USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1286 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 96 HIS : no HE2:sc= -1.09 X(o=-1.1,f=-1) USER MOD Set 1.2: A 168 SER OG : rot 151:sc= 0.00771 USER MOD Set 2.1: A 60 HIS : no HD1:sc= -0.209 X(o=0.052,f=0.47) USER MOD Set 2.2: A 80 HIS : no HE2:sc= -0.169 K(o=0.052,f=-2.9) USER MOD Set 2.3: A 83 THR OG1 : rot -36:sc= 0.431 USER MOD Set 3.1: A 51 TYR OH : rot 165:sc= -0.814 USER MOD Set 3.2: A 176 THR OG1 : rot 40:sc= 0.215 USER MOD Set 4.1: A 11 GLN : amide:sc= 0.217 K(o=0.39,f=-0.52) USER MOD Set 4.2: A 15 ASN : amide:sc= 0.176 K(o=0.39,f=-0.52) USER MOD Single : A 5 THR OG1 : rot 32:sc= 0.167 USER MOD Single : A 10 THR OG1 : rot 70:sc= 1.17 USER MOD Single : A 13 GLN :FLIP amide:sc= 0 F(o=-0.52,f=0) USER MOD Single : A 19 LYS NZ :NH3+ -122:sc= 1.22 (180deg=-0.118) USER MOD Single : A 24 SER OG : rot 93:sc= 0.834 USER MOD Single : A 26 HIS : no HD1:sc= -0.92 K(o=-0.92,f=-3.7!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 29 SER OG : rot -18:sc= 0.00891 USER MOD Single : A 43 SER OG : rot 116:sc= 0.531 USER MOD Single : A 44 TYR OH : rot 180:sc= -0.118 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 39:sc= 0.539 USER MOD Single : A 65 SER OG : rot 39:sc= 0.12 USER MOD Single : A 70 THR OG1 : rot -123:sc= 0.412 USER MOD Single : A 71 SER OG : rot 150:sc= 0 USER MOD Single : A 75 THR OG1 : rot -49:sc= -0.0586 USER MOD Single : A 78 TYR OH : rot 50:sc= 0.0955 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN :FLIP amide:sc= 0 F(o=-0.62,f=0) USER MOD Single : A 105 SER OG : rot -37:sc= 0.627 USER MOD Single : A 107 THR OG1 : rot -52:sc= 0.161 USER MOD Single : A 115 LYS NZ :NH3+ 173:sc= 0.315 (180deg=0.293) USER MOD Single : A 116 THR OG1 : rot -68:sc= 1.25 USER MOD Single : A 117 THR OG1 : rot 81:sc= 0.264 USER MOD Single : A 119 GLN : amide:sc= -0.187 X(o=-0.19,f=0) USER MOD Single : A 120 GLN : amide:sc= -1.67 X(o=-1.7,f=-1.4) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot -9:sc= 0.117 USER MOD Single : A 128 MET CE :methyl -158:sc= -0.0867 (180deg=-0.635) USER MOD Single : A 137 SER OG : rot 6:sc= 0.435 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN :FLIP amide:sc= 0.0904 F(o=-3.1!,f=0.09) USER MOD Single : A 150 TYR OH : rot -131:sc= -0.216 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 154 CYS SG : rot -164:sc= -2.05! USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 82:sc= 1.17 USER MOD Single : A 159 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 CYS SG : rot 180:sc= 0.0975 USER MOD Single : A 169 ASN : amide:sc= -0.102 K(o=-0.1,f=-3.5!) USER MOD Single : A 173 THR OG1 : rot -120:sc= -0.321 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -13.846 4.255 -15.018 1.00 73.11 N ATOM 60 CA THR A 5 -13.853 3.037 -14.209 1.00 60.32 C ATOM 61 C THR A 5 -12.626 2.137 -14.540 1.00 21.43 C ATOM 62 O THR A 5 -11.874 1.746 -13.638 1.00 23.02 O ATOM 63 CB THR A 5 -15.196 2.274 -14.464 1.00 5.10 C ATOM 64 OG1 THR A 5 -16.308 3.163 -14.231 1.00 70.11 O ATOM 65 CG2 THR A 5 -15.357 1.026 -13.584 1.00 55.44 C ATOM 0 HA THR A 5 -13.779 3.301 -13.154 1.00 60.32 H new ATOM 0 HB THR A 5 -15.175 1.938 -15.501 1.00 5.10 H new ATOM 0 HG1 THR A 5 -16.050 4.079 -14.467 1.00 70.11 H new ATOM 0 HG21 THR A 5 -16.308 0.542 -13.809 1.00 55.44 H new ATOM 0 HG22 THR A 5 -14.541 0.332 -13.784 1.00 55.44 H new ATOM 0 HG23 THR A 5 -15.337 1.316 -12.534 1.00 55.44 H new ATOM 73 N GLU A 6 -12.397 1.860 -15.845 1.00 72.13 N ATOM 74 CA GLU A 6 -11.394 0.856 -16.295 1.00 64.51 C ATOM 75 C GLU A 6 -9.960 1.420 -16.360 1.00 44.54 C ATOM 76 O GLU A 6 -9.042 0.670 -16.686 1.00 64.23 O ATOM 77 CB GLU A 6 -11.795 0.265 -17.675 1.00 21.15 C ATOM 78 CG GLU A 6 -11.627 1.235 -18.862 1.00 61.30 C ATOM 79 CD GLU A 6 -12.085 0.657 -20.206 1.00 50.04 C ATOM 80 OE1 GLU A 6 -11.379 -0.216 -20.762 1.00 14.31 O ATOM 81 OE2 GLU A 6 -13.155 1.064 -20.712 1.00 41.04 O ATOM 0 H GLU A 6 -12.893 2.317 -16.610 1.00 72.13 H new ATOM 0 HA GLU A 6 -11.392 0.067 -15.543 1.00 64.51 H new ATOM 0 HB2 GLU A 6 -11.195 -0.625 -17.863 1.00 21.15 H new ATOM 0 HB3 GLU A 6 -12.836 -0.056 -17.630 1.00 21.15 H new ATOM 0 HG2 GLU A 6 -12.191 2.145 -18.658 1.00 61.30 H new ATOM 0 HG3 GLU A 6 -10.578 1.521 -18.939 1.00 61.30 H new ATOM 88 N ASP A 7 -9.778 2.723 -16.018 1.00 2.30 N ATOM 89 CA ASP A 7 -8.429 3.376 -15.961 1.00 21.43 C ATOM 90 C ASP A 7 -7.536 2.614 -14.977 1.00 64.44 C ATOM 91 O ASP A 7 -6.329 2.455 -15.181 1.00 62.44 O ATOM 92 CB ASP A 7 -8.502 4.871 -15.514 1.00 71.33 C ATOM 93 CG ASP A 7 -9.038 5.835 -16.585 1.00 31.11 C ATOM 94 OD1 ASP A 7 -8.626 5.738 -17.763 1.00 2.43 O ATOM 95 OD2 ASP A 7 -9.843 6.720 -16.244 1.00 32.43 O ATOM 0 H ASP A 7 -10.546 3.349 -15.776 1.00 2.30 H new ATOM 0 HA ASP A 7 -8.018 3.349 -16.970 1.00 21.43 H new ATOM 0 HB2 ASP A 7 -9.136 4.942 -14.631 1.00 71.33 H new ATOM 0 HB3 ASP A 7 -7.505 5.197 -15.217 1.00 71.33 H new ATOM 100 N TRP A 8 -8.197 2.178 -13.905 1.00 32.25 N ATOM 101 CA TRP A 8 -7.668 1.299 -12.867 1.00 33.13 C ATOM 102 C TRP A 8 -6.992 0.037 -13.451 1.00 3.11 C ATOM 103 O TRP A 8 -5.895 -0.317 -13.040 1.00 74.31 O ATOM 104 CB TRP A 8 -8.853 0.913 -11.958 1.00 62.33 C ATOM 105 CG TRP A 8 -8.527 -0.028 -10.835 1.00 12.34 C ATOM 106 CD1 TRP A 8 -7.683 0.206 -9.790 1.00 52.14 C ATOM 107 CD2 TRP A 8 -9.074 -1.336 -10.629 1.00 23.12 C ATOM 108 NE1 TRP A 8 -7.683 -0.865 -8.951 1.00 10.22 N ATOM 109 CE2 TRP A 8 -8.516 -1.830 -9.445 1.00 64.41 C ATOM 110 CE3 TRP A 8 -9.979 -2.136 -11.333 1.00 22.11 C ATOM 111 CZ2 TRP A 8 -8.835 -3.080 -8.942 1.00 2.23 C ATOM 112 CZ3 TRP A 8 -10.294 -3.382 -10.832 1.00 64.44 C ATOM 113 CH2 TRP A 8 -9.721 -3.843 -9.646 1.00 33.33 C ATOM 0 H TRP A 8 -9.166 2.443 -13.730 1.00 32.25 H new ATOM 0 HA TRP A 8 -6.891 1.819 -12.307 1.00 33.13 H new ATOM 0 HB2 TRP A 8 -9.275 1.824 -11.534 1.00 62.33 H new ATOM 0 HB3 TRP A 8 -9.629 0.460 -12.575 1.00 62.33 H new ATOM 0 HD1 TRP A 8 -7.102 1.106 -9.650 1.00 52.14 H new ATOM 0 HE1 TRP A 8 -7.145 -0.937 -8.087 1.00 10.22 H new ATOM 0 HE3 TRP A 8 -10.423 -1.785 -12.253 1.00 22.11 H new ATOM 0 HZ2 TRP A 8 -8.397 -3.439 -8.023 1.00 2.23 H new ATOM 0 HZ3 TRP A 8 -10.993 -4.009 -11.365 1.00 64.44 H new ATOM 0 HH2 TRP A 8 -9.984 -4.824 -9.278 1.00 33.33 H new ATOM 124 N GLU A 9 -7.673 -0.622 -14.409 1.00 72.35 N ATOM 125 CA GLU A 9 -7.199 -1.878 -15.035 1.00 13.35 C ATOM 126 C GLU A 9 -6.217 -1.599 -16.195 1.00 15.41 C ATOM 127 O GLU A 9 -5.291 -2.383 -16.441 1.00 11.23 O ATOM 128 CB GLU A 9 -8.416 -2.687 -15.535 1.00 45.45 C ATOM 129 CG GLU A 9 -8.073 -4.046 -16.170 1.00 24.32 C ATOM 130 CD GLU A 9 -9.309 -4.771 -16.711 1.00 1.50 C ATOM 131 OE1 GLU A 9 -9.742 -4.456 -17.841 1.00 72.30 O ATOM 132 OE2 GLU A 9 -9.868 -5.635 -15.998 1.00 15.30 O ATOM 0 H GLU A 9 -8.570 -0.300 -14.773 1.00 72.35 H new ATOM 0 HA GLU A 9 -6.657 -2.457 -14.287 1.00 13.35 H new ATOM 0 HB2 GLU A 9 -9.092 -2.854 -14.697 1.00 45.45 H new ATOM 0 HB3 GLU A 9 -8.957 -2.087 -16.266 1.00 45.45 H new ATOM 0 HG2 GLU A 9 -7.361 -3.895 -16.981 1.00 24.32 H new ATOM 0 HG3 GLU A 9 -7.582 -4.676 -15.428 1.00 24.32 H new ATOM 139 N THR A 10 -6.425 -0.462 -16.875 1.00 10.32 N ATOM 140 CA THR A 10 -5.616 -0.039 -18.032 1.00 62.34 C ATOM 141 C THR A 10 -4.163 0.216 -17.609 1.00 21.00 C ATOM 142 O THR A 10 -3.218 -0.188 -18.303 1.00 15.53 O ATOM 143 CB THR A 10 -6.238 1.236 -18.682 1.00 23.11 C ATOM 144 OG1 THR A 10 -7.595 0.955 -19.037 1.00 15.34 O ATOM 145 CG2 THR A 10 -5.468 1.717 -19.930 1.00 63.55 C ATOM 0 H THR A 10 -7.166 0.197 -16.637 1.00 10.32 H new ATOM 0 HA THR A 10 -5.615 -0.839 -18.772 1.00 62.34 H new ATOM 0 HB THR A 10 -6.179 2.040 -17.948 1.00 23.11 H new ATOM 0 HG1 THR A 10 -8.134 0.863 -18.223 1.00 15.34 H new ATOM 0 HG21 THR A 10 -5.951 2.606 -20.335 1.00 63.55 H new ATOM 0 HG22 THR A 10 -4.441 1.955 -19.654 1.00 63.55 H new ATOM 0 HG23 THR A 10 -5.468 0.929 -20.684 1.00 63.55 H new ATOM 153 N GLN A 11 -3.995 0.887 -16.456 1.00 52.41 N ATOM 154 CA GLN A 11 -2.681 1.037 -15.826 1.00 34.51 C ATOM 155 C GLN A 11 -2.192 -0.310 -15.261 1.00 44.55 C ATOM 156 O GLN A 11 -1.018 -0.612 -15.348 1.00 1.33 O ATOM 157 CB GLN A 11 -2.709 2.116 -14.709 1.00 62.34 C ATOM 158 CG GLN A 11 -3.531 1.756 -13.457 1.00 63.33 C ATOM 159 CD GLN A 11 -3.345 2.727 -12.292 1.00 1.33 C ATOM 160 OE1 GLN A 11 -2.458 2.549 -11.455 1.00 1.12 O ATOM 161 NE2 GLN A 11 -4.170 3.759 -12.226 1.00 25.22 N ATOM 0 H GLN A 11 -4.757 1.333 -15.945 1.00 52.41 H new ATOM 0 HA GLN A 11 -1.981 1.367 -16.594 1.00 34.51 H new ATOM 0 HB2 GLN A 11 -1.684 2.322 -14.402 1.00 62.34 H new ATOM 0 HB3 GLN A 11 -3.107 3.039 -15.130 1.00 62.34 H new ATOM 0 HG2 GLN A 11 -4.587 1.724 -13.725 1.00 63.33 H new ATOM 0 HG3 GLN A 11 -3.255 0.754 -13.129 1.00 63.33 H new ATOM 0 HE21 GLN A 11 -4.894 3.879 -12.934 1.00 25.22 H new ATOM 0 HE22 GLN A 11 -4.082 4.435 -11.467 1.00 25.22 H new ATOM 170 N LEU A 12 -3.133 -1.132 -14.750 1.00 71.32 N ATOM 171 CA LEU A 12 -2.827 -2.322 -13.928 1.00 34.24 C ATOM 172 C LEU A 12 -2.206 -3.467 -14.741 1.00 1.22 C ATOM 173 O LEU A 12 -1.414 -4.248 -14.200 1.00 2.35 O ATOM 174 CB LEU A 12 -4.109 -2.784 -13.213 1.00 61.44 C ATOM 175 CG LEU A 12 -4.004 -4.004 -12.260 1.00 3.11 C ATOM 176 CD1 LEU A 12 -2.968 -3.773 -11.133 1.00 30.31 C ATOM 177 CD2 LEU A 12 -5.396 -4.352 -11.700 1.00 35.12 C ATOM 0 H LEU A 12 -4.132 -0.988 -14.897 1.00 71.32 H new ATOM 0 HA LEU A 12 -2.074 -2.037 -13.193 1.00 34.24 H new ATOM 0 HB2 LEU A 12 -4.494 -1.942 -12.638 1.00 61.44 H new ATOM 0 HB3 LEU A 12 -4.853 -3.017 -13.975 1.00 61.44 H new ATOM 0 HG LEU A 12 -3.641 -4.857 -12.834 1.00 3.11 H new ATOM 0 HD11 LEU A 12 -2.928 -4.652 -10.490 1.00 30.31 H new ATOM 0 HD12 LEU A 12 -1.986 -3.599 -11.572 1.00 30.31 H new ATOM 0 HD13 LEU A 12 -3.260 -2.905 -10.542 1.00 30.31 H new ATOM 0 HD21 LEU A 12 -5.315 -5.209 -11.032 1.00 35.12 H new ATOM 0 HD22 LEU A 12 -5.790 -3.498 -11.149 1.00 35.12 H new ATOM 0 HD23 LEU A 12 -6.069 -4.595 -12.522 1.00 35.12 H new ATOM 189 N GLN A 13 -2.548 -3.561 -16.036 1.00 51.10 N ATOM 190 CA GLN A 13 -1.910 -4.534 -16.950 1.00 54.14 C ATOM 191 C GLN A 13 -0.407 -4.208 -17.134 1.00 54.41 C ATOM 192 O GLN A 13 0.387 -5.081 -17.493 1.00 61.22 O ATOM 193 CB GLN A 13 -2.665 -4.573 -18.310 1.00 64.04 C ATOM 194 CG GLN A 13 -2.591 -3.281 -19.145 1.00 1.03 C ATOM 195 CD GLN A 13 -3.444 -3.302 -20.423 1.00 35.01 C ATOM 196 OE1 GLN A 13 -4.625 -3.909 -20.369 1.00 3.44 O flip ATOM 197 NE2 GLN A 13 -3.060 -2.732 -21.442 1.00 11.12 N flip ATOM 0 H GLN A 13 -3.260 -2.979 -16.477 1.00 51.10 H new ATOM 0 HA GLN A 13 -1.974 -5.528 -16.508 1.00 54.14 H new ATOM 0 HB2 GLN A 13 -2.264 -5.393 -18.905 1.00 64.04 H new ATOM 0 HB3 GLN A 13 -3.713 -4.801 -18.118 1.00 64.04 H new ATOM 0 HG2 GLN A 13 -2.909 -2.443 -18.524 1.00 1.03 H new ATOM 0 HG3 GLN A 13 -1.552 -3.099 -19.419 1.00 1.03 H new ATOM 0 HE21 GLN A 13 -2.149 -2.274 -21.457 1.00 11.12 H new ATOM 0 HE22 GLN A 13 -3.652 -2.717 -22.272 1.00 11.12 H new ATOM 206 N ALA A 14 -0.045 -2.939 -16.863 1.00 11.13 N ATOM 207 CA ALA A 14 1.351 -2.468 -16.824 1.00 43.14 C ATOM 208 C ALA A 14 1.928 -2.566 -15.388 1.00 4.14 C ATOM 209 O ALA A 14 3.106 -2.886 -15.214 1.00 32.32 O ATOM 210 CB ALA A 14 1.415 -1.026 -17.342 1.00 25.35 C ATOM 0 H ALA A 14 -0.723 -2.204 -16.663 1.00 11.13 H new ATOM 0 HA ALA A 14 1.960 -3.105 -17.466 1.00 43.14 H new ATOM 0 HB1 ALA A 14 2.447 -0.675 -17.314 1.00 25.35 H new ATOM 0 HB2 ALA A 14 1.047 -0.991 -18.367 1.00 25.35 H new ATOM 0 HB3 ALA A 14 0.797 -0.386 -16.713 1.00 25.35 H new ATOM 216 N ASN A 15 1.071 -2.282 -14.369 1.00 64.45 N ATOM 217 CA ASN A 15 1.455 -2.311 -12.930 1.00 73.12 C ATOM 218 C ASN A 15 1.946 -3.698 -12.508 1.00 55.13 C ATOM 219 O ASN A 15 2.939 -3.816 -11.796 1.00 1.14 O ATOM 220 CB ASN A 15 0.284 -1.873 -12.001 1.00 35.22 C ATOM 221 CG ASN A 15 -0.066 -0.380 -12.068 1.00 54.35 C ATOM 222 OD1 ASN A 15 0.165 0.292 -13.059 1.00 71.24 O ATOM 223 ND2 ASN A 15 -0.659 0.139 -11.008 1.00 70.24 N ATOM 0 H ASN A 15 0.095 -2.027 -14.522 1.00 64.45 H new ATOM 0 HA ASN A 15 2.269 -1.595 -12.819 1.00 73.12 H new ATOM 0 HB2 ASN A 15 -0.603 -2.452 -12.260 1.00 35.22 H new ATOM 0 HB3 ASN A 15 0.541 -2.126 -10.972 1.00 35.22 H new ATOM 0 HD21 ASN A 15 -0.934 1.121 -11.007 1.00 70.24 H new ATOM 0 HD22 ASN A 15 -0.842 -0.442 -10.190 1.00 70.24 H new ATOM 230 N ARG A 16 1.253 -4.743 -12.970 1.00 72.42 N ATOM 231 CA ARG A 16 1.622 -6.134 -12.653 1.00 30.14 C ATOM 232 C ARG A 16 3.042 -6.457 -13.149 1.00 20.30 C ATOM 233 O ARG A 16 3.785 -7.175 -12.481 1.00 52.42 O ATOM 234 CB ARG A 16 0.607 -7.134 -13.257 1.00 25.44 C ATOM 235 CG ARG A 16 0.509 -7.120 -14.796 1.00 31.13 C ATOM 236 CD ARG A 16 -0.358 -8.264 -15.337 1.00 22.45 C ATOM 237 NE ARG A 16 -1.732 -8.238 -14.799 1.00 52.43 N ATOM 238 CZ ARG A 16 -2.352 -9.260 -14.176 1.00 44.52 C ATOM 239 NH1 ARG A 16 -1.737 -10.429 -13.994 1.00 44.40 N ATOM 240 NH2 ARG A 16 -3.584 -9.089 -13.726 1.00 60.14 N ATOM 0 H ARG A 16 0.430 -4.656 -13.567 1.00 72.42 H new ATOM 0 HA ARG A 16 1.602 -6.237 -11.568 1.00 30.14 H new ATOM 0 HB2 ARG A 16 0.877 -8.140 -12.935 1.00 25.44 H new ATOM 0 HB3 ARG A 16 -0.379 -6.921 -12.844 1.00 25.44 H new ATOM 0 HG2 ARG A 16 0.093 -6.167 -15.122 1.00 31.13 H new ATOM 0 HG3 ARG A 16 1.510 -7.193 -15.222 1.00 31.13 H new ATOM 0 HD2 ARG A 16 -0.396 -8.203 -16.425 1.00 22.45 H new ATOM 0 HD3 ARG A 16 0.108 -9.217 -15.088 1.00 22.45 H new ATOM 0 HE ARG A 16 -2.258 -7.371 -14.908 1.00 52.43 H new ATOM 0 HH11 ARG A 16 -0.782 -10.561 -14.328 1.00 44.40 H new ATOM 0 HH12 ARG A 16 -2.221 -11.192 -13.520 1.00 44.40 H new ATOM 0 HH21 ARG A 16 -4.053 -8.192 -13.852 1.00 60.14 H new ATOM 0 HH22 ARG A 16 -4.065 -9.854 -13.253 1.00 60.14 H new ATOM 254 N ASP A 17 3.408 -5.859 -14.300 1.00 63.21 N ATOM 255 CA ASP A 17 4.684 -6.106 -14.978 1.00 53.45 C ATOM 256 C ASP A 17 5.833 -5.410 -14.235 1.00 74.45 C ATOM 257 O ASP A 17 6.826 -6.052 -13.882 1.00 51.25 O ATOM 258 CB ASP A 17 4.593 -5.621 -16.447 1.00 64.25 C ATOM 259 CG ASP A 17 5.836 -5.981 -17.283 1.00 53.45 C ATOM 260 OD1 ASP A 17 6.803 -5.193 -17.316 1.00 14.10 O ATOM 261 OD2 ASP A 17 5.848 -7.065 -17.913 1.00 62.30 O ATOM 0 H ASP A 17 2.816 -5.185 -14.785 1.00 63.21 H new ATOM 0 HA ASP A 17 4.891 -7.176 -14.976 1.00 53.45 H new ATOM 0 HB2 ASP A 17 3.710 -6.059 -16.913 1.00 64.25 H new ATOM 0 HB3 ASP A 17 4.456 -4.540 -16.458 1.00 64.25 H new ATOM 266 N GLU A 18 5.666 -4.097 -13.977 1.00 32.50 N ATOM 267 CA GLU A 18 6.697 -3.261 -13.332 1.00 21.02 C ATOM 268 C GLU A 18 7.003 -3.720 -11.893 1.00 40.31 C ATOM 269 O GLU A 18 8.151 -3.636 -11.456 1.00 52.24 O ATOM 270 CB GLU A 18 6.273 -1.767 -13.336 1.00 35.10 C ATOM 271 CG GLU A 18 4.943 -1.496 -12.606 1.00 42.21 C ATOM 272 CD GLU A 18 4.591 -0.017 -12.456 1.00 72.21 C ATOM 273 OE1 GLU A 18 3.966 0.558 -13.367 1.00 1.14 O ATOM 274 OE2 GLU A 18 4.930 0.573 -11.409 1.00 3.13 O ATOM 0 H GLU A 18 4.814 -3.588 -14.210 1.00 32.50 H new ATOM 0 HA GLU A 18 7.610 -3.376 -13.916 1.00 21.02 H new ATOM 0 HB2 GLU A 18 7.060 -1.174 -12.870 1.00 35.10 H new ATOM 0 HB3 GLU A 18 6.186 -1.426 -14.368 1.00 35.10 H new ATOM 0 HG2 GLU A 18 4.139 -1.995 -13.147 1.00 42.21 H new ATOM 0 HG3 GLU A 18 4.989 -1.948 -11.615 1.00 42.21 H new ATOM 281 N LYS A 19 5.980 -4.206 -11.165 1.00 53.33 N ATOM 282 CA LYS A 19 6.149 -4.688 -9.776 1.00 4.42 C ATOM 283 C LYS A 19 6.771 -6.092 -9.761 1.00 32.25 C ATOM 284 O LYS A 19 7.490 -6.452 -8.822 1.00 10.22 O ATOM 285 CB LYS A 19 4.797 -4.690 -9.012 1.00 45.34 C ATOM 286 CG LYS A 19 4.078 -3.325 -8.968 1.00 14.13 C ATOM 287 CD LYS A 19 4.933 -2.192 -8.357 1.00 1.02 C ATOM 288 CE LYS A 19 4.186 -0.844 -8.361 1.00 54.34 C ATOM 289 NZ LYS A 19 5.036 0.289 -7.899 1.00 3.24 N ATOM 0 H LYS A 19 5.024 -4.276 -11.515 1.00 53.33 H new ATOM 0 HA LYS A 19 6.825 -4.001 -9.267 1.00 4.42 H new ATOM 0 HB2 LYS A 19 4.134 -5.420 -9.477 1.00 45.34 H new ATOM 0 HB3 LYS A 19 4.973 -5.025 -7.990 1.00 45.34 H new ATOM 0 HG2 LYS A 19 3.789 -3.044 -9.981 1.00 14.13 H new ATOM 0 HG3 LYS A 19 3.159 -3.427 -8.390 1.00 14.13 H new ATOM 0 HD2 LYS A 19 5.205 -2.453 -7.334 1.00 1.02 H new ATOM 0 HD3 LYS A 19 5.862 -2.094 -8.919 1.00 1.02 H new ATOM 0 HE2 LYS A 19 3.827 -0.636 -9.369 1.00 54.34 H new ATOM 0 HE3 LYS A 19 3.308 -0.919 -7.719 1.00 54.34 H new ATOM 0 HZ1 LYS A 19 4.590 0.745 -7.078 1.00 3.24 H new ATOM 0 HZ2 LYS A 19 5.974 -0.069 -7.629 1.00 3.24 H new ATOM 0 HZ3 LYS A 19 5.138 0.982 -8.667 1.00 3.24 H new ATOM 303 N ASP A 20 6.491 -6.865 -10.823 1.00 14.22 N ATOM 304 CA ASP A 20 7.041 -8.223 -11.005 1.00 25.42 C ATOM 305 C ASP A 20 8.555 -8.155 -11.273 1.00 50.30 C ATOM 306 O ASP A 20 9.321 -8.977 -10.758 1.00 73.43 O ATOM 307 CB ASP A 20 6.301 -8.959 -12.153 1.00 11.21 C ATOM 308 CG ASP A 20 6.711 -10.432 -12.308 1.00 3.23 C ATOM 309 OD1 ASP A 20 6.178 -11.289 -11.559 1.00 5.53 O ATOM 310 OD2 ASP A 20 7.566 -10.742 -13.173 1.00 34.14 O ATOM 0 H ASP A 20 5.877 -6.568 -11.581 1.00 14.22 H new ATOM 0 HA ASP A 20 6.885 -8.791 -10.088 1.00 25.42 H new ATOM 0 HB2 ASP A 20 5.227 -8.907 -11.973 1.00 11.21 H new ATOM 0 HB3 ASP A 20 6.493 -8.437 -13.090 1.00 11.21 H new ATOM 315 N ARG A 21 8.982 -7.129 -12.045 1.00 15.24 N ATOM 316 CA ARG A 21 10.406 -6.920 -12.380 1.00 14.03 C ATOM 317 C ARG A 21 11.109 -6.038 -11.332 1.00 52.43 C ATOM 318 O ARG A 21 12.330 -5.992 -11.301 1.00 21.35 O ATOM 319 CB ARG A 21 10.581 -6.370 -13.835 1.00 44.14 C ATOM 320 CG ARG A 21 9.899 -5.019 -14.193 1.00 74.52 C ATOM 321 CD ARG A 21 10.622 -3.762 -13.659 1.00 53.52 C ATOM 322 NE ARG A 21 12.029 -3.675 -14.097 1.00 53.44 N ATOM 323 CZ ARG A 21 12.919 -2.757 -13.663 1.00 45.31 C ATOM 324 NH1 ARG A 21 12.575 -1.837 -12.759 1.00 1.31 N ATOM 325 NH2 ARG A 21 14.154 -2.769 -14.147 1.00 64.12 N ATOM 0 H ARG A 21 8.356 -6.432 -12.448 1.00 15.24 H new ATOM 0 HA ARG A 21 10.897 -7.893 -12.352 1.00 14.03 H new ATOM 0 HB2 ARG A 21 11.649 -6.266 -14.026 1.00 44.14 H new ATOM 0 HB3 ARG A 21 10.206 -7.126 -14.525 1.00 44.14 H new ATOM 0 HG2 ARG A 21 9.824 -4.943 -15.278 1.00 74.52 H new ATOM 0 HG3 ARG A 21 8.881 -5.028 -13.803 1.00 74.52 H new ATOM 0 HD2 ARG A 21 10.088 -2.873 -13.994 1.00 53.52 H new ATOM 0 HD3 ARG A 21 10.586 -3.764 -12.570 1.00 53.52 H new ATOM 0 HE ARG A 21 12.353 -4.360 -14.779 1.00 53.44 H new ATOM 0 HH11 ARG A 21 11.626 -1.820 -12.384 1.00 1.31 H new ATOM 0 HH12 ARG A 21 13.261 -1.151 -12.443 1.00 1.31 H new ATOM 0 HH21 ARG A 21 14.423 -3.467 -14.840 1.00 64.12 H new ATOM 0 HH22 ARG A 21 14.834 -2.080 -13.826 1.00 64.12 H new ATOM 339 N PHE A 22 10.325 -5.299 -10.517 1.00 14.02 N ATOM 340 CA PHE A 22 10.841 -4.536 -9.350 1.00 53.32 C ATOM 341 C PHE A 22 11.602 -5.483 -8.410 1.00 21.24 C ATOM 342 O PHE A 22 12.779 -5.288 -8.125 1.00 32.44 O ATOM 343 CB PHE A 22 9.652 -3.863 -8.602 1.00 1.14 C ATOM 344 CG PHE A 22 10.019 -2.925 -7.445 1.00 50.23 C ATOM 345 CD1 PHE A 22 10.249 -3.418 -6.157 1.00 41.50 C ATOM 346 CD2 PHE A 22 10.109 -1.547 -7.642 1.00 71.31 C ATOM 347 CE1 PHE A 22 10.559 -2.572 -5.113 1.00 4.23 C ATOM 348 CE2 PHE A 22 10.415 -0.702 -6.595 1.00 73.22 C ATOM 349 CZ PHE A 22 10.640 -1.216 -5.330 1.00 60.23 C ATOM 0 H PHE A 22 9.317 -5.212 -10.646 1.00 14.02 H new ATOM 0 HA PHE A 22 11.525 -3.760 -9.692 1.00 53.32 H new ATOM 0 HB2 PHE A 22 9.067 -3.298 -9.328 1.00 1.14 H new ATOM 0 HB3 PHE A 22 9.004 -4.649 -8.213 1.00 1.14 H new ATOM 0 HD1 PHE A 22 10.183 -4.481 -5.976 1.00 41.50 H new ATOM 0 HD2 PHE A 22 9.937 -1.136 -8.626 1.00 71.31 H new ATOM 0 HE1 PHE A 22 10.738 -2.973 -4.126 1.00 4.23 H new ATOM 0 HE2 PHE A 22 10.479 0.363 -6.763 1.00 73.22 H new ATOM 0 HZ PHE A 22 10.879 -0.552 -4.513 1.00 60.23 H new ATOM 359 N PHE A 23 10.903 -6.551 -8.000 1.00 32.42 N ATOM 360 CA PHE A 23 11.427 -7.576 -7.073 1.00 43.42 C ATOM 361 C PHE A 23 12.512 -8.470 -7.737 1.00 5.30 C ATOM 362 O PHE A 23 13.161 -9.274 -7.053 1.00 70.11 O ATOM 363 CB PHE A 23 10.241 -8.441 -6.538 1.00 14.00 C ATOM 364 CG PHE A 23 9.289 -7.715 -5.556 1.00 2.15 C ATOM 365 CD1 PHE A 23 8.657 -6.516 -5.897 1.00 23.02 C ATOM 366 CD2 PHE A 23 9.037 -8.232 -4.286 1.00 14.33 C ATOM 367 CE1 PHE A 23 7.813 -5.868 -5.005 1.00 62.41 C ATOM 368 CE2 PHE A 23 8.198 -7.583 -3.393 1.00 15.25 C ATOM 369 CZ PHE A 23 7.588 -6.403 -3.752 1.00 35.23 C ATOM 0 H PHE A 23 9.947 -6.734 -8.304 1.00 32.42 H new ATOM 0 HA PHE A 23 11.913 -7.067 -6.241 1.00 43.42 H new ATOM 0 HB2 PHE A 23 9.659 -8.797 -7.388 1.00 14.00 H new ATOM 0 HB3 PHE A 23 10.649 -9.321 -6.041 1.00 14.00 H new ATOM 0 HD1 PHE A 23 8.828 -6.085 -6.873 1.00 23.02 H new ATOM 0 HD2 PHE A 23 9.506 -9.159 -3.991 1.00 14.33 H new ATOM 0 HE1 PHE A 23 7.332 -4.944 -5.291 1.00 62.41 H new ATOM 0 HE2 PHE A 23 8.023 -8.004 -2.414 1.00 15.25 H new ATOM 0 HZ PHE A 23 6.935 -5.897 -3.056 1.00 35.23 H new ATOM 379 N SER A 24 12.688 -8.320 -9.069 1.00 20.45 N ATOM 380 CA SER A 24 13.661 -9.098 -9.858 1.00 30.53 C ATOM 381 C SER A 24 14.908 -8.274 -10.243 1.00 33.31 C ATOM 382 O SER A 24 15.994 -8.845 -10.404 1.00 53.11 O ATOM 383 CB SER A 24 12.980 -9.618 -11.144 1.00 72.41 C ATOM 384 OG SER A 24 11.819 -10.373 -10.848 1.00 13.51 O ATOM 0 H SER A 24 12.155 -7.652 -9.626 1.00 20.45 H new ATOM 0 HA SER A 24 13.995 -9.926 -9.233 1.00 30.53 H new ATOM 0 HB2 SER A 24 12.714 -8.775 -11.782 1.00 72.41 H new ATOM 0 HB3 SER A 24 13.683 -10.234 -11.705 1.00 72.41 H new ATOM 0 HG SER A 24 11.035 -9.786 -10.861 1.00 13.51 H new ATOM 390 N GLU A 25 14.760 -6.940 -10.415 1.00 51.21 N ATOM 391 CA GLU A 25 15.812 -6.082 -11.019 1.00 73.35 C ATOM 392 C GLU A 25 16.178 -4.923 -10.072 1.00 11.41 C ATOM 393 O GLU A 25 17.353 -4.743 -9.737 1.00 34.23 O ATOM 394 CB GLU A 25 15.344 -5.505 -12.391 1.00 33.23 C ATOM 395 CG GLU A 25 15.002 -6.557 -13.469 1.00 75.04 C ATOM 396 CD GLU A 25 14.642 -5.937 -14.832 1.00 21.12 C ATOM 397 OE1 GLU A 25 15.480 -5.204 -15.397 1.00 54.32 O ATOM 398 OE2 GLU A 25 13.521 -6.156 -15.339 1.00 51.24 O ATOM 0 H GLU A 25 13.919 -6.430 -10.143 1.00 51.21 H new ATOM 0 HA GLU A 25 16.692 -6.704 -11.181 1.00 73.35 H new ATOM 0 HB2 GLU A 25 14.465 -4.882 -12.223 1.00 33.23 H new ATOM 0 HB3 GLU A 25 16.127 -4.854 -12.778 1.00 33.23 H new ATOM 0 HG2 GLU A 25 15.852 -7.227 -13.596 1.00 75.04 H new ATOM 0 HG3 GLU A 25 14.166 -7.165 -13.122 1.00 75.04 H new ATOM 405 N HIS A 26 15.153 -4.146 -9.644 1.00 30.23 N ATOM 406 CA HIS A 26 15.352 -2.952 -8.791 1.00 54.22 C ATOM 407 C HIS A 26 15.872 -3.397 -7.417 1.00 23.42 C ATOM 408 O HIS A 26 16.958 -3.007 -6.978 1.00 12.13 O ATOM 409 CB HIS A 26 14.024 -2.150 -8.638 1.00 41.42 C ATOM 410 CG HIS A 26 14.093 -1.048 -7.600 1.00 72.12 C ATOM 411 ND1 HIS A 26 13.854 -1.309 -6.268 1.00 74.42 N ATOM 412 CD2 HIS A 26 14.420 0.259 -7.734 1.00 42.21 C ATOM 413 CE1 HIS A 26 14.046 -0.171 -5.631 1.00 74.43 C ATOM 414 NE2 HIS A 26 14.390 0.806 -6.475 1.00 25.22 N ATOM 0 H HIS A 26 14.177 -4.327 -9.878 1.00 30.23 H new ATOM 0 HA HIS A 26 16.083 -2.295 -9.262 1.00 54.22 H new ATOM 0 HB2 HIS A 26 13.761 -1.713 -9.601 1.00 41.42 H new ATOM 0 HB3 HIS A 26 13.223 -2.839 -8.371 1.00 41.42 H new ATOM 0 HD2 HIS A 26 14.658 0.772 -8.654 1.00 42.21 H new ATOM 0 HE1 HIS A 26 13.939 -0.045 -4.564 1.00 74.43 H new ATOM 0 HE2 HIS A 26 14.592 1.775 -6.230 1.00 25.22 H new ATOM 422 N ARG A 27 15.050 -4.201 -6.753 1.00 1.22 N ATOM 423 CA ARG A 27 15.400 -4.922 -5.536 1.00 34.12 C ATOM 424 C ARG A 27 15.794 -6.357 -5.890 1.00 63.35 C ATOM 425 O ARG A 27 15.359 -6.900 -6.914 1.00 20.22 O ATOM 426 CB ARG A 27 14.185 -4.951 -4.551 1.00 44.42 C ATOM 427 CG ARG A 27 13.970 -3.673 -3.717 1.00 32.45 C ATOM 428 CD ARG A 27 15.165 -3.367 -2.799 1.00 34.52 C ATOM 429 NE ARG A 27 15.526 -4.514 -1.933 1.00 23.22 N ATOM 430 CZ ARG A 27 16.414 -4.471 -0.923 1.00 2.33 C ATOM 431 NH1 ARG A 27 17.051 -3.351 -0.613 1.00 63.12 N ATOM 432 NH2 ARG A 27 16.686 -5.566 -0.239 1.00 73.12 N ATOM 0 H ARG A 27 14.092 -4.374 -7.057 1.00 1.22 H new ATOM 0 HA ARG A 27 16.236 -4.414 -5.055 1.00 34.12 H new ATOM 0 HB2 ARG A 27 13.279 -5.144 -5.126 1.00 44.42 H new ATOM 0 HB3 ARG A 27 14.314 -5.791 -3.868 1.00 44.42 H new ATOM 0 HG2 ARG A 27 13.803 -2.829 -4.386 1.00 32.45 H new ATOM 0 HG3 ARG A 27 13.070 -3.783 -3.113 1.00 32.45 H new ATOM 0 HD2 ARG A 27 16.026 -3.092 -3.409 1.00 34.52 H new ATOM 0 HD3 ARG A 27 14.928 -2.506 -2.175 1.00 34.52 H new ATOM 0 HE ARG A 27 15.066 -5.405 -2.117 1.00 23.22 H new ATOM 0 HH11 ARG A 27 16.872 -2.499 -1.144 1.00 63.12 H new ATOM 0 HH12 ARG A 27 17.720 -3.341 0.157 1.00 63.12 H new ATOM 0 HH21 ARG A 27 16.223 -6.444 -0.476 1.00 73.12 H new ATOM 0 HH22 ARG A 27 17.359 -5.535 0.527 1.00 73.12 H new ATOM 446 N GLN A 28 16.652 -6.943 -5.050 1.00 55.22 N ATOM 447 CA GLN A 28 16.788 -8.406 -4.961 1.00 54.12 C ATOM 448 C GLN A 28 15.514 -8.977 -4.309 1.00 12.53 C ATOM 449 O GLN A 28 14.847 -8.263 -3.536 1.00 21.33 O ATOM 450 CB GLN A 28 18.052 -8.792 -4.145 1.00 14.14 C ATOM 451 CG GLN A 28 18.155 -8.104 -2.769 1.00 64.33 C ATOM 452 CD GLN A 28 19.378 -8.538 -1.960 1.00 34.51 C ATOM 453 OE1 GLN A 28 19.815 -9.682 -2.026 1.00 54.41 O ATOM 454 NE2 GLN A 28 19.965 -7.619 -1.223 1.00 33.41 N ATOM 0 H GLN A 28 17.266 -6.428 -4.419 1.00 55.22 H new ATOM 0 HA GLN A 28 16.907 -8.827 -5.959 1.00 54.12 H new ATOM 0 HB2 GLN A 28 18.060 -9.872 -3.999 1.00 14.14 H new ATOM 0 HB3 GLN A 28 18.937 -8.543 -4.730 1.00 14.14 H new ATOM 0 HG2 GLN A 28 18.189 -7.024 -2.913 1.00 64.33 H new ATOM 0 HG3 GLN A 28 17.254 -8.321 -2.195 1.00 64.33 H new ATOM 0 HE21 GLN A 28 19.582 -6.674 -1.185 1.00 33.41 H new ATOM 0 HE22 GLN A 28 20.803 -7.851 -0.690 1.00 33.41 H new ATOM 463 N SER A 29 15.176 -10.234 -4.647 1.00 11.14 N ATOM 464 CA SER A 29 13.966 -10.907 -4.142 1.00 40.53 C ATOM 465 C SER A 29 13.939 -10.926 -2.591 1.00 1.24 C ATOM 466 O SER A 29 14.864 -11.456 -1.973 1.00 51.43 O ATOM 467 CB SER A 29 13.909 -12.351 -4.703 1.00 33.34 C ATOM 468 OG SER A 29 14.001 -12.348 -6.117 1.00 4.03 O ATOM 0 H SER A 29 15.733 -10.811 -5.277 1.00 11.14 H new ATOM 0 HA SER A 29 13.091 -10.351 -4.479 1.00 40.53 H new ATOM 0 HB2 SER A 29 14.723 -12.941 -4.283 1.00 33.34 H new ATOM 0 HB3 SER A 29 12.978 -12.828 -4.396 1.00 33.34 H new ATOM 0 HG SER A 29 13.793 -11.453 -6.456 1.00 4.03 H new ATOM 474 N PRO A 30 12.878 -10.329 -1.945 1.00 64.13 N ATOM 475 CA PRO A 30 12.663 -10.426 -0.479 1.00 14.04 C ATOM 476 C PRO A 30 12.065 -11.783 -0.087 1.00 20.44 C ATOM 477 O PRO A 30 11.913 -12.079 1.094 1.00 75.44 O ATOM 478 CB PRO A 30 11.687 -9.263 -0.192 1.00 65.33 C ATOM 479 CG PRO A 30 10.890 -9.137 -1.447 1.00 3.12 C ATOM 480 CD PRO A 30 11.840 -9.468 -2.582 1.00 23.14 C ATOM 0 HA PRO A 30 13.586 -10.356 0.096 1.00 14.04 H new ATOM 0 HB2 PRO A 30 11.049 -9.480 0.665 1.00 65.33 H new ATOM 0 HB3 PRO A 30 12.222 -8.341 0.035 1.00 65.33 H new ATOM 0 HG2 PRO A 30 10.040 -9.819 -1.439 1.00 3.12 H new ATOM 0 HG3 PRO A 30 10.489 -8.129 -1.555 1.00 3.12 H new ATOM 0 HD2 PRO A 30 11.329 -9.991 -3.390 1.00 23.14 H new ATOM 0 HD3 PRO A 30 12.278 -8.567 -3.012 1.00 23.14 H new ATOM 488 N ILE A 31 11.672 -12.578 -1.106 1.00 30.15 N ATOM 489 CA ILE A 31 11.304 -13.992 -0.941 1.00 30.13 C ATOM 490 C ILE A 31 12.448 -14.737 -0.199 1.00 55.13 C ATOM 491 O ILE A 31 13.603 -14.651 -0.647 1.00 45.35 O ATOM 492 CB ILE A 31 11.028 -14.669 -2.343 1.00 44.30 C ATOM 493 CG1 ILE A 31 9.972 -13.856 -3.167 1.00 74.13 C ATOM 494 CG2 ILE A 31 10.590 -16.146 -2.189 1.00 51.33 C ATOM 495 CD1 ILE A 31 8.596 -13.718 -2.521 1.00 63.02 C ATOM 0 H ILE A 31 11.602 -12.250 -2.069 1.00 30.15 H new ATOM 0 HA ILE A 31 10.388 -14.053 -0.353 1.00 30.13 H new ATOM 0 HB ILE A 31 11.967 -14.661 -2.896 1.00 44.30 H new ATOM 0 HG12 ILE A 31 10.370 -12.858 -3.349 1.00 74.13 H new ATOM 0 HG13 ILE A 31 9.851 -14.333 -4.140 1.00 74.13 H new ATOM 0 HG21 ILE A 31 10.410 -16.577 -3.174 1.00 51.33 H new ATOM 0 HG22 ILE A 31 11.377 -16.708 -1.686 1.00 51.33 H new ATOM 0 HG23 ILE A 31 9.675 -16.194 -1.599 1.00 51.33 H new ATOM 0 HD11 ILE A 31 7.944 -13.138 -3.174 1.00 63.02 H new ATOM 0 HD12 ILE A 31 8.167 -14.708 -2.365 1.00 63.02 H new ATOM 0 HD13 ILE A 31 8.694 -13.209 -1.562 1.00 63.02 H new ATOM 507 N PRO A 32 12.143 -15.454 0.940 1.00 40.32 N ATOM 508 CA PRO A 32 13.174 -16.040 1.848 1.00 13.24 C ATOM 509 C PRO A 32 14.225 -16.915 1.119 1.00 41.44 C ATOM 510 O PRO A 32 13.887 -17.519 0.117 1.00 74.32 O ATOM 511 CB PRO A 32 12.329 -16.900 2.826 1.00 32.44 C ATOM 512 CG PRO A 32 10.972 -16.269 2.826 1.00 3.24 C ATOM 513 CD PRO A 32 10.766 -15.761 1.422 1.00 22.34 C ATOM 0 HA PRO A 32 13.769 -15.263 2.328 1.00 13.24 H new ATOM 0 HB2 PRO A 32 12.281 -17.938 2.498 1.00 32.44 H new ATOM 0 HB3 PRO A 32 12.763 -16.902 3.826 1.00 32.44 H new ATOM 0 HG2 PRO A 32 10.203 -16.992 3.099 1.00 3.24 H new ATOM 0 HG3 PRO A 32 10.917 -15.456 3.550 1.00 3.24 H new ATOM 0 HD2 PRO A 32 10.282 -16.509 0.795 1.00 22.34 H new ATOM 0 HD3 PRO A 32 10.132 -14.874 1.408 1.00 22.34 H new ATOM 521 N PRO A 33 15.509 -16.978 1.615 1.00 31.01 N ATOM 522 CA PRO A 33 16.581 -17.850 1.047 1.00 74.52 C ATOM 523 C PRO A 33 16.098 -19.291 0.776 1.00 3.11 C ATOM 524 O PRO A 33 16.249 -19.817 -0.330 1.00 35.52 O ATOM 525 CB PRO A 33 17.673 -17.836 2.148 1.00 12.14 C ATOM 526 CG PRO A 33 17.485 -16.539 2.877 1.00 13.20 C ATOM 527 CD PRO A 33 16.021 -16.156 2.747 1.00 73.55 C ATOM 0 HA PRO A 33 16.927 -17.489 0.078 1.00 74.52 H new ATOM 0 HB2 PRO A 33 17.563 -18.685 2.822 1.00 12.14 H new ATOM 0 HB3 PRO A 33 18.670 -17.902 1.713 1.00 12.14 H new ATOM 0 HG2 PRO A 33 17.763 -16.644 3.926 1.00 13.20 H new ATOM 0 HG3 PRO A 33 18.124 -15.764 2.454 1.00 13.20 H new ATOM 0 HD2 PRO A 33 15.475 -16.366 3.666 1.00 73.55 H new ATOM 0 HD3 PRO A 33 15.908 -15.091 2.545 1.00 73.55 H new ATOM 535 N GLU A 34 15.493 -19.882 1.820 1.00 3.33 N ATOM 536 CA GLU A 34 14.844 -21.209 1.783 1.00 61.30 C ATOM 537 C GLU A 34 13.789 -21.341 0.657 1.00 24.41 C ATOM 538 O GLU A 34 13.666 -22.400 0.040 1.00 24.55 O ATOM 539 CB GLU A 34 14.193 -21.484 3.173 1.00 4.13 C ATOM 540 CG GLU A 34 13.296 -20.331 3.689 1.00 24.43 C ATOM 541 CD GLU A 34 12.756 -20.546 5.110 1.00 31.25 C ATOM 542 OE1 GLU A 34 13.428 -20.137 6.086 1.00 24.43 O ATOM 543 OE2 GLU A 34 11.658 -21.116 5.262 1.00 10.42 O ATOM 0 H GLU A 34 15.439 -19.441 2.738 1.00 3.33 H new ATOM 0 HA GLU A 34 15.612 -21.950 1.562 1.00 61.30 H new ATOM 0 HB2 GLU A 34 13.596 -22.394 3.109 1.00 4.13 H new ATOM 0 HB3 GLU A 34 14.982 -21.670 3.902 1.00 4.13 H new ATOM 0 HG2 GLU A 34 13.866 -19.402 3.665 1.00 24.43 H new ATOM 0 HG3 GLU A 34 12.455 -20.206 3.007 1.00 24.43 H new ATOM 550 N GLU A 35 13.051 -20.255 0.384 1.00 65.31 N ATOM 551 CA GLU A 35 11.860 -20.289 -0.489 1.00 43.44 C ATOM 552 C GLU A 35 12.221 -19.862 -1.929 1.00 42.51 C ATOM 553 O GLU A 35 11.620 -20.351 -2.891 1.00 0.43 O ATOM 554 CB GLU A 35 10.737 -19.377 0.116 1.00 52.44 C ATOM 555 CG GLU A 35 9.290 -19.926 0.011 1.00 12.43 C ATOM 556 CD GLU A 35 8.796 -20.160 -1.433 1.00 44.44 C ATOM 557 OE1 GLU A 35 8.542 -19.163 -2.153 1.00 43.22 O ATOM 558 OE2 GLU A 35 8.674 -21.334 -1.856 1.00 32.23 O ATOM 0 H GLU A 35 13.259 -19.329 0.759 1.00 65.31 H new ATOM 0 HA GLU A 35 11.484 -21.311 -0.541 1.00 43.44 H new ATOM 0 HB2 GLU A 35 10.964 -19.204 1.168 1.00 52.44 H new ATOM 0 HB3 GLU A 35 10.775 -18.408 -0.382 1.00 52.44 H new ATOM 0 HG2 GLU A 35 9.232 -20.867 0.558 1.00 12.43 H new ATOM 0 HG3 GLU A 35 8.614 -19.228 0.504 1.00 12.43 H new ATOM 565 N ARG A 36 13.254 -19.007 -2.073 1.00 55.34 N ATOM 566 CA ARG A 36 13.550 -18.302 -3.338 1.00 14.11 C ATOM 567 C ARG A 36 14.119 -19.257 -4.402 1.00 24.21 C ATOM 568 O ARG A 36 14.167 -18.922 -5.585 1.00 64.32 O ATOM 569 CB ARG A 36 14.530 -17.117 -3.091 1.00 21.50 C ATOM 570 CG ARG A 36 16.004 -17.520 -2.857 1.00 31.22 C ATOM 571 CD ARG A 36 16.924 -16.321 -2.554 1.00 64.44 C ATOM 572 NE ARG A 36 16.731 -15.174 -3.472 1.00 0.22 N ATOM 573 CZ ARG A 36 17.075 -15.128 -4.778 1.00 63.42 C ATOM 574 NH1 ARG A 36 17.654 -16.158 -5.384 1.00 54.31 N ATOM 575 NH2 ARG A 36 16.846 -14.023 -5.466 1.00 44.25 N ATOM 0 H ARG A 36 13.905 -18.786 -1.319 1.00 55.34 H new ATOM 0 HA ARG A 36 12.609 -17.905 -3.719 1.00 14.11 H new ATOM 0 HB2 ARG A 36 14.485 -16.445 -3.948 1.00 21.50 H new ATOM 0 HB3 ARG A 36 14.182 -16.553 -2.225 1.00 21.50 H new ATOM 0 HG2 ARG A 36 16.053 -18.225 -2.027 1.00 31.22 H new ATOM 0 HG3 ARG A 36 16.376 -18.040 -3.740 1.00 31.22 H new ATOM 0 HD2 ARG A 36 16.748 -15.989 -1.531 1.00 64.44 H new ATOM 0 HD3 ARG A 36 17.962 -16.648 -2.609 1.00 64.44 H new ATOM 0 HE ARG A 36 16.297 -14.338 -3.080 1.00 0.22 H new ATOM 0 HH11 ARG A 36 17.850 -17.012 -4.862 1.00 54.31 H new ATOM 0 HH12 ARG A 36 17.903 -16.095 -6.371 1.00 54.31 H new ATOM 0 HH21 ARG A 36 16.415 -13.219 -5.010 1.00 44.25 H new ATOM 0 HH22 ARG A 36 17.101 -13.974 -6.453 1.00 44.25 H new ATOM 589 N ASP A 37 14.601 -20.418 -3.943 1.00 71.52 N ATOM 590 CA ASP A 37 15.074 -21.505 -4.814 1.00 61.43 C ATOM 591 C ASP A 37 13.948 -21.980 -5.762 1.00 52.13 C ATOM 592 O ASP A 37 14.153 -22.113 -6.974 1.00 72.35 O ATOM 593 CB ASP A 37 15.579 -22.686 -3.943 1.00 23.24 C ATOM 594 CG ASP A 37 16.381 -23.731 -4.746 1.00 24.42 C ATOM 595 OD1 ASP A 37 15.771 -24.576 -5.442 1.00 41.12 O ATOM 596 OD2 ASP A 37 17.634 -23.705 -4.684 1.00 20.20 O ATOM 0 H ASP A 37 14.675 -20.633 -2.949 1.00 71.52 H new ATOM 0 HA ASP A 37 15.895 -21.132 -5.427 1.00 61.43 H new ATOM 0 HB2 ASP A 37 16.204 -22.296 -3.140 1.00 23.24 H new ATOM 0 HB3 ASP A 37 14.725 -23.175 -3.474 1.00 23.24 H new ATOM 601 N ASP A 38 12.757 -22.205 -5.180 1.00 72.44 N ATOM 602 CA ASP A 38 11.590 -22.796 -5.877 1.00 73.12 C ATOM 603 C ASP A 38 10.503 -21.750 -6.172 1.00 64.21 C ATOM 604 O ASP A 38 9.435 -22.118 -6.670 1.00 41.23 O ATOM 605 CB ASP A 38 10.971 -23.915 -4.996 1.00 32.34 C ATOM 606 CG ASP A 38 11.972 -25.002 -4.591 1.00 61.11 C ATOM 607 OD1 ASP A 38 12.693 -24.811 -3.586 1.00 24.03 O ATOM 608 OD2 ASP A 38 12.052 -26.044 -5.279 1.00 32.54 O ATOM 0 H ASP A 38 12.571 -21.981 -4.202 1.00 72.44 H new ATOM 0 HA ASP A 38 11.947 -23.198 -6.825 1.00 73.12 H new ATOM 0 HB2 ASP A 38 10.551 -23.466 -4.096 1.00 32.34 H new ATOM 0 HB3 ASP A 38 10.145 -24.377 -5.537 1.00 32.34 H new ATOM 613 N PHE A 39 10.792 -20.464 -5.907 1.00 45.11 N ATOM 614 CA PHE A 39 9.765 -19.402 -5.817 1.00 52.23 C ATOM 615 C PHE A 39 8.969 -19.190 -7.125 1.00 72.32 C ATOM 616 O PHE A 39 9.455 -19.474 -8.232 1.00 72.31 O ATOM 617 CB PHE A 39 10.409 -18.048 -5.366 1.00 42.43 C ATOM 618 CG PHE A 39 11.113 -17.218 -6.460 1.00 20.23 C ATOM 619 CD1 PHE A 39 12.024 -17.799 -7.354 1.00 2.35 C ATOM 620 CD2 PHE A 39 10.854 -15.852 -6.593 1.00 24.11 C ATOM 621 CE1 PHE A 39 12.643 -17.045 -8.336 1.00 21.05 C ATOM 622 CE2 PHE A 39 11.475 -15.102 -7.571 1.00 74.30 C ATOM 623 CZ PHE A 39 12.366 -15.698 -8.446 1.00 51.13 C ATOM 0 H PHE A 39 11.742 -20.128 -5.749 1.00 45.11 H new ATOM 0 HA PHE A 39 9.051 -19.746 -5.068 1.00 52.23 H new ATOM 0 HB2 PHE A 39 9.628 -17.431 -4.920 1.00 42.43 H new ATOM 0 HB3 PHE A 39 11.134 -18.261 -4.581 1.00 42.43 H new ATOM 0 HD1 PHE A 39 12.246 -18.853 -7.275 1.00 2.35 H new ATOM 0 HD2 PHE A 39 10.157 -15.375 -5.920 1.00 24.11 H new ATOM 0 HE1 PHE A 39 13.342 -17.511 -9.015 1.00 21.05 H new ATOM 0 HE2 PHE A 39 11.265 -14.046 -7.654 1.00 74.30 H new ATOM 0 HZ PHE A 39 12.844 -15.109 -9.215 1.00 51.13 H new ATOM 633 N ASP A 40 7.738 -18.701 -6.960 1.00 70.13 N ATOM 634 CA ASP A 40 6.940 -18.115 -8.049 1.00 64.32 C ATOM 635 C ASP A 40 7.279 -16.615 -8.144 1.00 44.44 C ATOM 636 O ASP A 40 7.712 -16.017 -7.144 1.00 3.22 O ATOM 637 CB ASP A 40 5.431 -18.337 -7.768 1.00 13.32 C ATOM 638 CG ASP A 40 4.499 -17.728 -8.833 1.00 73.14 C ATOM 639 OD1 ASP A 40 4.420 -18.269 -9.956 1.00 3.15 O ATOM 640 OD2 ASP A 40 3.849 -16.700 -8.559 1.00 22.32 O ATOM 0 H ASP A 40 7.259 -18.699 -6.060 1.00 70.13 H new ATOM 0 HA ASP A 40 7.173 -18.593 -9.000 1.00 64.32 H new ATOM 0 HB2 ASP A 40 5.238 -19.408 -7.701 1.00 13.32 H new ATOM 0 HB3 ASP A 40 5.186 -17.907 -6.797 1.00 13.32 H new ATOM 645 N GLY A 41 7.088 -16.014 -9.339 1.00 75.33 N ATOM 646 CA GLY A 41 7.305 -14.569 -9.545 1.00 14.21 C ATOM 647 C GLY A 41 6.406 -13.699 -8.662 1.00 64.10 C ATOM 648 O GLY A 41 5.587 -14.224 -7.892 1.00 2.31 O ATOM 0 H GLY A 41 6.783 -16.511 -10.176 1.00 75.33 H new ATOM 0 HA2 GLY A 41 8.348 -14.331 -9.339 1.00 14.21 H new ATOM 0 HA3 GLY A 41 7.123 -14.325 -10.592 1.00 14.21 H new ATOM 652 N LEU A 42 6.504 -12.363 -8.795 1.00 31.41 N ATOM 653 CA LEU A 42 5.819 -11.451 -7.867 1.00 34.41 C ATOM 654 C LEU A 42 4.348 -11.364 -8.281 1.00 41.51 C ATOM 655 O LEU A 42 3.971 -10.595 -9.176 1.00 44.41 O ATOM 656 CB LEU A 42 6.501 -10.052 -7.781 1.00 13.05 C ATOM 657 CG LEU A 42 6.004 -9.073 -6.631 1.00 34.11 C ATOM 658 CD1 LEU A 42 4.708 -8.297 -6.992 1.00 33.11 C ATOM 659 CD2 LEU A 42 5.837 -9.821 -5.279 1.00 62.24 C ATOM 0 H LEU A 42 7.043 -11.899 -9.526 1.00 31.41 H new ATOM 0 HA LEU A 42 5.888 -11.850 -6.855 1.00 34.41 H new ATOM 0 HB2 LEU A 42 7.573 -10.205 -7.655 1.00 13.05 H new ATOM 0 HB3 LEU A 42 6.362 -9.548 -8.738 1.00 13.05 H new ATOM 0 HG LEU A 42 6.791 -8.326 -6.524 1.00 34.11 H new ATOM 0 HD11 LEU A 42 4.428 -7.649 -6.161 1.00 33.11 H new ATOM 0 HD12 LEU A 42 4.882 -7.692 -7.882 1.00 33.11 H new ATOM 0 HD13 LEU A 42 3.902 -9.005 -7.187 1.00 33.11 H new ATOM 0 HD21 LEU A 42 5.496 -9.121 -4.516 1.00 62.24 H new ATOM 0 HD22 LEU A 42 5.104 -10.619 -5.393 1.00 62.24 H new ATOM 0 HD23 LEU A 42 6.794 -10.248 -4.979 1.00 62.24 H new ATOM 671 N SER A 43 3.546 -12.227 -7.665 1.00 1.40 N ATOM 672 CA SER A 43 2.101 -12.203 -7.775 1.00 15.40 C ATOM 673 C SER A 43 1.525 -11.364 -6.630 1.00 52.53 C ATOM 674 O SER A 43 2.127 -11.246 -5.553 1.00 3.12 O ATOM 675 CB SER A 43 1.557 -13.641 -7.745 1.00 33.54 C ATOM 676 OG SER A 43 2.067 -14.383 -8.843 1.00 53.44 O ATOM 0 H SER A 43 3.894 -12.975 -7.065 1.00 1.40 H new ATOM 0 HA SER A 43 1.801 -11.750 -8.720 1.00 15.40 H new ATOM 0 HB2 SER A 43 1.838 -14.124 -6.809 1.00 33.54 H new ATOM 0 HB3 SER A 43 0.468 -13.626 -7.782 1.00 33.54 H new ATOM 0 HG SER A 43 2.625 -15.117 -8.511 1.00 53.44 H new ATOM 682 N TYR A 44 0.366 -10.786 -6.888 1.00 2.43 N ATOM 683 CA TYR A 44 -0.354 -9.923 -5.947 1.00 3.14 C ATOM 684 C TYR A 44 -1.807 -10.414 -5.844 1.00 43.25 C ATOM 685 O TYR A 44 -2.160 -11.445 -6.435 1.00 31.10 O ATOM 686 CB TYR A 44 -0.249 -8.431 -6.409 1.00 40.31 C ATOM 687 CG TYR A 44 -0.838 -8.120 -7.801 1.00 42.13 C ATOM 688 CD1 TYR A 44 -0.275 -8.659 -8.964 1.00 60.13 C ATOM 689 CD2 TYR A 44 -1.955 -7.294 -7.951 1.00 14.22 C ATOM 690 CE1 TYR A 44 -0.802 -8.391 -10.209 1.00 43.41 C ATOM 691 CE2 TYR A 44 -2.485 -7.027 -9.198 1.00 74.44 C ATOM 692 CZ TYR A 44 -1.907 -7.578 -10.323 1.00 71.15 C ATOM 693 OH TYR A 44 -2.437 -7.318 -11.567 1.00 74.24 O ATOM 0 H TYR A 44 -0.119 -10.902 -7.778 1.00 2.43 H new ATOM 0 HA TYR A 44 0.088 -9.974 -4.952 1.00 3.14 H new ATOM 0 HB2 TYR A 44 -0.754 -7.805 -5.673 1.00 40.31 H new ATOM 0 HB3 TYR A 44 0.802 -8.142 -6.406 1.00 40.31 H new ATOM 0 HD1 TYR A 44 0.591 -9.299 -8.884 1.00 60.13 H new ATOM 0 HD2 TYR A 44 -2.412 -6.856 -7.076 1.00 14.22 H new ATOM 0 HE1 TYR A 44 -0.350 -8.817 -11.092 1.00 43.41 H new ATOM 0 HE2 TYR A 44 -3.350 -6.388 -9.292 1.00 74.44 H new ATOM 0 HH TYR A 44 -3.214 -6.729 -11.475 1.00 74.24 H new ATOM 703 N PHE A 45 -2.635 -9.682 -5.091 1.00 74.21 N ATOM 704 CA PHE A 45 -4.062 -10.011 -4.897 1.00 10.12 C ATOM 705 C PHE A 45 -4.835 -9.737 -6.216 1.00 41.53 C ATOM 706 O PHE A 45 -4.329 -9.021 -7.089 1.00 42.32 O ATOM 707 CB PHE A 45 -4.619 -9.215 -3.678 1.00 0.01 C ATOM 708 CG PHE A 45 -3.957 -9.562 -2.326 1.00 31.11 C ATOM 709 CD1 PHE A 45 -2.610 -9.285 -2.088 1.00 32.52 C ATOM 710 CD2 PHE A 45 -4.681 -10.164 -1.298 1.00 52.33 C ATOM 711 CE1 PHE A 45 -2.011 -9.603 -0.882 1.00 34.41 C ATOM 712 CE2 PHE A 45 -4.084 -10.487 -0.091 1.00 41.40 C ATOM 713 CZ PHE A 45 -2.749 -10.202 0.118 1.00 32.02 C ATOM 0 H PHE A 45 -2.339 -8.841 -4.595 1.00 74.21 H new ATOM 0 HA PHE A 45 -4.191 -11.068 -4.666 1.00 10.12 H new ATOM 0 HB2 PHE A 45 -4.491 -8.149 -3.867 1.00 0.01 H new ATOM 0 HB3 PHE A 45 -5.691 -9.398 -3.600 1.00 0.01 H new ATOM 0 HD1 PHE A 45 -2.023 -8.812 -2.862 1.00 32.52 H new ATOM 0 HD2 PHE A 45 -5.728 -10.383 -1.446 1.00 52.33 H new ATOM 0 HE1 PHE A 45 -0.966 -9.382 -0.723 1.00 34.41 H new ATOM 0 HE2 PHE A 45 -4.663 -10.962 0.687 1.00 41.40 H new ATOM 0 HZ PHE A 45 -2.284 -10.447 1.061 1.00 32.02 H new ATOM 723 N ASP A 46 -6.039 -10.321 -6.392 1.00 21.12 N ATOM 724 CA ASP A 46 -6.742 -10.300 -7.702 1.00 72.22 C ATOM 725 C ASP A 46 -7.435 -8.954 -7.942 1.00 70.51 C ATOM 726 O ASP A 46 -7.896 -8.322 -6.989 1.00 73.25 O ATOM 727 CB ASP A 46 -7.781 -11.469 -7.820 1.00 13.44 C ATOM 728 CG ASP A 46 -9.183 -11.167 -7.228 1.00 4.30 C ATOM 729 OD1 ASP A 46 -9.337 -11.140 -5.982 1.00 60.42 O ATOM 730 OD2 ASP A 46 -10.139 -10.961 -8.017 1.00 44.45 O ATOM 0 H ASP A 46 -6.545 -10.810 -5.653 1.00 21.12 H new ATOM 0 HA ASP A 46 -5.982 -10.441 -8.471 1.00 72.22 H new ATOM 0 HB2 ASP A 46 -7.896 -11.727 -8.873 1.00 13.44 H new ATOM 0 HB3 ASP A 46 -7.374 -12.348 -7.319 1.00 13.44 H new ATOM 735 N PRO A 47 -7.542 -8.490 -9.217 1.00 1.33 N ATOM 736 CA PRO A 47 -8.312 -7.282 -9.526 1.00 31.31 C ATOM 737 C PRO A 47 -9.829 -7.531 -9.363 1.00 2.13 C ATOM 738 O PRO A 47 -10.461 -8.170 -10.211 1.00 64.52 O ATOM 739 CB PRO A 47 -7.919 -6.969 -11.001 1.00 44.11 C ATOM 740 CG PRO A 47 -6.731 -7.848 -11.301 1.00 21.03 C ATOM 741 CD PRO A 47 -6.915 -9.067 -10.439 1.00 32.45 C ATOM 0 HA PRO A 47 -8.096 -6.449 -8.857 1.00 31.31 H new ATOM 0 HB2 PRO A 47 -8.745 -7.181 -11.680 1.00 44.11 H new ATOM 0 HB3 PRO A 47 -7.668 -5.916 -11.124 1.00 44.11 H new ATOM 0 HG2 PRO A 47 -6.695 -8.114 -12.357 1.00 21.03 H new ATOM 0 HG3 PRO A 47 -5.796 -7.339 -11.069 1.00 21.03 H new ATOM 0 HD2 PRO A 47 -7.555 -9.810 -10.914 1.00 32.45 H new ATOM 0 HD3 PRO A 47 -5.967 -9.558 -10.218 1.00 32.45 H new ATOM 749 N ASP A 48 -10.390 -7.041 -8.244 1.00 74.23 N ATOM 750 CA ASP A 48 -11.829 -7.090 -7.962 1.00 64.25 C ATOM 751 C ASP A 48 -12.335 -5.646 -7.775 1.00 51.11 C ATOM 752 O ASP A 48 -11.985 -4.999 -6.779 1.00 13.01 O ATOM 753 CB ASP A 48 -12.109 -7.946 -6.700 1.00 1.42 C ATOM 754 CG ASP A 48 -13.617 -8.207 -6.474 1.00 31.34 C ATOM 755 OD1 ASP A 48 -14.303 -7.361 -5.863 1.00 12.23 O ATOM 756 OD2 ASP A 48 -14.128 -9.256 -6.925 1.00 23.52 O ATOM 0 H ASP A 48 -9.848 -6.595 -7.504 1.00 74.23 H new ATOM 0 HA ASP A 48 -12.357 -7.558 -8.793 1.00 64.25 H new ATOM 0 HB2 ASP A 48 -11.590 -8.900 -6.791 1.00 1.42 H new ATOM 0 HB3 ASP A 48 -11.697 -7.441 -5.826 1.00 1.42 H new ATOM 761 N PRO A 49 -13.145 -5.104 -8.736 1.00 34.12 N ATOM 762 CA PRO A 49 -13.618 -3.693 -8.695 1.00 64.33 C ATOM 763 C PRO A 49 -14.566 -3.397 -7.516 1.00 24.14 C ATOM 764 O PRO A 49 -14.682 -2.245 -7.088 1.00 22.15 O ATOM 765 CB PRO A 49 -14.334 -3.521 -10.056 1.00 74.34 C ATOM 766 CG PRO A 49 -14.751 -4.908 -10.449 1.00 4.12 C ATOM 767 CD PRO A 49 -13.655 -5.815 -9.946 1.00 41.14 C ATOM 0 HA PRO A 49 -12.795 -2.995 -8.541 1.00 64.33 H new ATOM 0 HB2 PRO A 49 -15.195 -2.859 -9.969 1.00 74.34 H new ATOM 0 HB3 PRO A 49 -13.669 -3.082 -10.800 1.00 74.34 H new ATOM 0 HG2 PRO A 49 -15.712 -5.170 -10.005 1.00 4.12 H new ATOM 0 HG3 PRO A 49 -14.865 -4.992 -11.530 1.00 4.12 H new ATOM 0 HD2 PRO A 49 -14.035 -6.806 -9.699 1.00 41.14 H new ATOM 0 HD3 PRO A 49 -12.872 -5.951 -10.692 1.00 41.14 H new ATOM 775 N ASP A 50 -15.237 -4.442 -7.004 1.00 62.34 N ATOM 776 CA ASP A 50 -16.220 -4.318 -5.908 1.00 3.04 C ATOM 777 C ASP A 50 -15.537 -4.298 -4.527 1.00 60.33 C ATOM 778 O ASP A 50 -16.114 -3.795 -3.557 1.00 70.42 O ATOM 779 CB ASP A 50 -17.242 -5.480 -5.992 1.00 50.13 C ATOM 780 CG ASP A 50 -17.897 -5.597 -7.383 1.00 62.32 C ATOM 781 OD1 ASP A 50 -18.954 -4.964 -7.617 1.00 71.01 O ATOM 782 OD2 ASP A 50 -17.335 -6.298 -8.261 1.00 13.42 O ATOM 0 H ASP A 50 -15.115 -5.398 -7.337 1.00 62.34 H new ATOM 0 HA ASP A 50 -16.740 -3.367 -6.024 1.00 3.04 H new ATOM 0 HB2 ASP A 50 -16.741 -6.417 -5.751 1.00 50.13 H new ATOM 0 HB3 ASP A 50 -18.018 -5.331 -5.241 1.00 50.13 H new ATOM 787 N TYR A 51 -14.302 -4.843 -4.448 1.00 24.23 N ATOM 788 CA TYR A 51 -13.503 -4.851 -3.194 1.00 73.20 C ATOM 789 C TYR A 51 -12.725 -3.526 -3.091 1.00 23.21 C ATOM 790 O TYR A 51 -12.338 -3.082 -2.002 1.00 14.33 O ATOM 791 CB TYR A 51 -12.522 -6.076 -3.168 1.00 52.21 C ATOM 792 CG TYR A 51 -12.376 -6.743 -1.785 1.00 71.04 C ATOM 793 CD1 TYR A 51 -11.852 -6.051 -0.685 1.00 22.24 C ATOM 794 CD2 TYR A 51 -12.791 -8.062 -1.575 1.00 4.41 C ATOM 795 CE1 TYR A 51 -11.746 -6.654 0.557 1.00 23.44 C ATOM 796 CE2 TYR A 51 -12.692 -8.659 -0.338 1.00 62.13 C ATOM 797 CZ TYR A 51 -12.172 -7.958 0.721 1.00 54.15 C ATOM 798 OH TYR A 51 -12.085 -8.564 1.953 1.00 3.13 O ATOM 0 H TYR A 51 -13.833 -5.285 -5.239 1.00 24.23 H new ATOM 0 HA TYR A 51 -14.171 -4.947 -2.338 1.00 73.20 H new ATOM 0 HB2 TYR A 51 -12.871 -6.821 -3.883 1.00 52.21 H new ATOM 0 HB3 TYR A 51 -11.539 -5.747 -3.505 1.00 52.21 H new ATOM 0 HD1 TYR A 51 -11.525 -5.029 -0.808 1.00 22.24 H new ATOM 0 HD2 TYR A 51 -13.198 -8.625 -2.402 1.00 4.41 H new ATOM 0 HE1 TYR A 51 -11.333 -6.108 1.392 1.00 23.44 H new ATOM 0 HE2 TYR A 51 -13.023 -9.678 -0.201 1.00 62.13 H new ATOM 0 HH TYR A 51 -12.636 -9.375 1.958 1.00 3.13 H new ATOM 808 N ARG A 52 -12.517 -2.920 -4.265 1.00 10.23 N ATOM 809 CA ARG A 52 -11.960 -1.580 -4.426 1.00 11.11 C ATOM 810 C ARG A 52 -12.945 -0.535 -3.851 1.00 12.11 C ATOM 811 O ARG A 52 -14.070 -0.407 -4.343 1.00 61.41 O ATOM 812 CB ARG A 52 -11.711 -1.362 -5.944 1.00 53.15 C ATOM 813 CG ARG A 52 -11.140 0.002 -6.347 1.00 14.24 C ATOM 814 CD ARG A 52 -11.032 0.158 -7.871 1.00 63.35 C ATOM 815 NE ARG A 52 -10.338 1.403 -8.266 1.00 11.42 N ATOM 816 CZ ARG A 52 -10.778 2.287 -9.183 1.00 33.10 C ATOM 817 NH1 ARG A 52 -11.930 2.093 -9.819 1.00 72.12 N ATOM 818 NH2 ARG A 52 -10.053 3.363 -9.457 1.00 75.12 N ATOM 0 H ARG A 52 -12.740 -3.366 -5.155 1.00 10.23 H new ATOM 0 HA ARG A 52 -11.021 -1.468 -3.884 1.00 11.11 H new ATOM 0 HB2 ARG A 52 -11.028 -2.136 -6.294 1.00 53.15 H new ATOM 0 HB3 ARG A 52 -12.654 -1.508 -6.470 1.00 53.15 H new ATOM 0 HG2 ARG A 52 -11.775 0.792 -5.947 1.00 14.24 H new ATOM 0 HG3 ARG A 52 -10.154 0.128 -5.900 1.00 14.24 H new ATOM 0 HD2 ARG A 52 -10.498 -0.698 -8.284 1.00 63.35 H new ATOM 0 HD3 ARG A 52 -12.032 0.150 -8.305 1.00 63.35 H new ATOM 0 HE ARG A 52 -9.452 1.610 -7.806 1.00 11.42 H new ATOM 0 HH11 ARG A 52 -12.492 1.267 -9.615 1.00 72.12 H new ATOM 0 HH12 ARG A 52 -12.251 2.770 -10.511 1.00 72.12 H new ATOM 0 HH21 ARG A 52 -9.168 3.518 -8.975 1.00 75.12 H new ATOM 0 HH22 ARG A 52 -10.381 4.036 -10.150 1.00 75.12 H new ATOM 832 N VAL A 53 -12.516 0.202 -2.809 1.00 53.13 N ATOM 833 CA VAL A 53 -13.370 1.183 -2.096 1.00 3.22 C ATOM 834 C VAL A 53 -12.841 2.598 -2.373 1.00 64.53 C ATOM 835 O VAL A 53 -11.759 2.746 -2.930 1.00 75.21 O ATOM 836 CB VAL A 53 -13.410 0.902 -0.540 1.00 41.42 C ATOM 837 CG1 VAL A 53 -13.875 -0.539 -0.246 1.00 10.24 C ATOM 838 CG2 VAL A 53 -12.051 1.180 0.139 1.00 5.30 C ATOM 0 H VAL A 53 -11.569 0.138 -2.435 1.00 53.13 H new ATOM 0 HA VAL A 53 -14.392 1.089 -2.464 1.00 3.22 H new ATOM 0 HB VAL A 53 -14.136 1.595 -0.115 1.00 41.42 H new ATOM 0 HG11 VAL A 53 -13.893 -0.703 0.831 1.00 10.24 H new ATOM 0 HG12 VAL A 53 -14.875 -0.689 -0.652 1.00 10.24 H new ATOM 0 HG13 VAL A 53 -13.186 -1.245 -0.709 1.00 10.24 H new ATOM 0 HG21 VAL A 53 -12.128 0.973 1.206 1.00 5.30 H new ATOM 0 HG22 VAL A 53 -11.287 0.539 -0.301 1.00 5.30 H new ATOM 0 HG23 VAL A 53 -11.777 2.225 -0.009 1.00 5.30 H new ATOM 848 N GLU A 54 -13.592 3.636 -1.980 1.00 72.33 N ATOM 849 CA GLU A 54 -13.214 5.045 -2.240 1.00 34.43 C ATOM 850 C GLU A 54 -13.273 5.862 -0.936 1.00 50.11 C ATOM 851 O GLU A 54 -14.058 5.547 -0.037 1.00 15.01 O ATOM 852 CB GLU A 54 -14.128 5.641 -3.354 1.00 64.22 C ATOM 853 CG GLU A 54 -15.642 5.412 -3.129 1.00 3.23 C ATOM 854 CD GLU A 54 -16.516 5.909 -4.289 1.00 31.15 C ATOM 855 OE1 GLU A 54 -16.734 5.151 -5.262 1.00 53.11 O ATOM 856 OE2 GLU A 54 -16.978 7.069 -4.244 1.00 63.23 O ATOM 0 H GLU A 54 -14.473 3.532 -1.476 1.00 72.33 H new ATOM 0 HA GLU A 54 -12.186 5.090 -2.600 1.00 34.43 H new ATOM 0 HB2 GLU A 54 -13.942 6.713 -3.425 1.00 64.22 H new ATOM 0 HB3 GLU A 54 -13.845 5.204 -4.312 1.00 64.22 H new ATOM 0 HG2 GLU A 54 -15.822 4.347 -2.979 1.00 3.23 H new ATOM 0 HG3 GLU A 54 -15.946 5.919 -2.213 1.00 3.23 H new ATOM 863 N ALA A 55 -12.447 6.924 -0.853 1.00 13.31 N ATOM 864 CA ALA A 55 -12.209 7.675 0.400 1.00 4.33 C ATOM 865 C ALA A 55 -12.069 9.178 0.140 1.00 31.42 C ATOM 866 O ALA A 55 -11.744 9.590 -0.975 1.00 13.24 O ATOM 867 CB ALA A 55 -10.932 7.157 1.082 1.00 40.34 C ATOM 0 H ALA A 55 -11.925 7.287 -1.651 1.00 13.31 H new ATOM 0 HA ALA A 55 -13.071 7.520 1.049 1.00 4.33 H new ATOM 0 HB1 ALA A 55 -10.761 7.713 2.004 1.00 40.34 H new ATOM 0 HB2 ALA A 55 -11.047 6.098 1.313 1.00 40.34 H new ATOM 0 HB3 ALA A 55 -10.082 7.293 0.413 1.00 40.34 H new ATOM 873 N THR A 56 -12.311 9.989 1.186 1.00 54.31 N ATOM 874 CA THR A 56 -12.071 11.439 1.154 1.00 31.43 C ATOM 875 C THR A 56 -10.738 11.762 1.869 1.00 11.32 C ATOM 876 O THR A 56 -10.484 11.268 2.971 1.00 71.11 O ATOM 877 CB THR A 56 -13.250 12.210 1.830 1.00 23.23 C ATOM 878 OG1 THR A 56 -14.503 11.695 1.341 1.00 5.23 O ATOM 879 CG2 THR A 56 -13.183 13.725 1.548 1.00 33.14 C ATOM 0 H THR A 56 -12.679 9.655 2.077 1.00 54.31 H new ATOM 0 HA THR A 56 -12.007 11.761 0.115 1.00 31.43 H new ATOM 0 HB THR A 56 -13.169 12.062 2.907 1.00 23.23 H new ATOM 0 HG1 THR A 56 -15.243 12.177 1.766 1.00 5.23 H new ATOM 0 HG21 THR A 56 -14.021 14.223 2.036 1.00 33.14 H new ATOM 0 HG22 THR A 56 -12.246 14.126 1.935 1.00 33.14 H new ATOM 0 HG23 THR A 56 -13.234 13.898 0.473 1.00 33.14 H new ATOM 887 N VAL A 57 -9.902 12.583 1.219 1.00 33.02 N ATOM 888 CA VAL A 57 -8.564 12.957 1.701 1.00 32.54 C ATOM 889 C VAL A 57 -8.661 14.075 2.758 1.00 63.24 C ATOM 890 O VAL A 57 -9.299 15.104 2.524 1.00 53.25 O ATOM 891 CB VAL A 57 -7.672 13.430 0.490 1.00 13.54 C ATOM 892 CG1 VAL A 57 -6.234 13.775 0.928 1.00 52.12 C ATOM 893 CG2 VAL A 57 -7.663 12.364 -0.626 1.00 35.25 C ATOM 0 H VAL A 57 -10.141 13.014 0.326 1.00 33.02 H new ATOM 0 HA VAL A 57 -8.103 12.085 2.165 1.00 32.54 H new ATOM 0 HB VAL A 57 -8.116 14.345 0.098 1.00 13.54 H new ATOM 0 HG11 VAL A 57 -5.657 14.096 0.061 1.00 52.12 H new ATOM 0 HG12 VAL A 57 -6.261 14.579 1.664 1.00 52.12 H new ATOM 0 HG13 VAL A 57 -5.767 12.895 1.369 1.00 52.12 H new ATOM 0 HG21 VAL A 57 -7.042 12.708 -1.453 1.00 35.25 H new ATOM 0 HG22 VAL A 57 -7.260 11.430 -0.234 1.00 35.25 H new ATOM 0 HG23 VAL A 57 -8.681 12.199 -0.980 1.00 35.25 H new ATOM 903 N THR A 58 -8.028 13.852 3.917 1.00 61.33 N ATOM 904 CA THR A 58 -7.985 14.809 5.028 1.00 44.11 C ATOM 905 C THR A 58 -6.519 15.201 5.272 1.00 34.14 C ATOM 906 O THR A 58 -5.766 14.445 5.899 1.00 71.30 O ATOM 907 CB THR A 58 -8.605 14.171 6.320 1.00 43.44 C ATOM 908 OG1 THR A 58 -9.878 13.567 6.017 1.00 60.03 O ATOM 909 CG2 THR A 58 -8.785 15.199 7.448 1.00 1.32 C ATOM 0 H THR A 58 -7.523 12.987 4.111 1.00 61.33 H new ATOM 0 HA THR A 58 -8.569 15.696 4.780 1.00 44.11 H new ATOM 0 HB THR A 58 -7.905 13.411 6.667 1.00 43.44 H new ATOM 0 HG1 THR A 58 -10.254 13.171 6.831 1.00 60.03 H new ATOM 0 HG21 THR A 58 -9.217 14.710 8.321 1.00 1.32 H new ATOM 0 HG22 THR A 58 -7.816 15.623 7.712 1.00 1.32 H new ATOM 0 HG23 THR A 58 -9.450 15.995 7.112 1.00 1.32 H new ATOM 917 N VAL A 59 -6.100 16.367 4.763 1.00 13.25 N ATOM 918 CA VAL A 59 -4.689 16.780 4.807 1.00 35.14 C ATOM 919 C VAL A 59 -4.430 17.612 6.064 1.00 71.21 C ATOM 920 O VAL A 59 -5.240 18.468 6.431 1.00 41.32 O ATOM 921 CB VAL A 59 -4.246 17.547 3.500 1.00 62.24 C ATOM 922 CG1 VAL A 59 -2.865 18.232 3.653 1.00 31.55 C ATOM 923 CG2 VAL A 59 -4.219 16.564 2.311 1.00 74.14 C ATOM 0 H VAL A 59 -6.719 17.043 4.315 1.00 13.25 H new ATOM 0 HA VAL A 59 -4.076 15.879 4.850 1.00 35.14 H new ATOM 0 HB VAL A 59 -4.975 18.337 3.319 1.00 62.24 H new ATOM 0 HG11 VAL A 59 -2.609 18.745 2.726 1.00 31.55 H new ATOM 0 HG12 VAL A 59 -2.906 18.955 4.468 1.00 31.55 H new ATOM 0 HG13 VAL A 59 -2.108 17.479 3.873 1.00 31.55 H new ATOM 0 HG21 VAL A 59 -3.913 17.093 1.408 1.00 74.14 H new ATOM 0 HG22 VAL A 59 -3.511 15.761 2.518 1.00 74.14 H new ATOM 0 HG23 VAL A 59 -5.213 16.142 2.165 1.00 74.14 H new ATOM 933 N HIS A 60 -3.311 17.308 6.732 1.00 35.42 N ATOM 934 CA HIS A 60 -2.848 18.025 7.923 1.00 62.33 C ATOM 935 C HIS A 60 -1.888 19.137 7.500 1.00 64.34 C ATOM 936 O HIS A 60 -0.903 18.868 6.804 1.00 31.52 O ATOM 937 CB HIS A 60 -2.170 17.025 8.888 1.00 64.22 C ATOM 938 CG HIS A 60 -3.155 16.073 9.513 1.00 24.21 C ATOM 939 ND1 HIS A 60 -3.676 14.976 8.854 1.00 15.35 N ATOM 940 CD2 HIS A 60 -3.775 16.108 10.718 1.00 11.33 C ATOM 941 CE1 HIS A 60 -4.574 14.394 9.625 1.00 22.12 C ATOM 942 NE2 HIS A 60 -4.646 15.055 10.758 1.00 11.21 N ATOM 0 H HIS A 60 -2.693 16.545 6.455 1.00 35.42 H new ATOM 0 HA HIS A 60 -3.689 18.483 8.444 1.00 62.33 H new ATOM 0 HB2 HIS A 60 -1.414 16.457 8.346 1.00 64.22 H new ATOM 0 HB3 HIS A 60 -1.653 17.576 9.673 1.00 64.22 H new ATOM 0 HD2 HIS A 60 -3.611 16.833 11.501 1.00 11.33 H new ATOM 0 HE1 HIS A 60 -5.154 13.520 9.368 1.00 22.12 H new ATOM 0 HE2 HIS A 60 -5.254 14.820 11.542 1.00 11.21 H new ATOM 951 N GLU A 61 -2.197 20.378 7.925 1.00 62.42 N ATOM 952 CA GLU A 61 -1.397 21.576 7.603 1.00 3.30 C ATOM 953 C GLU A 61 0.036 21.444 8.159 1.00 40.45 C ATOM 954 O GLU A 61 0.991 21.940 7.558 1.00 3.05 O ATOM 955 CB GLU A 61 -2.086 22.860 8.151 1.00 31.25 C ATOM 956 CG GLU A 61 -2.227 22.926 9.684 1.00 21.41 C ATOM 957 CD GLU A 61 -2.844 24.237 10.188 1.00 31.42 C ATOM 958 OE1 GLU A 61 -2.095 25.220 10.388 1.00 34.22 O ATOM 959 OE2 GLU A 61 -4.081 24.298 10.380 1.00 65.54 O ATOM 0 H GLU A 61 -3.012 20.578 8.504 1.00 62.42 H new ATOM 0 HA GLU A 61 -1.332 21.660 6.518 1.00 3.30 H new ATOM 0 HB2 GLU A 61 -1.518 23.728 7.817 1.00 31.25 H new ATOM 0 HB3 GLU A 61 -3.079 22.938 7.707 1.00 31.25 H new ATOM 0 HG2 GLU A 61 -2.843 22.092 10.020 1.00 21.41 H new ATOM 0 HG3 GLU A 61 -1.244 22.799 10.137 1.00 21.41 H new ATOM 966 N THR A 62 0.165 20.752 9.306 1.00 33.32 N ATOM 967 CA THR A 62 1.449 20.471 9.950 1.00 50.02 C ATOM 968 C THR A 62 1.748 18.956 9.834 1.00 43.30 C ATOM 969 O THR A 62 1.192 18.153 10.596 1.00 1.11 O ATOM 970 CB THR A 62 1.420 20.936 11.446 1.00 20.15 C ATOM 971 OG1 THR A 62 0.326 20.309 12.140 1.00 13.12 O ATOM 972 CG2 THR A 62 1.269 22.462 11.570 1.00 70.41 C ATOM 0 H THR A 62 -0.633 20.370 9.813 1.00 33.32 H new ATOM 0 HA THR A 62 2.245 21.025 9.452 1.00 50.02 H new ATOM 0 HB THR A 62 2.371 20.642 11.890 1.00 20.15 H new ATOM 0 HG1 THR A 62 0.239 19.380 11.841 1.00 13.12 H new ATOM 0 HG21 THR A 62 1.253 22.742 12.623 1.00 70.41 H new ATOM 0 HG22 THR A 62 2.109 22.952 11.077 1.00 70.41 H new ATOM 0 HG23 THR A 62 0.338 22.775 11.098 1.00 70.41 H new ATOM 980 N PRO A 63 2.593 18.528 8.843 1.00 22.54 N ATOM 981 CA PRO A 63 2.909 17.100 8.637 1.00 40.22 C ATOM 982 C PRO A 63 3.809 16.554 9.773 1.00 25.43 C ATOM 983 O PRO A 63 4.890 17.094 10.038 1.00 73.34 O ATOM 984 CB PRO A 63 3.630 17.094 7.269 1.00 3.01 C ATOM 985 CG PRO A 63 4.254 18.451 7.156 1.00 30.22 C ATOM 986 CD PRO A 63 3.300 19.397 7.856 1.00 22.03 C ATOM 0 HA PRO A 63 2.030 16.456 8.649 1.00 40.22 H new ATOM 0 HB2 PRO A 63 4.383 16.308 7.223 1.00 3.01 H new ATOM 0 HB3 PRO A 63 2.929 16.912 6.454 1.00 3.01 H new ATOM 0 HG2 PRO A 63 5.238 18.470 7.624 1.00 30.22 H new ATOM 0 HG3 PRO A 63 4.391 18.734 6.112 1.00 30.22 H new ATOM 0 HD2 PRO A 63 3.833 20.210 8.349 1.00 22.03 H new ATOM 0 HD3 PRO A 63 2.602 19.853 7.154 1.00 22.03 H new ATOM 994 N GLU A 64 3.345 15.493 10.440 1.00 22.44 N ATOM 995 CA GLU A 64 4.023 14.913 11.620 1.00 4.44 C ATOM 996 C GLU A 64 4.843 13.671 11.238 1.00 1.05 C ATOM 997 O GLU A 64 4.544 12.998 10.249 1.00 22.33 O ATOM 998 CB GLU A 64 2.966 14.596 12.713 1.00 54.12 C ATOM 999 CG GLU A 64 1.814 13.678 12.260 1.00 21.35 C ATOM 1000 CD GLU A 64 0.636 13.647 13.238 1.00 53.34 C ATOM 1001 OE1 GLU A 64 -0.253 14.521 13.142 1.00 21.30 O ATOM 1002 OE2 GLU A 64 0.598 12.760 14.115 1.00 63.33 O ATOM 0 H GLU A 64 2.487 15.006 10.182 1.00 22.44 H new ATOM 0 HA GLU A 64 4.731 15.639 12.021 1.00 4.44 H new ATOM 0 HB2 GLU A 64 3.470 14.130 13.560 1.00 54.12 H new ATOM 0 HB3 GLU A 64 2.543 15.535 13.071 1.00 54.12 H new ATOM 0 HG2 GLU A 64 1.458 14.010 11.285 1.00 21.35 H new ATOM 0 HG3 GLU A 64 2.196 12.665 12.132 1.00 21.35 H new ATOM 1009 N SER A 65 5.871 13.372 12.041 1.00 2.23 N ATOM 1010 CA SER A 65 6.866 12.334 11.730 1.00 5.13 C ATOM 1011 C SER A 65 6.367 10.926 12.130 1.00 32.25 C ATOM 1012 O SER A 65 6.168 10.649 13.319 1.00 11.41 O ATOM 1013 CB SER A 65 8.193 12.691 12.446 1.00 74.32 C ATOM 1014 OG SER A 65 7.997 12.952 13.829 1.00 64.53 O ATOM 0 H SER A 65 6.038 13.844 12.929 1.00 2.23 H new ATOM 0 HA SER A 65 7.031 12.305 10.653 1.00 5.13 H new ATOM 0 HB2 SER A 65 8.901 11.870 12.328 1.00 74.32 H new ATOM 0 HB3 SER A 65 8.637 13.566 11.971 1.00 74.32 H new ATOM 0 HG SER A 65 7.341 12.321 14.191 1.00 64.53 H new ATOM 1020 N VAL A 66 6.167 10.045 11.121 1.00 31.44 N ATOM 1021 CA VAL A 66 5.779 8.627 11.315 1.00 44.24 C ATOM 1022 C VAL A 66 6.782 7.739 10.564 1.00 13.22 C ATOM 1023 O VAL A 66 6.891 7.843 9.343 1.00 61.43 O ATOM 1024 CB VAL A 66 4.322 8.333 10.775 1.00 11.23 C ATOM 1025 CG1 VAL A 66 3.805 6.940 11.226 1.00 63.22 C ATOM 1026 CG2 VAL A 66 3.343 9.464 11.172 1.00 22.44 C ATOM 0 H VAL A 66 6.272 10.301 10.139 1.00 31.44 H new ATOM 0 HA VAL A 66 5.786 8.413 12.384 1.00 44.24 H new ATOM 0 HB VAL A 66 4.376 8.309 9.687 1.00 11.23 H new ATOM 0 HG11 VAL A 66 2.801 6.780 10.833 1.00 63.22 H new ATOM 0 HG12 VAL A 66 4.471 6.165 10.847 1.00 63.22 H new ATOM 0 HG13 VAL A 66 3.779 6.896 12.315 1.00 63.22 H new ATOM 0 HG21 VAL A 66 2.349 9.236 10.788 1.00 22.44 H new ATOM 0 HG22 VAL A 66 3.302 9.546 12.258 1.00 22.44 H new ATOM 0 HG23 VAL A 66 3.687 10.408 10.750 1.00 22.44 H new ATOM 1036 N ASP A 67 7.501 6.866 11.286 1.00 14.11 N ATOM 1037 CA ASP A 67 8.556 6.013 10.697 1.00 70.43 C ATOM 1038 C ASP A 67 7.920 4.819 9.974 1.00 53.41 C ATOM 1039 O ASP A 67 7.120 4.120 10.576 1.00 4.20 O ATOM 1040 CB ASP A 67 9.511 5.503 11.807 1.00 73.34 C ATOM 1041 CG ASP A 67 10.272 6.631 12.511 1.00 64.31 C ATOM 1042 OD1 ASP A 67 11.271 7.134 11.948 1.00 33.45 O ATOM 1043 OD2 ASP A 67 9.857 7.047 13.619 1.00 24.43 O ATOM 0 H ASP A 67 7.372 6.728 12.288 1.00 14.11 H new ATOM 0 HA ASP A 67 9.127 6.604 9.981 1.00 70.43 H new ATOM 0 HB2 ASP A 67 8.935 4.946 12.546 1.00 73.34 H new ATOM 0 HB3 ASP A 67 10.227 4.807 11.370 1.00 73.34 H new ATOM 1048 N LEU A 68 8.257 4.594 8.684 1.00 41.13 N ATOM 1049 CA LEU A 68 7.762 3.421 7.906 1.00 33.31 C ATOM 1050 C LEU A 68 8.928 2.698 7.206 1.00 54.02 C ATOM 1051 O LEU A 68 10.036 3.244 7.125 1.00 15.11 O ATOM 1052 CB LEU A 68 6.722 3.842 6.843 1.00 35.40 C ATOM 1053 CG LEU A 68 5.529 4.698 7.339 1.00 54.30 C ATOM 1054 CD1 LEU A 68 4.646 5.092 6.161 1.00 74.11 C ATOM 1055 CD2 LEU A 68 4.697 3.979 8.425 1.00 23.14 C ATOM 0 H LEU A 68 8.873 5.209 8.152 1.00 41.13 H new ATOM 0 HA LEU A 68 7.286 2.746 8.617 1.00 33.31 H new ATOM 0 HB2 LEU A 68 7.240 4.399 6.062 1.00 35.40 H new ATOM 0 HB3 LEU A 68 6.324 2.939 6.380 1.00 35.40 H new ATOM 0 HG LEU A 68 5.941 5.596 7.801 1.00 54.30 H new ATOM 0 HD11 LEU A 68 3.810 5.693 6.518 1.00 74.11 H new ATOM 0 HD12 LEU A 68 5.230 5.671 5.446 1.00 74.11 H new ATOM 0 HD13 LEU A 68 4.265 4.194 5.675 1.00 74.11 H new ATOM 0 HD21 LEU A 68 3.874 4.622 8.738 1.00 23.14 H new ATOM 0 HD22 LEU A 68 4.298 3.049 8.021 1.00 23.14 H new ATOM 0 HD23 LEU A 68 5.332 3.759 9.283 1.00 23.14 H new ATOM 1067 N GLU A 69 8.657 1.487 6.666 1.00 61.13 N ATOM 1068 CA GLU A 69 9.657 0.708 5.912 1.00 1.31 C ATOM 1069 C GLU A 69 9.863 1.318 4.512 1.00 50.11 C ATOM 1070 O GLU A 69 8.998 2.041 3.983 1.00 41.21 O ATOM 1071 CB GLU A 69 9.274 -0.811 5.784 1.00 4.25 C ATOM 1072 CG GLU A 69 8.173 -1.169 4.737 1.00 60.11 C ATOM 1073 CD GLU A 69 6.722 -0.991 5.241 1.00 21.51 C ATOM 1074 OE1 GLU A 69 6.330 0.142 5.600 1.00 64.15 O ATOM 1075 OE2 GLU A 69 5.977 -1.997 5.306 1.00 40.04 O ATOM 0 H GLU A 69 7.748 1.030 6.741 1.00 61.13 H new ATOM 0 HA GLU A 69 10.588 0.758 6.477 1.00 1.31 H new ATOM 0 HB2 GLU A 69 10.176 -1.370 5.534 1.00 4.25 H new ATOM 0 HB3 GLU A 69 8.942 -1.162 6.761 1.00 4.25 H new ATOM 0 HG2 GLU A 69 8.315 -0.547 3.853 1.00 60.11 H new ATOM 0 HG3 GLU A 69 8.311 -2.204 4.424 1.00 60.11 H new ATOM 1082 N THR A 70 11.041 1.055 3.953 1.00 44.14 N ATOM 1083 CA THR A 70 11.406 1.445 2.586 1.00 60.34 C ATOM 1084 C THR A 70 12.210 0.307 1.913 1.00 45.21 C ATOM 1085 O THR A 70 12.471 -0.737 2.539 1.00 5.12 O ATOM 1086 CB THR A 70 12.217 2.790 2.622 1.00 4.13 C ATOM 1087 OG1 THR A 70 12.572 3.214 1.295 1.00 21.11 O ATOM 1088 CG2 THR A 70 13.483 2.676 3.503 1.00 22.30 C ATOM 0 H THR A 70 11.784 0.557 4.442 1.00 44.14 H new ATOM 0 HA THR A 70 10.507 1.611 1.993 1.00 60.34 H new ATOM 0 HB THR A 70 11.566 3.542 3.068 1.00 4.13 H new ATOM 0 HG1 THR A 70 13.544 3.322 1.235 1.00 21.11 H new ATOM 0 HG21 THR A 70 14.015 3.627 3.501 1.00 22.30 H new ATOM 0 HG22 THR A 70 13.195 2.424 4.524 1.00 22.30 H new ATOM 0 HG23 THR A 70 14.133 1.896 3.107 1.00 22.30 H new ATOM 1096 N SER A 71 12.645 0.529 0.655 1.00 62.45 N ATOM 1097 CA SER A 71 13.403 -0.467 -0.137 1.00 32.43 C ATOM 1098 C SER A 71 14.915 -0.407 0.185 1.00 25.11 C ATOM 1099 O SER A 71 15.737 -0.922 -0.575 1.00 53.51 O ATOM 1100 CB SER A 71 13.153 -0.227 -1.650 1.00 45.43 C ATOM 1101 OG SER A 71 11.781 -0.371 -1.968 1.00 43.45 O ATOM 0 H SER A 71 12.481 1.404 0.158 1.00 62.45 H new ATOM 0 HA SER A 71 13.052 -1.464 0.130 1.00 32.43 H new ATOM 0 HB2 SER A 71 13.490 0.773 -1.924 1.00 45.43 H new ATOM 0 HB3 SER A 71 13.742 -0.933 -2.236 1.00 45.43 H new ATOM 0 HG SER A 71 11.558 0.210 -2.725 1.00 43.45 H new ATOM 1107 N ASP A 72 15.265 0.191 1.341 1.00 74.32 N ATOM 1108 CA ASP A 72 16.658 0.407 1.763 1.00 74.11 C ATOM 1109 C ASP A 72 16.978 -0.478 2.973 1.00 3.22 C ATOM 1110 O ASP A 72 17.984 -0.245 3.652 1.00 20.14 O ATOM 1111 CB ASP A 72 16.895 1.906 2.104 1.00 54.22 C ATOM 1112 CG ASP A 72 16.538 2.839 0.937 1.00 71.32 C ATOM 1113 OD1 ASP A 72 17.255 2.839 -0.084 1.00 52.51 O ATOM 1114 OD2 ASP A 72 15.525 3.561 1.030 1.00 54.45 O ATOM 0 H ASP A 72 14.581 0.540 2.012 1.00 74.32 H new ATOM 0 HA ASP A 72 17.323 0.135 0.943 1.00 74.11 H new ATOM 0 HB2 ASP A 72 16.299 2.176 2.976 1.00 54.22 H new ATOM 0 HB3 ASP A 72 17.940 2.053 2.375 1.00 54.22 H new ATOM 1119 N ASP A 73 16.100 -1.498 3.229 1.00 24.32 N ATOM 1120 CA ASP A 73 16.231 -2.482 4.346 1.00 55.20 C ATOM 1121 C ASP A 73 16.129 -1.805 5.721 1.00 22.43 C ATOM 1122 O ASP A 73 16.449 -2.405 6.750 1.00 0.13 O ATOM 1123 CB ASP A 73 17.549 -3.302 4.252 1.00 50.30 C ATOM 1124 CG ASP A 73 17.715 -3.989 2.894 1.00 63.32 C ATOM 1125 OD1 ASP A 73 17.200 -5.111 2.709 1.00 34.54 O ATOM 1126 OD2 ASP A 73 18.356 -3.398 1.997 1.00 22.22 O ATOM 0 H ASP A 73 15.272 -1.659 2.656 1.00 24.32 H new ATOM 0 HA ASP A 73 15.394 -3.172 4.241 1.00 55.20 H new ATOM 0 HB2 ASP A 73 18.398 -2.641 4.428 1.00 50.30 H new ATOM 0 HB3 ASP A 73 17.562 -4.054 5.041 1.00 50.30 H new ATOM 1131 N ARG A 74 15.618 -0.569 5.727 1.00 65.11 N ATOM 1132 CA ARG A 74 15.662 0.317 6.895 1.00 30.13 C ATOM 1133 C ARG A 74 14.240 0.866 7.181 1.00 25.11 C ATOM 1134 O ARG A 74 13.284 0.575 6.447 1.00 3.52 O ATOM 1135 CB ARG A 74 16.710 1.451 6.604 1.00 4.43 C ATOM 1136 CG ARG A 74 17.099 2.324 7.817 1.00 34.20 C ATOM 1137 CD ARG A 74 18.122 3.415 7.514 1.00 5.24 C ATOM 1138 NE ARG A 74 18.229 4.348 8.649 1.00 63.24 N ATOM 1139 CZ ARG A 74 18.310 5.685 8.556 1.00 14.51 C ATOM 1140 NH1 ARG A 74 18.318 6.287 7.370 1.00 11.14 N ATOM 1141 NH2 ARG A 74 18.318 6.414 9.663 1.00 35.02 N ATOM 0 H ARG A 74 15.159 -0.153 4.916 1.00 65.11 H new ATOM 0 HA ARG A 74 15.977 -0.214 7.793 1.00 30.13 H new ATOM 0 HB2 ARG A 74 17.614 0.992 6.204 1.00 4.43 H new ATOM 0 HB3 ARG A 74 16.310 2.100 5.825 1.00 4.43 H new ATOM 0 HG2 ARG A 74 16.198 2.790 8.216 1.00 34.20 H new ATOM 0 HG3 ARG A 74 17.497 1.678 8.600 1.00 34.20 H new ATOM 0 HD2 ARG A 74 19.094 2.965 7.312 1.00 5.24 H new ATOM 0 HD3 ARG A 74 17.829 3.958 6.615 1.00 5.24 H new ATOM 0 HE ARG A 74 18.243 3.944 9.585 1.00 63.24 H new ATOM 0 HH11 ARG A 74 18.262 5.732 6.516 1.00 11.14 H new ATOM 0 HH12 ARG A 74 18.380 7.304 7.314 1.00 11.14 H new ATOM 0 HH21 ARG A 74 18.263 5.959 10.574 1.00 35.02 H new ATOM 0 HH22 ARG A 74 18.379 7.430 9.604 1.00 35.02 H new ATOM 1155 N THR A 75 14.133 1.687 8.235 1.00 54.23 N ATOM 1156 CA THR A 75 12.924 2.388 8.610 1.00 1.11 C ATOM 1157 C THR A 75 13.307 3.877 8.584 1.00 41.24 C ATOM 1158 O THR A 75 14.366 4.260 9.107 1.00 15.20 O ATOM 1159 CB THR A 75 12.419 1.960 10.023 1.00 55.53 C ATOM 1160 OG1 THR A 75 12.327 0.537 10.088 1.00 33.12 O ATOM 1161 CG2 THR A 75 11.048 2.551 10.342 1.00 43.52 C ATOM 0 H THR A 75 14.915 1.879 8.861 1.00 54.23 H new ATOM 0 HA THR A 75 12.102 2.162 7.930 1.00 1.11 H new ATOM 0 HB THR A 75 13.135 2.336 10.753 1.00 55.53 H new ATOM 0 HG1 THR A 75 11.835 0.205 9.308 1.00 33.12 H new ATOM 0 HG21 THR A 75 10.734 2.228 11.335 1.00 43.52 H new ATOM 0 HG22 THR A 75 11.106 3.639 10.316 1.00 43.52 H new ATOM 0 HG23 THR A 75 10.323 2.209 9.603 1.00 43.52 H new ATOM 1169 N VAL A 76 12.457 4.697 7.988 1.00 75.44 N ATOM 1170 CA VAL A 76 12.779 6.102 7.662 1.00 64.14 C ATOM 1171 C VAL A 76 11.582 6.985 7.986 1.00 11.54 C ATOM 1172 O VAL A 76 10.437 6.519 7.975 1.00 34.34 O ATOM 1173 CB VAL A 76 13.224 6.312 6.154 1.00 55.20 C ATOM 1174 CG1 VAL A 76 14.637 5.734 5.894 1.00 54.41 C ATOM 1175 CG2 VAL A 76 12.197 5.729 5.162 1.00 73.00 C ATOM 0 H VAL A 76 11.516 4.418 7.710 1.00 75.44 H new ATOM 0 HA VAL A 76 13.636 6.384 8.274 1.00 64.14 H new ATOM 0 HB VAL A 76 13.265 7.388 5.984 1.00 55.20 H new ATOM 0 HG11 VAL A 76 14.910 5.895 4.851 1.00 54.41 H new ATOM 0 HG12 VAL A 76 15.359 6.234 6.539 1.00 54.41 H new ATOM 0 HG13 VAL A 76 14.638 4.665 6.108 1.00 54.41 H new ATOM 0 HG21 VAL A 76 12.542 5.895 4.141 1.00 73.00 H new ATOM 0 HG22 VAL A 76 12.088 4.659 5.338 1.00 73.00 H new ATOM 0 HG23 VAL A 76 11.234 6.220 5.304 1.00 73.00 H new ATOM 1185 N ARG A 77 11.868 8.257 8.275 1.00 45.32 N ATOM 1186 CA ARG A 77 10.862 9.245 8.653 1.00 10.05 C ATOM 1187 C ARG A 77 9.998 9.603 7.435 1.00 70.35 C ATOM 1188 O ARG A 77 10.508 10.055 6.406 1.00 72.44 O ATOM 1189 CB ARG A 77 11.558 10.507 9.260 1.00 74.12 C ATOM 1190 CG ARG A 77 10.600 11.633 9.753 1.00 32.55 C ATOM 1191 CD ARG A 77 10.235 12.678 8.683 1.00 20.03 C ATOM 1192 NE ARG A 77 11.395 13.512 8.310 1.00 33.23 N ATOM 1193 CZ ARG A 77 11.425 14.410 7.305 1.00 50.44 C ATOM 1194 NH1 ARG A 77 10.368 14.608 6.534 1.00 35.23 N ATOM 1195 NH2 ARG A 77 12.531 15.096 7.079 1.00 55.40 N ATOM 0 H ARG A 77 12.817 8.631 8.252 1.00 45.32 H new ATOM 0 HA ARG A 77 10.205 8.827 9.416 1.00 10.05 H new ATOM 0 HB2 ARG A 77 12.178 10.190 10.098 1.00 74.12 H new ATOM 0 HB3 ARG A 77 12.227 10.927 8.509 1.00 74.12 H new ATOM 0 HG2 ARG A 77 9.683 11.175 10.123 1.00 32.55 H new ATOM 0 HG3 ARG A 77 11.064 12.143 10.597 1.00 32.55 H new ATOM 0 HD2 ARG A 77 9.852 12.172 7.797 1.00 20.03 H new ATOM 0 HD3 ARG A 77 9.434 13.316 9.057 1.00 20.03 H new ATOM 0 HE ARG A 77 12.247 13.399 8.860 1.00 33.23 H new ATOM 0 HH11 ARG A 77 9.512 14.077 6.696 1.00 35.23 H new ATOM 0 HH12 ARG A 77 10.409 15.292 5.778 1.00 35.23 H new ATOM 0 HH21 ARG A 77 13.354 14.944 7.663 1.00 55.40 H new ATOM 0 HH22 ARG A 77 12.562 15.777 6.321 1.00 55.40 H new ATOM 1209 N TYR A 78 8.698 9.341 7.568 1.00 23.30 N ATOM 1210 CA TYR A 78 7.660 9.814 6.644 1.00 23.15 C ATOM 1211 C TYR A 78 6.915 10.977 7.297 1.00 51.44 C ATOM 1212 O TYR A 78 6.934 11.137 8.519 1.00 52.23 O ATOM 1213 CB TYR A 78 6.672 8.670 6.288 1.00 62.55 C ATOM 1214 CG TYR A 78 7.192 7.656 5.252 1.00 70.50 C ATOM 1215 CD1 TYR A 78 8.315 6.867 5.508 1.00 13.23 C ATOM 1216 CD2 TYR A 78 6.539 7.470 4.030 1.00 31.11 C ATOM 1217 CE1 TYR A 78 8.762 5.937 4.587 1.00 24.02 C ATOM 1218 CE2 TYR A 78 6.979 6.539 3.110 1.00 55.05 C ATOM 1219 CZ TYR A 78 8.091 5.772 3.391 1.00 64.13 C ATOM 1220 OH TYR A 78 8.532 4.837 2.472 1.00 63.32 O ATOM 0 H TYR A 78 8.326 8.782 8.336 1.00 23.30 H new ATOM 0 HA TYR A 78 8.127 10.147 5.717 1.00 23.15 H new ATOM 0 HB2 TYR A 78 6.417 8.134 7.202 1.00 62.55 H new ATOM 0 HB3 TYR A 78 5.750 9.112 5.910 1.00 62.55 H new ATOM 0 HD1 TYR A 78 8.844 6.985 6.442 1.00 13.23 H new ATOM 0 HD2 TYR A 78 5.670 8.069 3.800 1.00 31.11 H new ATOM 0 HE1 TYR A 78 9.636 5.340 4.803 1.00 24.02 H new ATOM 0 HE2 TYR A 78 6.455 6.412 2.174 1.00 55.05 H new ATOM 0 HH TYR A 78 8.663 3.975 2.920 1.00 63.32 H new ATOM 1230 N LEU A 79 6.292 11.802 6.468 1.00 12.33 N ATOM 1231 CA LEU A 79 5.414 12.883 6.917 1.00 10.15 C ATOM 1232 C LEU A 79 3.962 12.492 6.690 1.00 24.21 C ATOM 1233 O LEU A 79 3.600 12.043 5.593 1.00 34.24 O ATOM 1234 CB LEU A 79 5.751 14.206 6.185 1.00 52.22 C ATOM 1235 CG LEU A 79 7.091 14.885 6.606 1.00 0.45 C ATOM 1236 CD1 LEU A 79 7.299 16.229 5.875 1.00 64.24 C ATOM 1237 CD2 LEU A 79 7.162 15.072 8.139 1.00 11.13 C ATOM 0 H LEU A 79 6.380 11.743 5.454 1.00 12.33 H new ATOM 0 HA LEU A 79 5.572 13.046 7.983 1.00 10.15 H new ATOM 0 HB2 LEU A 79 5.785 14.009 5.113 1.00 52.22 H new ATOM 0 HB3 LEU A 79 4.938 14.912 6.354 1.00 52.22 H new ATOM 0 HG LEU A 79 7.902 14.220 6.309 1.00 0.45 H new ATOM 0 HD11 LEU A 79 8.242 16.674 6.193 1.00 64.24 H new ATOM 0 HD12 LEU A 79 7.323 16.058 4.799 1.00 64.24 H new ATOM 0 HD13 LEU A 79 6.479 16.905 6.117 1.00 64.24 H new ATOM 0 HD21 LEU A 79 8.106 15.547 8.404 1.00 11.13 H new ATOM 0 HD22 LEU A 79 6.334 15.701 8.468 1.00 11.13 H new ATOM 0 HD23 LEU A 79 7.095 14.100 8.628 1.00 11.13 H new ATOM 1249 N HIS A 80 3.141 12.657 7.737 1.00 63.03 N ATOM 1250 CA HIS A 80 1.710 12.420 7.659 1.00 32.13 C ATOM 1251 C HIS A 80 1.077 13.640 7.001 1.00 12.23 C ATOM 1252 O HIS A 80 0.838 14.671 7.650 1.00 13.14 O ATOM 1253 CB HIS A 80 1.151 12.170 9.081 1.00 54.33 C ATOM 1254 CG HIS A 80 -0.325 11.876 9.163 1.00 33.24 C ATOM 1255 ND1 HIS A 80 -1.073 12.289 10.236 1.00 4.14 N ATOM 1256 CD2 HIS A 80 -1.118 11.170 8.323 1.00 31.30 C ATOM 1257 CE1 HIS A 80 -2.287 11.825 10.031 1.00 24.53 C ATOM 1258 NE2 HIS A 80 -2.367 11.139 8.886 1.00 40.14 N ATOM 0 H HIS A 80 3.460 12.959 8.658 1.00 63.03 H new ATOM 0 HA HIS A 80 1.480 11.536 7.064 1.00 32.13 H new ATOM 0 HB2 HIS A 80 1.694 11.334 9.523 1.00 54.33 H new ATOM 0 HB3 HIS A 80 1.362 13.047 9.693 1.00 54.33 H new ATOM 0 HD1 HIS A 80 -0.753 12.843 11.031 1.00 4.14 H new ATOM 0 HD2 HIS A 80 -0.823 10.718 7.388 1.00 31.30 H new ATOM 0 HE1 HIS A 80 -3.117 11.979 10.705 1.00 24.53 H new ATOM 1266 N VAL A 81 0.841 13.516 5.697 1.00 22.31 N ATOM 1267 CA VAL A 81 0.286 14.601 4.891 1.00 53.32 C ATOM 1268 C VAL A 81 -1.228 14.451 4.789 1.00 11.25 C ATOM 1269 O VAL A 81 -1.936 15.436 4.863 1.00 50.30 O ATOM 1270 CB VAL A 81 0.952 14.680 3.463 1.00 52.00 C ATOM 1271 CG1 VAL A 81 2.473 14.939 3.584 1.00 41.41 C ATOM 1272 CG2 VAL A 81 0.664 13.416 2.624 1.00 45.12 C ATOM 0 H VAL A 81 1.028 12.663 5.170 1.00 22.31 H new ATOM 0 HA VAL A 81 0.513 15.542 5.391 1.00 53.32 H new ATOM 0 HB VAL A 81 0.503 15.521 2.935 1.00 52.00 H new ATOM 0 HG11 VAL A 81 2.914 14.990 2.588 1.00 41.41 H new ATOM 0 HG12 VAL A 81 2.641 15.882 4.104 1.00 41.41 H new ATOM 0 HG13 VAL A 81 2.937 14.128 4.145 1.00 41.41 H new ATOM 0 HG21 VAL A 81 1.140 13.511 1.648 1.00 45.12 H new ATOM 0 HG22 VAL A 81 1.060 12.540 3.138 1.00 45.12 H new ATOM 0 HG23 VAL A 81 -0.412 13.304 2.493 1.00 45.12 H new ATOM 1282 N ALA A 82 -1.728 13.205 4.695 1.00 11.32 N ATOM 1283 CA ALA A 82 -3.158 12.953 4.427 1.00 10.23 C ATOM 1284 C ALA A 82 -3.704 11.806 5.284 1.00 25.02 C ATOM 1285 O ALA A 82 -2.946 10.994 5.807 1.00 44.53 O ATOM 1286 CB ALA A 82 -3.355 12.660 2.935 1.00 33.31 C ATOM 0 H ALA A 82 -1.167 12.360 4.800 1.00 11.32 H new ATOM 0 HA ALA A 82 -3.720 13.847 4.697 1.00 10.23 H new ATOM 0 HB1 ALA A 82 -4.411 12.474 2.737 1.00 33.31 H new ATOM 0 HB2 ALA A 82 -3.021 13.516 2.349 1.00 33.31 H new ATOM 0 HB3 ALA A 82 -2.773 11.781 2.657 1.00 33.31 H new ATOM 1292 N THR A 83 -5.036 11.777 5.443 1.00 35.10 N ATOM 1293 CA THR A 83 -5.769 10.695 6.113 1.00 73.23 C ATOM 1294 C THR A 83 -6.998 10.362 5.256 1.00 73.21 C ATOM 1295 O THR A 83 -7.836 11.230 5.004 1.00 71.13 O ATOM 1296 CB THR A 83 -6.218 11.117 7.552 1.00 74.42 C ATOM 1297 OG1 THR A 83 -5.074 11.546 8.305 1.00 3.02 O ATOM 1298 CG2 THR A 83 -6.926 9.972 8.308 1.00 64.53 C ATOM 0 H THR A 83 -5.645 12.521 5.102 1.00 35.10 H new ATOM 0 HA THR A 83 -5.121 9.825 6.218 1.00 73.23 H new ATOM 0 HB THR A 83 -6.934 11.932 7.443 1.00 74.42 H new ATOM 0 HG1 THR A 83 -4.299 10.997 8.064 1.00 3.02 H new ATOM 0 HG21 THR A 83 -7.217 10.317 9.300 1.00 64.53 H new ATOM 0 HG22 THR A 83 -7.814 9.666 7.755 1.00 64.53 H new ATOM 0 HG23 THR A 83 -6.247 9.124 8.403 1.00 64.53 H new ATOM 1306 N LEU A 84 -7.092 9.114 4.803 1.00 20.15 N ATOM 1307 CA LEU A 84 -8.108 8.687 3.836 1.00 54.42 C ATOM 1308 C LEU A 84 -9.283 8.054 4.603 1.00 41.33 C ATOM 1309 O LEU A 84 -9.155 6.953 5.149 1.00 10.22 O ATOM 1310 CB LEU A 84 -7.465 7.710 2.811 1.00 35.52 C ATOM 1311 CG LEU A 84 -6.050 8.125 2.269 1.00 21.21 C ATOM 1312 CD1 LEU A 84 -5.543 7.115 1.228 1.00 72.20 C ATOM 1313 CD2 LEU A 84 -6.022 9.576 1.718 1.00 54.21 C ATOM 0 H LEU A 84 -6.464 8.365 5.096 1.00 20.15 H new ATOM 0 HA LEU A 84 -8.497 9.534 3.271 1.00 54.42 H new ATOM 0 HB2 LEU A 84 -7.382 6.728 3.276 1.00 35.52 H new ATOM 0 HB3 LEU A 84 -8.142 7.605 1.963 1.00 35.52 H new ATOM 0 HG LEU A 84 -5.367 8.109 3.118 1.00 21.21 H new ATOM 0 HD11 LEU A 84 -4.562 7.425 0.868 1.00 72.20 H new ATOM 0 HD12 LEU A 84 -5.467 6.128 1.685 1.00 72.20 H new ATOM 0 HD13 LEU A 84 -6.240 7.074 0.391 1.00 72.20 H new ATOM 0 HD21 LEU A 84 -5.020 9.809 1.357 1.00 54.21 H new ATOM 0 HD22 LEU A 84 -6.734 9.667 0.897 1.00 54.21 H new ATOM 0 HD23 LEU A 84 -6.292 10.272 2.512 1.00 54.21 H new ATOM 1325 N SER A 85 -10.391 8.800 4.685 1.00 52.13 N ATOM 1326 CA SER A 85 -11.589 8.422 5.445 1.00 23.52 C ATOM 1327 C SER A 85 -12.575 7.653 4.536 1.00 51.10 C ATOM 1328 O SER A 85 -13.052 8.203 3.537 1.00 10.32 O ATOM 1329 CB SER A 85 -12.230 9.716 6.009 1.00 63.15 C ATOM 1330 OG SER A 85 -13.402 9.460 6.765 1.00 24.05 O ATOM 0 H SER A 85 -10.482 9.701 4.216 1.00 52.13 H new ATOM 0 HA SER A 85 -11.327 7.760 6.271 1.00 23.52 H new ATOM 0 HB2 SER A 85 -11.504 10.233 6.636 1.00 63.15 H new ATOM 0 HB3 SER A 85 -12.473 10.386 5.184 1.00 63.15 H new ATOM 0 HG SER A 85 -13.767 10.306 7.100 1.00 24.05 H new ATOM 1336 N PHE A 86 -12.873 6.387 4.893 1.00 21.11 N ATOM 1337 CA PHE A 86 -13.745 5.494 4.098 1.00 4.13 C ATOM 1338 C PHE A 86 -14.435 4.464 5.010 1.00 4.24 C ATOM 1339 O PHE A 86 -14.265 4.482 6.234 1.00 42.31 O ATOM 1340 CB PHE A 86 -12.925 4.775 2.981 1.00 52.43 C ATOM 1341 CG PHE A 86 -11.766 3.898 3.472 1.00 24.55 C ATOM 1342 CD1 PHE A 86 -10.529 4.457 3.793 1.00 60.03 C ATOM 1343 CD2 PHE A 86 -11.912 2.517 3.601 1.00 42.54 C ATOM 1344 CE1 PHE A 86 -9.481 3.667 4.227 1.00 10.20 C ATOM 1345 CE2 PHE A 86 -10.869 1.730 4.035 1.00 23.34 C ATOM 1346 CZ PHE A 86 -9.652 2.304 4.349 1.00 74.53 C ATOM 0 H PHE A 86 -12.515 5.952 5.744 1.00 21.11 H new ATOM 0 HA PHE A 86 -14.514 6.101 3.620 1.00 4.13 H new ATOM 0 HB2 PHE A 86 -13.605 4.154 2.398 1.00 52.43 H new ATOM 0 HB3 PHE A 86 -12.525 5.531 2.305 1.00 52.43 H new ATOM 0 HD1 PHE A 86 -10.388 5.524 3.701 1.00 60.03 H new ATOM 0 HD2 PHE A 86 -12.858 2.058 3.357 1.00 42.54 H new ATOM 0 HE1 PHE A 86 -8.530 4.117 4.470 1.00 10.20 H new ATOM 0 HE2 PHE A 86 -11.002 0.662 4.130 1.00 23.34 H new ATOM 0 HZ PHE A 86 -8.835 1.685 4.690 1.00 74.53 H new ATOM 1356 N ASP A 87 -15.217 3.569 4.384 1.00 44.11 N ATOM 1357 CA ASP A 87 -15.889 2.444 5.060 1.00 51.03 C ATOM 1358 C ASP A 87 -15.284 1.123 4.565 1.00 32.33 C ATOM 1359 O ASP A 87 -14.830 1.037 3.414 1.00 21.31 O ATOM 1360 CB ASP A 87 -17.429 2.476 4.787 1.00 73.43 C ATOM 1361 CG ASP A 87 -17.842 1.997 3.374 1.00 12.44 C ATOM 1362 OD1 ASP A 87 -17.616 2.738 2.392 1.00 23.03 O ATOM 1363 OD2 ASP A 87 -18.369 0.865 3.238 1.00 21.11 O ATOM 0 H ASP A 87 -15.403 3.606 3.382 1.00 44.11 H new ATOM 0 HA ASP A 87 -15.737 2.531 6.136 1.00 51.03 H new ATOM 0 HB2 ASP A 87 -17.929 1.853 5.528 1.00 73.43 H new ATOM 0 HB3 ASP A 87 -17.789 3.495 4.931 1.00 73.43 H new ATOM 1368 N LEU A 88 -15.281 0.102 5.431 1.00 50.51 N ATOM 1369 CA LEU A 88 -14.869 -1.272 5.065 1.00 74.15 C ATOM 1370 C LEU A 88 -15.538 -2.267 6.028 1.00 44.22 C ATOM 1371 O LEU A 88 -15.548 -2.015 7.239 1.00 73.30 O ATOM 1372 CB LEU A 88 -13.320 -1.419 5.091 1.00 15.44 C ATOM 1373 CG LEU A 88 -12.733 -2.763 4.548 1.00 52.40 C ATOM 1374 CD1 LEU A 88 -13.044 -2.960 3.045 1.00 22.31 C ATOM 1375 CD2 LEU A 88 -11.218 -2.838 4.820 1.00 23.40 C ATOM 0 H LEU A 88 -15.563 0.198 6.407 1.00 50.51 H new ATOM 0 HA LEU A 88 -15.192 -1.486 4.046 1.00 74.15 H new ATOM 0 HB2 LEU A 88 -12.891 -0.602 4.512 1.00 15.44 H new ATOM 0 HB3 LEU A 88 -12.983 -1.292 6.120 1.00 15.44 H new ATOM 0 HG LEU A 88 -13.219 -3.579 5.083 1.00 52.40 H new ATOM 0 HD11 LEU A 88 -12.619 -3.905 2.706 1.00 22.31 H new ATOM 0 HD12 LEU A 88 -14.124 -2.973 2.896 1.00 22.31 H new ATOM 0 HD13 LEU A 88 -12.609 -2.141 2.473 1.00 22.31 H new ATOM 0 HD21 LEU A 88 -10.826 -3.780 4.436 1.00 23.40 H new ATOM 0 HD22 LEU A 88 -10.718 -2.007 4.323 1.00 23.40 H new ATOM 0 HD23 LEU A 88 -11.038 -2.781 5.893 1.00 23.40 H new ATOM 1387 N ASP A 89 -16.128 -3.356 5.464 1.00 64.20 N ATOM 1388 CA ASP A 89 -16.816 -4.440 6.220 1.00 31.20 C ATOM 1389 C ASP A 89 -18.150 -3.948 6.832 1.00 23.25 C ATOM 1390 O ASP A 89 -19.237 -4.243 6.314 1.00 50.03 O ATOM 1391 CB ASP A 89 -15.874 -5.051 7.295 1.00 32.04 C ATOM 1392 CG ASP A 89 -16.542 -6.092 8.217 1.00 55.14 C ATOM 1393 OD1 ASP A 89 -16.677 -7.268 7.811 1.00 20.31 O ATOM 1394 OD2 ASP A 89 -16.912 -5.742 9.363 1.00 45.14 O ATOM 0 H ASP A 89 -16.139 -3.508 4.455 1.00 64.20 H new ATOM 0 HA ASP A 89 -17.066 -5.233 5.515 1.00 31.20 H new ATOM 0 HB2 ASP A 89 -15.027 -5.520 6.793 1.00 32.04 H new ATOM 0 HB3 ASP A 89 -15.474 -4.244 7.909 1.00 32.04 H new ATOM 1399 N GLY A 90 -18.045 -3.180 7.918 1.00 73.03 N ATOM 1400 CA GLY A 90 -19.204 -2.620 8.620 1.00 13.21 C ATOM 1401 C GLY A 90 -18.806 -1.523 9.595 1.00 24.55 C ATOM 1402 O GLY A 90 -19.600 -1.143 10.464 1.00 14.14 O ATOM 0 H GLY A 90 -17.150 -2.927 8.338 1.00 73.03 H new ATOM 0 HA2 GLY A 90 -19.909 -2.219 7.892 1.00 13.21 H new ATOM 0 HA3 GLY A 90 -19.719 -3.415 9.159 1.00 13.21 H new ATOM 1406 N GLU A 91 -17.571 -1.004 9.434 1.00 42.23 N ATOM 1407 CA GLU A 91 -16.969 -0.013 10.339 1.00 73.42 C ATOM 1408 C GLU A 91 -16.365 1.157 9.541 1.00 34.42 C ATOM 1409 O GLU A 91 -16.168 1.058 8.318 1.00 13.31 O ATOM 1410 CB GLU A 91 -15.866 -0.694 11.196 1.00 55.55 C ATOM 1411 CG GLU A 91 -14.702 -1.289 10.372 1.00 24.14 C ATOM 1412 CD GLU A 91 -13.573 -1.903 11.217 1.00 32.34 C ATOM 1413 OE1 GLU A 91 -13.141 -1.260 12.205 1.00 32.45 O ATOM 1414 OE2 GLU A 91 -13.054 -2.978 10.848 1.00 1.34 O ATOM 0 H GLU A 91 -16.959 -1.267 8.661 1.00 42.23 H new ATOM 0 HA GLU A 91 -17.747 0.382 10.992 1.00 73.42 H new ATOM 0 HB2 GLU A 91 -15.464 0.037 11.898 1.00 55.55 H new ATOM 0 HB3 GLU A 91 -16.320 -1.488 11.789 1.00 55.55 H new ATOM 0 HG2 GLU A 91 -15.099 -2.056 9.706 1.00 24.14 H new ATOM 0 HG3 GLU A 91 -14.282 -0.506 9.741 1.00 24.14 H new ATOM 1421 N SER A 92 -16.080 2.264 10.246 1.00 63.30 N ATOM 1422 CA SER A 92 -15.393 3.427 9.678 1.00 41.23 C ATOM 1423 C SER A 92 -13.869 3.218 9.804 1.00 0.31 C ATOM 1424 O SER A 92 -13.357 2.966 10.904 1.00 2.22 O ATOM 1425 CB SER A 92 -15.858 4.706 10.413 1.00 2.30 C ATOM 1426 OG SER A 92 -15.327 5.880 9.824 1.00 1.32 O ATOM 0 H SER A 92 -16.322 2.374 11.231 1.00 63.30 H new ATOM 0 HA SER A 92 -15.637 3.541 8.622 1.00 41.23 H new ATOM 0 HB2 SER A 92 -16.947 4.755 10.401 1.00 2.30 H new ATOM 0 HB3 SER A 92 -15.553 4.655 11.458 1.00 2.30 H new ATOM 0 HG SER A 92 -15.645 6.666 10.316 1.00 1.32 H new ATOM 1432 N ARG A 93 -13.161 3.280 8.667 1.00 34.12 N ATOM 1433 CA ARG A 93 -11.715 3.009 8.580 1.00 60.40 C ATOM 1434 C ARG A 93 -10.967 4.238 8.060 1.00 42.33 C ATOM 1435 O ARG A 93 -11.445 4.918 7.145 1.00 54.03 O ATOM 1436 CB ARG A 93 -11.459 1.827 7.609 1.00 74.45 C ATOM 1437 CG ARG A 93 -12.068 0.466 8.013 1.00 35.25 C ATOM 1438 CD ARG A 93 -11.264 -0.272 9.093 1.00 54.55 C ATOM 1439 NE ARG A 93 -11.333 0.373 10.412 1.00 20.01 N ATOM 1440 CZ ARG A 93 -10.270 0.749 11.154 1.00 22.20 C ATOM 1441 NH1 ARG A 93 -9.028 0.559 10.712 1.00 12.52 N ATOM 1442 NH2 ARG A 93 -10.459 1.302 12.335 1.00 24.53 N ATOM 0 H ARG A 93 -13.580 3.523 7.769 1.00 34.12 H new ATOM 0 HA ARG A 93 -11.355 2.761 9.578 1.00 60.40 H new ATOM 0 HB2 ARG A 93 -11.849 2.099 6.628 1.00 74.45 H new ATOM 0 HB3 ARG A 93 -10.382 1.701 7.500 1.00 74.45 H new ATOM 0 HG2 ARG A 93 -13.084 0.625 8.374 1.00 35.25 H new ATOM 0 HG3 ARG A 93 -12.139 -0.167 7.129 1.00 35.25 H new ATOM 0 HD2 ARG A 93 -11.634 -1.294 9.176 1.00 54.55 H new ATOM 0 HD3 ARG A 93 -10.222 -0.334 8.781 1.00 54.55 H new ATOM 0 HE ARG A 93 -12.260 0.551 10.798 1.00 20.01 H new ATOM 0 HH11 ARG A 93 -8.871 0.125 9.803 1.00 12.52 H new ATOM 0 HH12 ARG A 93 -8.234 0.848 11.283 1.00 12.52 H new ATOM 0 HH21 ARG A 93 -11.406 1.445 12.686 1.00 24.53 H new ATOM 0 HH22 ARG A 93 -9.658 1.587 12.899 1.00 24.53 H new ATOM 1456 N ASP A 94 -9.789 4.500 8.638 1.00 31.14 N ATOM 1457 CA ASP A 94 -8.842 5.512 8.129 1.00 10.14 C ATOM 1458 C ASP A 94 -7.522 4.830 7.772 1.00 43.31 C ATOM 1459 O ASP A 94 -6.997 4.044 8.562 1.00 14.01 O ATOM 1460 CB ASP A 94 -8.556 6.627 9.176 1.00 71.10 C ATOM 1461 CG ASP A 94 -9.797 7.427 9.594 1.00 71.11 C ATOM 1462 OD1 ASP A 94 -10.278 8.262 8.798 1.00 70.42 O ATOM 1463 OD2 ASP A 94 -10.291 7.229 10.729 1.00 73.15 O ATOM 0 H ASP A 94 -9.460 4.018 9.474 1.00 31.14 H new ATOM 0 HA ASP A 94 -9.296 5.976 7.253 1.00 10.14 H new ATOM 0 HB2 ASP A 94 -8.114 6.173 10.063 1.00 71.10 H new ATOM 0 HB3 ASP A 94 -7.815 7.314 8.766 1.00 71.10 H new ATOM 1468 N LEU A 95 -6.986 5.137 6.589 1.00 53.11 N ATOM 1469 CA LEU A 95 -5.599 4.795 6.228 1.00 35.22 C ATOM 1470 C LEU A 95 -4.860 6.097 5.977 1.00 53.31 C ATOM 1471 O LEU A 95 -5.286 6.901 5.157 1.00 65.34 O ATOM 1472 CB LEU A 95 -5.520 3.849 4.999 1.00 45.01 C ATOM 1473 CG LEU A 95 -5.991 2.387 5.254 1.00 12.44 C ATOM 1474 CD1 LEU A 95 -5.763 1.523 4.011 1.00 72.14 C ATOM 1475 CD2 LEU A 95 -5.294 1.771 6.485 1.00 14.41 C ATOM 0 H LEU A 95 -7.495 5.628 5.853 1.00 53.11 H new ATOM 0 HA LEU A 95 -5.135 4.243 7.046 1.00 35.22 H new ATOM 0 HB2 LEU A 95 -6.123 4.273 4.196 1.00 45.01 H new ATOM 0 HB3 LEU A 95 -4.489 3.825 4.645 1.00 45.01 H new ATOM 0 HG LEU A 95 -7.060 2.416 5.465 1.00 12.44 H new ATOM 0 HD11 LEU A 95 -6.098 0.505 4.209 1.00 72.14 H new ATOM 0 HD12 LEU A 95 -6.327 1.934 3.174 1.00 72.14 H new ATOM 0 HD13 LEU A 95 -4.701 1.514 3.764 1.00 72.14 H new ATOM 0 HD21 LEU A 95 -5.648 0.751 6.631 1.00 14.41 H new ATOM 0 HD22 LEU A 95 -4.216 1.761 6.326 1.00 14.41 H new ATOM 0 HD23 LEU A 95 -5.525 2.365 7.369 1.00 14.41 H new ATOM 1487 N HIS A 96 -3.760 6.297 6.690 1.00 4.32 N ATOM 1488 CA HIS A 96 -3.026 7.556 6.666 1.00 52.12 C ATOM 1489 C HIS A 96 -2.035 7.501 5.504 1.00 53.52 C ATOM 1490 O HIS A 96 -1.273 6.539 5.392 1.00 72.22 O ATOM 1491 CB HIS A 96 -2.290 7.748 8.013 1.00 30.41 C ATOM 1492 CG HIS A 96 -3.163 7.824 9.248 1.00 72.33 C ATOM 1493 ND1 HIS A 96 -2.641 8.232 10.453 1.00 3.43 N ATOM 1494 CD2 HIS A 96 -4.479 7.532 9.427 1.00 5.12 C ATOM 1495 CE1 HIS A 96 -3.635 8.176 11.318 1.00 63.53 C ATOM 1496 NE2 HIS A 96 -4.764 7.762 10.741 1.00 64.41 N ATOM 0 H HIS A 96 -3.351 5.591 7.302 1.00 4.32 H new ATOM 0 HA HIS A 96 -3.702 8.400 6.528 1.00 52.12 H new ATOM 0 HB2 HIS A 96 -1.588 6.924 8.140 1.00 30.41 H new ATOM 0 HB3 HIS A 96 -1.700 8.663 7.954 1.00 30.41 H new ATOM 0 HD1 HIS A 96 -1.680 8.519 10.640 1.00 3.43 H new ATOM 0 HD2 HIS A 96 -5.168 7.184 8.672 1.00 5.12 H new ATOM 0 HE1 HIS A 96 -3.546 8.433 12.363 1.00 63.53 H new ATOM 1504 N ALA A 97 -2.061 8.525 4.643 1.00 20.24 N ATOM 1505 CA ALA A 97 -1.262 8.571 3.418 1.00 20.21 C ATOM 1506 C ALA A 97 -0.044 9.451 3.670 1.00 1.44 C ATOM 1507 O ALA A 97 -0.182 10.621 4.056 1.00 50.31 O ATOM 1508 CB ALA A 97 -2.107 9.106 2.254 1.00 13.15 C ATOM 0 H ALA A 97 -2.643 9.351 4.780 1.00 20.24 H new ATOM 0 HA ALA A 97 -0.929 7.570 3.145 1.00 20.21 H new ATOM 0 HB1 ALA A 97 -1.501 9.136 1.348 1.00 13.15 H new ATOM 0 HB2 ALA A 97 -2.964 8.452 2.096 1.00 13.15 H new ATOM 0 HB3 ALA A 97 -2.456 10.111 2.490 1.00 13.15 H new ATOM 1514 N PHE A 98 1.143 8.865 3.485 1.00 2.43 N ATOM 1515 CA PHE A 98 2.418 9.505 3.833 1.00 51.34 C ATOM 1516 C PHE A 98 3.317 9.672 2.596 1.00 64.31 C ATOM 1517 O PHE A 98 3.015 9.171 1.505 1.00 4.53 O ATOM 1518 CB PHE A 98 3.182 8.644 4.871 1.00 32.01 C ATOM 1519 CG PHE A 98 2.395 8.182 6.093 1.00 41.14 C ATOM 1520 CD1 PHE A 98 2.264 8.995 7.203 1.00 75.15 C ATOM 1521 CD2 PHE A 98 1.831 6.907 6.148 1.00 50.40 C ATOM 1522 CE1 PHE A 98 1.600 8.556 8.325 1.00 2.41 C ATOM 1523 CE2 PHE A 98 1.166 6.469 7.272 1.00 53.24 C ATOM 1524 CZ PHE A 98 1.052 7.297 8.362 1.00 34.22 C ATOM 0 H PHE A 98 1.248 7.931 3.089 1.00 2.43 H new ATOM 0 HA PHE A 98 2.186 10.487 4.246 1.00 51.34 H new ATOM 0 HB2 PHE A 98 3.568 7.761 4.362 1.00 32.01 H new ATOM 0 HB3 PHE A 98 4.044 9.215 5.218 1.00 32.01 H new ATOM 0 HD1 PHE A 98 2.688 9.988 7.189 1.00 75.15 H new ATOM 0 HD2 PHE A 98 1.917 6.252 5.294 1.00 50.40 H new ATOM 0 HE1 PHE A 98 1.509 9.206 9.183 1.00 2.41 H new ATOM 0 HE2 PHE A 98 0.736 5.479 7.296 1.00 53.24 H new ATOM 0 HZ PHE A 98 0.533 6.959 9.246 1.00 34.22 H new ATOM 1534 N ARG A 99 4.430 10.382 2.822 1.00 32.31 N ATOM 1535 CA ARG A 99 5.600 10.430 1.932 1.00 3.44 C ATOM 1536 C ARG A 99 6.780 10.989 2.733 1.00 1.31 C ATOM 1537 O ARG A 99 6.570 11.864 3.575 1.00 40.42 O ATOM 1538 CB ARG A 99 5.344 11.248 0.641 1.00 32.55 C ATOM 1539 CG ARG A 99 4.884 12.727 0.823 1.00 35.32 C ATOM 1540 CD ARG A 99 3.461 12.976 0.284 1.00 61.15 C ATOM 1541 NE ARG A 99 3.308 12.529 -1.124 1.00 23.42 N ATOM 1542 CZ ARG A 99 2.755 13.248 -2.120 1.00 24.00 C ATOM 1543 NH1 ARG A 99 2.288 14.473 -1.906 1.00 64.24 N ATOM 1544 NH2 ARG A 99 2.668 12.725 -3.329 1.00 20.42 N ATOM 0 H ARG A 99 4.546 10.958 3.656 1.00 32.31 H new ATOM 0 HA ARG A 99 5.823 9.421 1.586 1.00 3.44 H new ATOM 0 HB2 ARG A 99 6.261 11.248 0.052 1.00 32.55 H new ATOM 0 HB3 ARG A 99 4.588 10.727 0.054 1.00 32.55 H new ATOM 0 HG2 ARG A 99 4.918 12.987 1.881 1.00 35.32 H new ATOM 0 HG3 ARG A 99 5.584 13.387 0.310 1.00 35.32 H new ATOM 0 HD2 ARG A 99 2.740 12.451 0.910 1.00 61.15 H new ATOM 0 HD3 ARG A 99 3.229 14.039 0.353 1.00 61.15 H new ATOM 0 HE ARG A 99 3.651 11.597 -1.357 1.00 23.42 H new ATOM 0 HH11 ARG A 99 2.345 14.885 -0.975 1.00 64.24 H new ATOM 0 HH12 ARG A 99 1.873 15.002 -2.673 1.00 64.24 H new ATOM 0 HH21 ARG A 99 3.018 11.783 -3.504 1.00 20.42 H new ATOM 0 HH22 ARG A 99 2.251 13.263 -4.089 1.00 20.42 H new ATOM 1558 N GLN A 100 8.001 10.492 2.433 1.00 53.22 N ATOM 1559 CA GLN A 100 9.196 10.646 3.298 1.00 3.13 C ATOM 1560 C GLN A 100 9.435 12.109 3.734 1.00 22.32 C ATOM 1561 O GLN A 100 9.264 12.440 4.920 1.00 64.40 O ATOM 1562 CB GLN A 100 10.444 10.058 2.597 1.00 72.54 C ATOM 1563 CG GLN A 100 10.315 8.563 2.218 1.00 14.30 C ATOM 1564 CD GLN A 100 11.583 7.950 1.613 1.00 12.22 C ATOM 1565 OE1 GLN A 100 12.748 8.373 2.083 1.00 24.53 O flip ATOM 1566 NE2 GLN A 100 11.520 7.071 0.751 1.00 40.21 N flip ATOM 0 H GLN A 100 8.188 9.969 1.578 1.00 53.22 H new ATOM 0 HA GLN A 100 9.007 10.084 4.213 1.00 3.13 H new ATOM 0 HB2 GLN A 100 10.644 10.634 1.694 1.00 72.54 H new ATOM 0 HB3 GLN A 100 11.307 10.182 3.252 1.00 72.54 H new ATOM 0 HG2 GLN A 100 10.042 7.997 3.109 1.00 14.30 H new ATOM 0 HG3 GLN A 100 9.497 8.451 1.506 1.00 14.30 H new ATOM 0 HE21 GLN A 100 10.612 6.761 0.404 1.00 40.21 H new ATOM 0 HE22 GLN A 100 12.376 6.654 0.385 1.00 40.21 H new ATOM 1575 N ALA A 101 9.824 12.980 2.785 1.00 11.04 N ATOM 1576 CA ALA A 101 9.975 14.419 3.057 1.00 61.25 C ATOM 1577 C ALA A 101 8.990 15.250 2.218 1.00 24.34 C ATOM 1578 O ALA A 101 7.920 15.636 2.703 1.00 63.51 O ATOM 1579 CB ALA A 101 11.437 14.857 2.823 1.00 4.12 C ATOM 0 H ALA A 101 10.039 12.712 1.825 1.00 11.04 H new ATOM 0 HA ALA A 101 9.733 14.601 4.104 1.00 61.25 H new ATOM 0 HB1 ALA A 101 11.535 15.923 3.028 1.00 4.12 H new ATOM 0 HB2 ALA A 101 12.095 14.298 3.488 1.00 4.12 H new ATOM 0 HB3 ALA A 101 11.715 14.659 1.788 1.00 4.12 H new ATOM 1585 N ALA A 102 9.328 15.466 0.937 1.00 41.54 N ATOM 1586 CA ALA A 102 8.594 16.394 0.049 1.00 30.43 C ATOM 1587 C ALA A 102 8.304 15.745 -1.309 1.00 41.12 C ATOM 1588 O ALA A 102 8.346 16.426 -2.343 1.00 73.14 O ATOM 1589 CB ALA A 102 9.417 17.696 -0.095 1.00 75.44 C ATOM 0 H ALA A 102 10.117 15.005 0.484 1.00 41.54 H new ATOM 0 HA ALA A 102 7.625 16.635 0.486 1.00 30.43 H new ATOM 0 HB1 ALA A 102 8.888 18.391 -0.748 1.00 75.44 H new ATOM 0 HB2 ALA A 102 9.552 18.151 0.886 1.00 75.44 H new ATOM 0 HB3 ALA A 102 10.391 17.465 -0.525 1.00 75.44 H new ATOM 1595 N ASP A 103 7.975 14.440 -1.299 1.00 65.14 N ATOM 1596 CA ASP A 103 7.835 13.627 -2.529 1.00 51.30 C ATOM 1597 C ASP A 103 6.671 14.151 -3.405 1.00 45.01 C ATOM 1598 O ASP A 103 5.574 14.396 -2.901 1.00 50.34 O ATOM 1599 CB ASP A 103 7.588 12.139 -2.163 1.00 45.15 C ATOM 1600 CG ASP A 103 8.678 11.545 -1.243 1.00 12.34 C ATOM 1601 OD1 ASP A 103 8.738 11.938 -0.050 1.00 21.45 O ATOM 1602 OD2 ASP A 103 9.473 10.692 -1.693 1.00 30.40 O ATOM 0 H ASP A 103 7.798 13.917 -0.441 1.00 65.14 H new ATOM 0 HA ASP A 103 8.762 13.708 -3.097 1.00 51.30 H new ATOM 0 HB2 ASP A 103 6.619 12.049 -1.671 1.00 45.15 H new ATOM 0 HB3 ASP A 103 7.536 11.551 -3.079 1.00 45.15 H new ATOM 1607 N GLU A 104 6.937 14.295 -4.716 1.00 62.31 N ATOM 1608 CA GLU A 104 5.974 14.835 -5.709 1.00 75.14 C ATOM 1609 C GLU A 104 5.741 13.810 -6.833 1.00 3.53 C ATOM 1610 O GLU A 104 5.111 14.121 -7.846 1.00 72.23 O ATOM 1611 CB GLU A 104 6.472 16.192 -6.280 1.00 3.44 C ATOM 1612 CG GLU A 104 6.612 17.310 -5.227 1.00 2.44 C ATOM 1613 CD GLU A 104 7.006 18.663 -5.837 1.00 41.11 C ATOM 1614 OE1 GLU A 104 8.209 18.885 -6.097 1.00 33.31 O ATOM 1615 OE2 GLU A 104 6.113 19.515 -6.064 1.00 13.15 O ATOM 0 H GLU A 104 7.835 14.039 -5.126 1.00 62.31 H new ATOM 0 HA GLU A 104 5.022 15.017 -5.210 1.00 75.14 H new ATOM 0 HB2 GLU A 104 7.438 16.038 -6.760 1.00 3.44 H new ATOM 0 HB3 GLU A 104 5.780 16.523 -7.055 1.00 3.44 H new ATOM 0 HG2 GLU A 104 5.668 17.419 -4.694 1.00 2.44 H new ATOM 0 HG3 GLU A 104 7.361 17.017 -4.492 1.00 2.44 H new ATOM 1622 N SER A 105 6.190 12.552 -6.604 1.00 43.05 N ATOM 1623 CA SER A 105 5.983 11.417 -7.531 1.00 61.43 C ATOM 1624 C SER A 105 4.563 10.799 -7.369 1.00 65.31 C ATOM 1625 O SER A 105 4.319 9.672 -7.817 1.00 33.10 O ATOM 1626 CB SER A 105 7.093 10.357 -7.281 1.00 50.14 C ATOM 1627 OG SER A 105 7.029 9.279 -8.203 1.00 31.31 O ATOM 0 H SER A 105 6.710 12.297 -5.764 1.00 43.05 H new ATOM 0 HA SER A 105 6.050 11.776 -8.558 1.00 61.43 H new ATOM 0 HB2 SER A 105 8.070 10.835 -7.352 1.00 50.14 H new ATOM 0 HB3 SER A 105 7.000 9.970 -6.266 1.00 50.14 H new ATOM 0 HG SER A 105 6.091 9.064 -8.390 1.00 31.31 H new ATOM 1633 N ARG A 106 3.640 11.560 -6.716 1.00 44.24 N ATOM 1634 CA ARG A 106 2.229 11.149 -6.460 1.00 44.32 C ATOM 1635 C ARG A 106 2.186 9.921 -5.534 1.00 35.52 C ATOM 1636 O ARG A 106 1.144 9.310 -5.351 1.00 14.32 O ATOM 1637 CB ARG A 106 1.453 10.905 -7.806 1.00 32.41 C ATOM 1638 CG ARG A 106 1.659 12.017 -8.879 1.00 1.04 C ATOM 1639 CD ARG A 106 1.389 13.435 -8.342 1.00 55.42 C ATOM 1640 NE ARG A 106 1.789 14.498 -9.288 1.00 3.14 N ATOM 1641 CZ ARG A 106 2.442 15.637 -8.960 1.00 75.03 C ATOM 1642 NH1 ARG A 106 2.787 15.896 -7.700 1.00 62.31 N ATOM 1643 NH2 ARG A 106 2.729 16.529 -9.895 1.00 22.35 N ATOM 0 H ARG A 106 3.857 12.486 -6.349 1.00 44.24 H new ATOM 0 HA ARG A 106 1.718 11.964 -5.948 1.00 44.32 H new ATOM 0 HB2 ARG A 106 1.769 9.950 -8.225 1.00 32.41 H new ATOM 0 HB3 ARG A 106 0.388 10.821 -7.587 1.00 32.41 H new ATOM 0 HG2 ARG A 106 2.681 11.966 -9.254 1.00 1.04 H new ATOM 0 HG3 ARG A 106 0.999 11.824 -9.725 1.00 1.04 H new ATOM 0 HD2 ARG A 106 0.327 13.536 -8.118 1.00 55.42 H new ATOM 0 HD3 ARG A 106 1.927 13.570 -7.404 1.00 55.42 H new ATOM 0 HE ARG A 106 1.553 14.362 -10.271 1.00 3.14 H new ATOM 0 HH11 ARG A 106 2.559 15.230 -6.962 1.00 62.31 H new ATOM 0 HH12 ARG A 106 3.279 16.760 -7.473 1.00 62.31 H new ATOM 0 HH21 ARG A 106 2.458 16.358 -10.863 1.00 22.35 H new ATOM 0 HH22 ARG A 106 3.221 17.387 -9.647 1.00 22.35 H new ATOM 1657 N THR A 107 3.328 9.638 -4.878 1.00 43.32 N ATOM 1658 CA THR A 107 3.524 8.416 -4.106 1.00 51.20 C ATOM 1659 C THR A 107 2.997 8.623 -2.673 1.00 22.24 C ATOM 1660 O THR A 107 3.590 9.363 -1.873 1.00 2.14 O ATOM 1661 CB THR A 107 5.041 8.020 -4.099 1.00 44.54 C ATOM 1662 OG1 THR A 107 5.541 8.028 -5.447 1.00 34.23 O ATOM 1663 CG2 THR A 107 5.292 6.630 -3.485 1.00 51.34 C ATOM 0 H THR A 107 4.137 10.259 -4.875 1.00 43.32 H new ATOM 0 HA THR A 107 2.967 7.600 -4.566 1.00 51.20 H new ATOM 0 HB THR A 107 5.560 8.753 -3.481 1.00 44.54 H new ATOM 0 HG1 THR A 107 4.962 7.477 -6.014 1.00 34.23 H new ATOM 0 HG21 THR A 107 6.359 6.410 -3.507 1.00 51.34 H new ATOM 0 HG22 THR A 107 4.941 6.619 -2.453 1.00 51.34 H new ATOM 0 HG23 THR A 107 4.754 5.876 -4.059 1.00 51.34 H new ATOM 1671 N LEU A 108 1.833 8.021 -2.409 1.00 41.24 N ATOM 1672 CA LEU A 108 1.190 7.989 -1.092 1.00 3.03 C ATOM 1673 C LEU A 108 1.264 6.559 -0.563 1.00 3.43 C ATOM 1674 O LEU A 108 0.700 5.637 -1.164 1.00 71.11 O ATOM 1675 CB LEU A 108 -0.285 8.453 -1.200 1.00 45.15 C ATOM 1676 CG LEU A 108 -0.508 9.904 -1.722 1.00 42.33 C ATOM 1677 CD1 LEU A 108 -2.011 10.207 -1.860 1.00 64.52 C ATOM 1678 CD2 LEU A 108 0.191 10.941 -0.813 1.00 41.03 C ATOM 0 H LEU A 108 1.298 7.529 -3.125 1.00 41.24 H new ATOM 0 HA LEU A 108 1.701 8.666 -0.408 1.00 3.03 H new ATOM 0 HB2 LEU A 108 -0.814 7.765 -1.860 1.00 45.15 H new ATOM 0 HB3 LEU A 108 -0.745 8.368 -0.216 1.00 45.15 H new ATOM 0 HG LEU A 108 -0.056 9.980 -2.711 1.00 42.33 H new ATOM 0 HD11 LEU A 108 -2.145 11.225 -2.226 1.00 64.52 H new ATOM 0 HD12 LEU A 108 -2.460 9.506 -2.564 1.00 64.52 H new ATOM 0 HD13 LEU A 108 -2.494 10.104 -0.888 1.00 64.52 H new ATOM 0 HD21 LEU A 108 0.017 11.943 -1.204 1.00 41.03 H new ATOM 0 HD22 LEU A 108 -0.213 10.870 0.197 1.00 41.03 H new ATOM 0 HD23 LEU A 108 1.262 10.742 -0.790 1.00 41.03 H new ATOM 1690 N PHE A 109 1.971 6.373 0.547 1.00 63.41 N ATOM 1691 CA PHE A 109 2.199 5.049 1.125 1.00 13.52 C ATOM 1692 C PHE A 109 1.227 4.862 2.300 1.00 54.40 C ATOM 1693 O PHE A 109 1.249 5.654 3.248 1.00 62.23 O ATOM 1694 CB PHE A 109 3.675 4.937 1.583 1.00 15.22 C ATOM 1695 CG PHE A 109 4.119 3.516 1.934 1.00 32.11 C ATOM 1696 CD1 PHE A 109 4.544 2.633 0.938 1.00 50.55 C ATOM 1697 CD2 PHE A 109 4.113 3.064 3.251 1.00 4.25 C ATOM 1698 CE1 PHE A 109 4.953 1.350 1.255 1.00 42.41 C ATOM 1699 CE2 PHE A 109 4.516 1.784 3.569 1.00 52.03 C ATOM 1700 CZ PHE A 109 4.938 0.927 2.571 1.00 13.01 C ATOM 0 H PHE A 109 2.402 7.133 1.072 1.00 63.41 H new ATOM 0 HA PHE A 109 2.018 4.264 0.391 1.00 13.52 H new ATOM 0 HB2 PHE A 109 4.319 5.321 0.792 1.00 15.22 H new ATOM 0 HB3 PHE A 109 3.823 5.577 2.453 1.00 15.22 H new ATOM 0 HD1 PHE A 109 4.553 2.956 -0.092 1.00 50.55 H new ATOM 0 HD2 PHE A 109 3.787 3.728 4.038 1.00 4.25 H new ATOM 0 HE1 PHE A 109 5.284 0.680 0.475 1.00 42.41 H new ATOM 0 HE2 PHE A 109 4.502 1.452 4.597 1.00 52.03 H new ATOM 0 HZ PHE A 109 5.257 -0.075 2.819 1.00 13.01 H new ATOM 1710 N VAL A 110 0.349 3.844 2.212 1.00 70.02 N ATOM 1711 CA VAL A 110 -0.605 3.499 3.292 1.00 32.32 C ATOM 1712 C VAL A 110 -0.348 2.052 3.786 1.00 63.53 C ATOM 1713 O VAL A 110 -0.833 1.079 3.192 1.00 42.31 O ATOM 1714 CB VAL A 110 -2.131 3.704 2.870 1.00 21.14 C ATOM 1715 CG1 VAL A 110 -2.486 5.198 2.724 1.00 73.21 C ATOM 1716 CG2 VAL A 110 -2.497 2.957 1.567 1.00 32.34 C ATOM 0 H VAL A 110 0.279 3.238 1.395 1.00 70.02 H new ATOM 0 HA VAL A 110 -0.427 4.195 4.112 1.00 32.32 H new ATOM 0 HB VAL A 110 -2.720 3.274 3.681 1.00 21.14 H new ATOM 0 HG11 VAL A 110 -3.533 5.297 2.436 1.00 73.21 H new ATOM 0 HG12 VAL A 110 -2.322 5.706 3.675 1.00 73.21 H new ATOM 0 HG13 VAL A 110 -1.855 5.649 1.958 1.00 73.21 H new ATOM 0 HG21 VAL A 110 -3.546 3.133 1.329 1.00 32.34 H new ATOM 0 HG22 VAL A 110 -1.874 3.323 0.751 1.00 32.34 H new ATOM 0 HG23 VAL A 110 -2.329 1.888 1.701 1.00 32.34 H new ATOM 1726 N PRO A 111 0.472 1.874 4.873 1.00 53.23 N ATOM 1727 CA PRO A 111 0.652 0.555 5.507 1.00 73.52 C ATOM 1728 C PRO A 111 -0.607 0.184 6.307 1.00 33.20 C ATOM 1729 O PRO A 111 -1.204 1.054 6.953 1.00 65.05 O ATOM 1730 CB PRO A 111 1.887 0.764 6.417 1.00 3.41 C ATOM 1731 CG PRO A 111 1.852 2.217 6.779 1.00 25.15 C ATOM 1732 CD PRO A 111 1.267 2.933 5.574 1.00 62.33 C ATOM 0 HA PRO A 111 0.801 -0.263 4.803 1.00 73.52 H new ATOM 0 HB2 PRO A 111 1.836 0.134 7.305 1.00 3.41 H new ATOM 0 HB3 PRO A 111 2.810 0.508 5.897 1.00 3.41 H new ATOM 0 HG2 PRO A 111 1.242 2.384 7.667 1.00 25.15 H new ATOM 0 HG3 PRO A 111 2.852 2.587 7.006 1.00 25.15 H new ATOM 0 HD2 PRO A 111 0.638 3.771 5.874 1.00 62.33 H new ATOM 0 HD3 PRO A 111 2.049 3.336 4.931 1.00 62.33 H new ATOM 1740 N PHE A 112 -1.025 -1.089 6.255 1.00 20.23 N ATOM 1741 CA PHE A 112 -2.214 -1.557 6.986 1.00 52.32 C ATOM 1742 C PHE A 112 -2.015 -2.995 7.472 1.00 65.52 C ATOM 1743 O PHE A 112 -1.177 -3.735 6.948 1.00 75.03 O ATOM 1744 CB PHE A 112 -3.510 -1.419 6.124 1.00 63.04 C ATOM 1745 CG PHE A 112 -3.687 -2.429 4.985 1.00 14.24 C ATOM 1746 CD1 PHE A 112 -3.204 -2.174 3.700 1.00 34.03 C ATOM 1747 CD2 PHE A 112 -4.368 -3.636 5.203 1.00 72.14 C ATOM 1748 CE1 PHE A 112 -3.397 -3.090 2.684 1.00 41.30 C ATOM 1749 CE2 PHE A 112 -4.555 -4.543 4.186 1.00 21.14 C ATOM 1750 CZ PHE A 112 -4.070 -4.269 2.925 1.00 63.14 C ATOM 0 H PHE A 112 -0.557 -1.815 5.713 1.00 20.23 H new ATOM 0 HA PHE A 112 -2.344 -0.919 7.860 1.00 52.32 H new ATOM 0 HB2 PHE A 112 -4.371 -1.500 6.788 1.00 63.04 H new ATOM 0 HB3 PHE A 112 -3.530 -0.416 5.697 1.00 63.04 H new ATOM 0 HD1 PHE A 112 -2.676 -1.254 3.499 1.00 34.03 H new ATOM 0 HD2 PHE A 112 -4.753 -3.857 6.188 1.00 72.14 H new ATOM 0 HE1 PHE A 112 -3.018 -2.881 1.694 1.00 41.30 H new ATOM 0 HE2 PHE A 112 -5.080 -5.467 4.375 1.00 21.14 H new ATOM 0 HZ PHE A 112 -4.217 -4.979 2.125 1.00 63.14 H new ATOM 1760 N ARG A 113 -2.808 -3.386 8.473 1.00 71.43 N ATOM 1761 CA ARG A 113 -2.803 -4.752 9.011 1.00 24.04 C ATOM 1762 C ARG A 113 -4.241 -5.187 9.325 1.00 71.14 C ATOM 1763 O ARG A 113 -4.935 -4.537 10.111 1.00 70.33 O ATOM 1764 CB ARG A 113 -1.911 -4.837 10.275 1.00 52.04 C ATOM 1765 CG ARG A 113 -1.858 -6.251 10.887 1.00 22.03 C ATOM 1766 CD ARG A 113 -1.038 -6.329 12.176 1.00 5.33 C ATOM 1767 NE ARG A 113 -1.536 -5.399 13.208 1.00 73.31 N ATOM 1768 CZ ARG A 113 -1.892 -5.732 14.459 1.00 63.30 C ATOM 1769 NH1 ARG A 113 -1.833 -6.993 14.875 1.00 24.50 N ATOM 1770 NH2 ARG A 113 -2.289 -4.787 15.299 1.00 14.05 N ATOM 0 H ARG A 113 -3.473 -2.765 8.935 1.00 71.43 H new ATOM 0 HA ARG A 113 -2.387 -5.428 8.264 1.00 24.04 H new ATOM 0 HB2 ARG A 113 -0.900 -4.520 10.020 1.00 52.04 H new ATOM 0 HB3 ARG A 113 -2.285 -4.138 11.023 1.00 52.04 H new ATOM 0 HG2 ARG A 113 -2.874 -6.588 11.092 1.00 22.03 H new ATOM 0 HG3 ARG A 113 -1.435 -6.939 10.155 1.00 22.03 H new ATOM 0 HD2 ARG A 113 -1.067 -7.348 12.562 1.00 5.33 H new ATOM 0 HD3 ARG A 113 0.005 -6.101 11.956 1.00 5.33 H new ATOM 0 HE ARG A 113 -1.617 -4.416 12.948 1.00 73.31 H new ATOM 0 HH11 ARG A 113 -1.513 -7.725 14.240 1.00 24.50 H new ATOM 0 HH12 ARG A 113 -2.107 -7.229 15.829 1.00 24.50 H new ATOM 0 HH21 ARG A 113 -2.323 -3.814 14.994 1.00 14.05 H new ATOM 0 HH22 ARG A 113 -2.561 -5.032 16.251 1.00 14.05 H new ATOM 1784 N ASP A 114 -4.666 -6.303 8.728 1.00 20.31 N ATOM 1785 CA ASP A 114 -6.046 -6.795 8.799 1.00 43.11 C ATOM 1786 C ASP A 114 -6.041 -8.215 9.419 1.00 72.44 C ATOM 1787 O ASP A 114 -5.036 -8.614 10.024 1.00 30.30 O ATOM 1788 CB ASP A 114 -6.642 -6.762 7.369 1.00 33.33 C ATOM 1789 CG ASP A 114 -5.972 -7.762 6.417 1.00 42.34 C ATOM 1790 OD1 ASP A 114 -4.771 -7.604 6.103 1.00 52.42 O ATOM 1791 OD2 ASP A 114 -6.633 -8.727 6.016 1.00 4.24 O ATOM 0 H ASP A 114 -4.053 -6.900 8.173 1.00 20.31 H new ATOM 0 HA ASP A 114 -6.671 -6.170 9.437 1.00 43.11 H new ATOM 0 HB2 ASP A 114 -7.709 -6.977 7.421 1.00 33.33 H new ATOM 0 HB3 ASP A 114 -6.539 -5.756 6.962 1.00 33.33 H new ATOM 1796 N LYS A 115 -7.141 -8.985 9.256 1.00 43.11 N ATOM 1797 CA LYS A 115 -7.276 -10.325 9.880 1.00 22.32 C ATOM 1798 C LYS A 115 -6.684 -11.459 9.004 1.00 31.00 C ATOM 1799 O LYS A 115 -6.700 -12.615 9.432 1.00 5.50 O ATOM 1800 CB LYS A 115 -8.765 -10.644 10.215 1.00 31.20 C ATOM 1801 CG LYS A 115 -9.521 -9.645 11.134 1.00 51.34 C ATOM 1802 CD LYS A 115 -8.902 -9.430 12.547 1.00 73.31 C ATOM 1803 CE LYS A 115 -8.058 -8.143 12.649 1.00 61.20 C ATOM 1804 NZ LYS A 115 -7.569 -7.910 14.030 1.00 31.40 N ATOM 0 H LYS A 115 -7.948 -8.704 8.699 1.00 43.11 H new ATOM 0 HA LYS A 115 -6.698 -10.285 10.803 1.00 22.32 H new ATOM 0 HB2 LYS A 115 -9.313 -10.719 9.276 1.00 31.20 H new ATOM 0 HB3 LYS A 115 -8.802 -11.627 10.684 1.00 31.20 H new ATOM 0 HG2 LYS A 115 -9.571 -8.681 10.628 1.00 51.34 H new ATOM 0 HG3 LYS A 115 -10.546 -9.995 11.255 1.00 51.34 H new ATOM 0 HD2 LYS A 115 -9.703 -9.392 13.286 1.00 73.31 H new ATOM 0 HD3 LYS A 115 -8.278 -10.288 12.798 1.00 73.31 H new ATOM 0 HE2 LYS A 115 -7.208 -8.211 11.970 1.00 61.20 H new ATOM 0 HE3 LYS A 115 -8.656 -7.290 12.327 1.00 61.20 H new ATOM 0 HZ1 LYS A 115 -6.911 -7.105 14.034 1.00 31.40 H new ATOM 0 HZ2 LYS A 115 -8.375 -7.702 14.653 1.00 31.40 H new ATOM 0 HZ3 LYS A 115 -7.078 -8.760 14.372 1.00 31.40 H new ATOM 1818 N THR A 116 -6.192 -11.155 7.775 1.00 52.51 N ATOM 1819 CA THR A 116 -5.498 -12.175 6.938 1.00 21.35 C ATOM 1820 C THR A 116 -3.990 -12.160 7.219 1.00 33.02 C ATOM 1821 O THR A 116 -3.328 -13.200 7.139 1.00 41.22 O ATOM 1822 CB THR A 116 -5.744 -12.007 5.399 1.00 70.14 C ATOM 1823 OG1 THR A 116 -5.164 -10.782 4.913 1.00 24.20 O ATOM 1824 CG2 THR A 116 -7.247 -12.056 5.064 1.00 71.41 C ATOM 0 H THR A 116 -6.259 -10.232 7.346 1.00 52.51 H new ATOM 0 HA THR A 116 -5.930 -13.135 7.222 1.00 21.35 H new ATOM 0 HB THR A 116 -5.256 -12.843 4.898 1.00 70.14 H new ATOM 0 HG1 THR A 116 -5.657 -10.019 5.280 1.00 24.20 H new ATOM 0 HG21 THR A 116 -7.384 -11.937 3.989 1.00 71.41 H new ATOM 0 HG22 THR A 116 -7.659 -13.015 5.378 1.00 71.41 H new ATOM 0 HG23 THR A 116 -7.763 -11.251 5.587 1.00 71.41 H new ATOM 1832 N THR A 117 -3.462 -10.975 7.562 1.00 42.43 N ATOM 1833 CA THR A 117 -2.058 -10.808 7.957 1.00 61.10 C ATOM 1834 C THR A 117 -1.792 -11.627 9.247 1.00 4.41 C ATOM 1835 O THR A 117 -2.550 -11.516 10.212 1.00 50.32 O ATOM 1836 CB THR A 117 -1.732 -9.293 8.188 1.00 23.41 C ATOM 1837 OG1 THR A 117 -2.016 -8.543 6.991 1.00 72.43 O ATOM 1838 CG2 THR A 117 -0.261 -9.060 8.595 1.00 35.10 C ATOM 0 H THR A 117 -3.997 -10.107 7.573 1.00 42.43 H new ATOM 0 HA THR A 117 -1.410 -11.173 7.160 1.00 61.10 H new ATOM 0 HB THR A 117 -2.362 -8.953 9.010 1.00 23.41 H new ATOM 0 HG1 THR A 117 -2.976 -8.354 6.944 1.00 72.43 H new ATOM 0 HG21 THR A 117 -0.089 -7.994 8.743 1.00 35.10 H new ATOM 0 HG22 THR A 117 -0.051 -9.593 9.522 1.00 35.10 H new ATOM 0 HG23 THR A 117 0.397 -9.428 7.808 1.00 35.10 H new ATOM 1846 N GLY A 118 -0.758 -12.481 9.216 1.00 62.11 N ATOM 1847 CA GLY A 118 -0.417 -13.356 10.352 1.00 44.03 C ATOM 1848 C GLY A 118 -1.281 -14.614 10.464 1.00 20.43 C ATOM 1849 O GLY A 118 -0.961 -15.499 11.267 1.00 20.52 O ATOM 0 H GLY A 118 -0.139 -12.586 8.412 1.00 62.11 H new ATOM 0 HA2 GLY A 118 0.628 -13.654 10.264 1.00 44.03 H new ATOM 0 HA3 GLY A 118 -0.508 -12.784 11.275 1.00 44.03 H new ATOM 1853 N GLN A 119 -2.379 -14.702 9.669 1.00 55.13 N ATOM 1854 CA GLN A 119 -3.366 -15.802 9.762 1.00 24.21 C ATOM 1855 C GLN A 119 -3.415 -16.599 8.433 1.00 4.13 C ATOM 1856 O GLN A 119 -3.033 -17.773 8.382 1.00 24.22 O ATOM 1857 CB GLN A 119 -4.773 -15.222 10.114 1.00 33.21 C ATOM 1858 CG GLN A 119 -4.838 -14.381 11.412 1.00 63.13 C ATOM 1859 CD GLN A 119 -4.570 -15.185 12.687 1.00 65.11 C ATOM 1860 OE1 GLN A 119 -5.485 -15.751 13.290 1.00 24.14 O ATOM 1861 NE2 GLN A 119 -3.325 -15.226 13.123 1.00 11.11 N ATOM 0 H GLN A 119 -2.601 -14.014 8.950 1.00 55.13 H new ATOM 0 HA GLN A 119 -3.063 -16.486 10.554 1.00 24.21 H new ATOM 0 HB2 GLN A 119 -5.111 -14.603 9.283 1.00 33.21 H new ATOM 0 HB3 GLN A 119 -5.477 -16.050 10.202 1.00 33.21 H new ATOM 0 HG2 GLN A 119 -4.111 -13.571 11.345 1.00 63.13 H new ATOM 0 HG3 GLN A 119 -5.823 -13.920 11.485 1.00 63.13 H new ATOM 0 HE21 GLN A 119 -2.587 -14.749 12.605 1.00 11.11 H new ATOM 0 HE22 GLN A 119 -3.101 -15.735 13.978 1.00 11.11 H new ATOM 1870 N GLN A 120 -3.903 -15.934 7.366 1.00 55.12 N ATOM 1871 CA GLN A 120 -3.953 -16.488 5.979 1.00 44.22 C ATOM 1872 C GLN A 120 -2.694 -16.056 5.184 1.00 43.44 C ATOM 1873 O GLN A 120 -2.549 -16.366 3.998 1.00 72.41 O ATOM 1874 CB GLN A 120 -5.238 -16.001 5.238 1.00 3.04 C ATOM 1875 CG GLN A 120 -6.595 -16.554 5.754 1.00 64.33 C ATOM 1876 CD GLN A 120 -6.885 -16.266 7.233 1.00 43.34 C ATOM 1877 OE1 GLN A 120 -6.634 -17.100 8.107 1.00 63.24 O ATOM 1878 NE2 GLN A 120 -7.346 -15.064 7.533 1.00 4.30 N ATOM 0 H GLN A 120 -4.279 -14.988 7.434 1.00 55.12 H new ATOM 0 HA GLN A 120 -3.978 -17.576 6.046 1.00 44.22 H new ATOM 0 HB2 GLN A 120 -5.271 -14.913 5.294 1.00 3.04 H new ATOM 0 HB3 GLN A 120 -5.143 -16.263 4.184 1.00 3.04 H new ATOM 0 HG2 GLN A 120 -7.398 -16.129 5.151 1.00 64.33 H new ATOM 0 HG3 GLN A 120 -6.615 -17.632 5.597 1.00 64.33 H new ATOM 0 HE21 GLN A 120 -7.545 -14.394 6.790 1.00 4.30 H new ATOM 0 HE22 GLN A 120 -7.503 -14.806 8.507 1.00 4.30 H new ATOM 1887 N SER A 121 -1.807 -15.349 5.887 1.00 50.24 N ATOM 1888 CA SER A 121 -0.536 -14.808 5.387 1.00 63.02 C ATOM 1889 C SER A 121 0.442 -14.775 6.579 1.00 1.31 C ATOM 1890 O SER A 121 0.073 -15.176 7.695 1.00 52.04 O ATOM 1891 CB SER A 121 -0.747 -13.388 4.787 1.00 52.14 C ATOM 1892 OG SER A 121 -1.661 -13.404 3.696 1.00 14.11 O ATOM 0 H SER A 121 -1.961 -15.126 6.870 1.00 50.24 H new ATOM 0 HA SER A 121 -0.133 -15.430 4.587 1.00 63.02 H new ATOM 0 HB2 SER A 121 -1.118 -12.718 5.562 1.00 52.14 H new ATOM 0 HB3 SER A 121 0.211 -12.989 4.453 1.00 52.14 H new ATOM 0 HG SER A 121 -1.769 -12.495 3.347 1.00 14.11 H new ATOM 1898 N TYR A 122 1.685 -14.333 6.358 1.00 62.15 N ATOM 1899 CA TYR A 122 2.671 -14.187 7.448 1.00 41.14 C ATOM 1900 C TYR A 122 2.490 -12.814 8.143 1.00 22.15 C ATOM 1901 O TYR A 122 1.830 -11.910 7.610 1.00 11.02 O ATOM 1902 CB TYR A 122 4.122 -14.379 6.914 1.00 45.43 C ATOM 1903 CG TYR A 122 5.172 -14.627 8.021 1.00 71.40 C ATOM 1904 CD1 TYR A 122 5.318 -15.893 8.584 1.00 23.31 C ATOM 1905 CD2 TYR A 122 5.993 -13.605 8.517 1.00 1.30 C ATOM 1906 CE1 TYR A 122 6.234 -16.128 9.587 1.00 30.11 C ATOM 1907 CE2 TYR A 122 6.910 -13.839 9.525 1.00 12.44 C ATOM 1908 CZ TYR A 122 7.025 -15.102 10.052 1.00 53.20 C ATOM 1909 OH TYR A 122 7.933 -15.344 11.059 1.00 65.13 O ATOM 0 H TYR A 122 2.037 -14.069 5.438 1.00 62.15 H new ATOM 0 HA TYR A 122 2.499 -14.966 8.190 1.00 41.14 H new ATOM 0 HB2 TYR A 122 4.135 -15.220 6.221 1.00 45.43 H new ATOM 0 HB3 TYR A 122 4.409 -13.494 6.347 1.00 45.43 H new ATOM 0 HD1 TYR A 122 4.702 -16.706 8.228 1.00 23.31 H new ATOM 0 HD2 TYR A 122 5.907 -12.612 8.102 1.00 1.30 H new ATOM 0 HE1 TYR A 122 6.331 -17.118 10.008 1.00 30.11 H new ATOM 0 HE2 TYR A 122 7.530 -13.036 9.895 1.00 12.44 H new ATOM 0 HH TYR A 122 8.414 -14.517 11.272 1.00 65.13 H new ATOM 1919 N ASP A 123 3.070 -12.687 9.342 1.00 71.42 N ATOM 1920 CA ASP A 123 2.952 -11.486 10.196 1.00 44.12 C ATOM 1921 C ASP A 123 4.100 -10.485 9.927 1.00 13.52 C ATOM 1922 O ASP A 123 4.905 -10.680 9.015 1.00 13.54 O ATOM 1923 CB ASP A 123 2.901 -11.909 11.687 1.00 64.41 C ATOM 1924 CG ASP A 123 4.164 -12.647 12.167 1.00 32.30 C ATOM 1925 OD1 ASP A 123 4.327 -13.840 11.824 1.00 0.43 O ATOM 1926 OD2 ASP A 123 4.983 -12.046 12.899 1.00 71.31 O ATOM 0 H ASP A 123 3.643 -13.421 9.757 1.00 71.42 H new ATOM 0 HA ASP A 123 2.024 -10.971 9.949 1.00 44.12 H new ATOM 0 HB2 ASP A 123 2.754 -11.021 12.302 1.00 64.41 H new ATOM 0 HB3 ASP A 123 2.035 -12.552 11.843 1.00 64.41 H new ATOM 1931 N GLY A 124 4.144 -9.399 10.723 1.00 63.42 N ATOM 1932 CA GLY A 124 5.065 -8.280 10.490 1.00 4.22 C ATOM 1933 C GLY A 124 4.313 -7.067 9.984 1.00 41.42 C ATOM 1934 O GLY A 124 4.624 -5.927 10.352 1.00 31.35 O ATOM 0 H GLY A 124 3.545 -9.277 11.539 1.00 63.42 H new ATOM 0 HA2 GLY A 124 5.586 -8.032 11.415 1.00 4.22 H new ATOM 0 HA3 GLY A 124 5.825 -8.572 9.765 1.00 4.22 H new ATOM 1938 N GLY A 125 3.307 -7.334 9.132 1.00 21.14 N ATOM 1939 CA GLY A 125 2.396 -6.314 8.615 1.00 73.12 C ATOM 1940 C GLY A 125 2.192 -6.435 7.122 1.00 34.41 C ATOM 1941 O GLY A 125 2.694 -7.380 6.498 1.00 73.55 O ATOM 0 H GLY A 125 3.108 -8.272 8.785 1.00 21.14 H new ATOM 0 HA2 GLY A 125 1.434 -6.399 9.120 1.00 73.12 H new ATOM 0 HA3 GLY A 125 2.791 -5.325 8.847 1.00 73.12 H new ATOM 1945 N ARG A 126 1.427 -5.490 6.550 1.00 24.05 N ATOM 1946 CA ARG A 126 1.271 -5.352 5.090 1.00 13.04 C ATOM 1947 C ARG A 126 1.136 -3.862 4.738 1.00 75.03 C ATOM 1948 O ARG A 126 1.193 -2.990 5.614 1.00 30.42 O ATOM 1949 CB ARG A 126 0.052 -6.160 4.536 1.00 4.51 C ATOM 1950 CG ARG A 126 0.173 -6.573 3.024 1.00 15.13 C ATOM 1951 CD ARG A 126 -1.165 -6.571 2.276 1.00 62.35 C ATOM 1952 NE ARG A 126 -2.176 -7.287 3.036 1.00 1.21 N ATOM 1953 CZ ARG A 126 -3.406 -7.656 2.591 1.00 63.03 C ATOM 1954 NH1 ARG A 126 -3.806 -7.359 1.350 1.00 44.21 N ATOM 1955 NH2 ARG A 126 -4.239 -8.296 3.398 1.00 45.30 N ATOM 0 H ARG A 126 0.899 -4.800 7.085 1.00 24.05 H new ATOM 0 HA ARG A 126 2.159 -5.771 4.616 1.00 13.04 H new ATOM 0 HB2 ARG A 126 -0.073 -7.061 5.136 1.00 4.51 H new ATOM 0 HB3 ARG A 126 -0.851 -5.564 4.665 1.00 4.51 H new ATOM 0 HG2 ARG A 126 0.860 -5.890 2.524 1.00 15.13 H new ATOM 0 HG3 ARG A 126 0.612 -7.569 2.962 1.00 15.13 H new ATOM 0 HD2 ARG A 126 -1.490 -5.545 2.104 1.00 62.35 H new ATOM 0 HD3 ARG A 126 -1.042 -7.035 1.297 1.00 62.35 H new ATOM 0 HE ARG A 126 -1.940 -7.537 3.996 1.00 1.21 H new ATOM 0 HH11 ARG A 126 -3.185 -6.848 0.722 1.00 44.21 H new ATOM 0 HH12 ARG A 126 -4.732 -7.643 1.031 1.00 44.21 H new ATOM 0 HH21 ARG A 126 -3.957 -8.512 4.354 1.00 45.30 H new ATOM 0 HH22 ARG A 126 -5.162 -8.573 3.063 1.00 45.30 H new ATOM 1969 N TYR A 127 0.981 -3.586 3.444 1.00 52.34 N ATOM 1970 CA TYR A 127 0.988 -2.246 2.900 1.00 70.31 C ATOM 1971 C TYR A 127 0.164 -2.180 1.617 1.00 3.04 C ATOM 1972 O TYR A 127 -0.165 -3.207 1.001 1.00 75.15 O ATOM 1973 CB TYR A 127 2.459 -1.846 2.647 1.00 33.21 C ATOM 1974 CG TYR A 127 3.234 -2.706 1.608 1.00 12.33 C ATOM 1975 CD1 TYR A 127 3.158 -4.108 1.609 1.00 31.51 C ATOM 1976 CD2 TYR A 127 4.058 -2.115 0.645 1.00 22.12 C ATOM 1977 CE1 TYR A 127 3.857 -4.859 0.702 1.00 11.10 C ATOM 1978 CE2 TYR A 127 4.769 -2.880 -0.259 1.00 12.42 C ATOM 1979 CZ TYR A 127 4.665 -4.248 -0.225 1.00 30.41 C ATOM 1980 OH TYR A 127 5.399 -5.011 -1.109 1.00 32.34 O ATOM 0 H TYR A 127 0.845 -4.309 2.737 1.00 52.34 H new ATOM 0 HA TYR A 127 0.533 -1.548 3.602 1.00 70.31 H new ATOM 0 HB2 TYR A 127 2.480 -0.808 2.316 1.00 33.21 H new ATOM 0 HB3 TYR A 127 2.994 -1.889 3.596 1.00 33.21 H new ATOM 0 HD1 TYR A 127 2.536 -4.604 2.339 1.00 31.51 H new ATOM 0 HD2 TYR A 127 4.140 -1.039 0.607 1.00 22.12 H new ATOM 0 HE1 TYR A 127 3.772 -5.936 0.716 1.00 11.10 H new ATOM 0 HE2 TYR A 127 5.405 -2.403 -0.990 1.00 12.42 H new ATOM 0 HH TYR A 127 5.350 -5.954 -0.847 1.00 32.34 H new ATOM 1990 N MET A 128 -0.153 -0.952 1.240 1.00 53.35 N ATOM 1991 CA MET A 128 -0.847 -0.616 -0.001 1.00 12.03 C ATOM 1992 C MET A 128 -0.216 0.684 -0.524 1.00 74.52 C ATOM 1993 O MET A 128 0.076 1.591 0.264 1.00 70.31 O ATOM 1994 CB MET A 128 -2.390 -0.466 0.259 1.00 33.43 C ATOM 1995 CG MET A 128 -3.269 -1.460 -0.514 1.00 55.52 C ATOM 1996 SD MET A 128 -3.265 -1.157 -2.287 1.00 55.24 S ATOM 1997 CE MET A 128 -4.105 0.426 -2.348 1.00 11.22 C ATOM 0 H MET A 128 0.071 -0.133 1.805 1.00 53.35 H new ATOM 0 HA MET A 128 -0.741 -1.403 -0.747 1.00 12.03 H new ATOM 0 HB2 MET A 128 -2.579 -0.588 1.326 1.00 33.43 H new ATOM 0 HB3 MET A 128 -2.693 0.547 -0.005 1.00 33.43 H new ATOM 0 HG2 MET A 128 -2.919 -2.474 -0.322 1.00 55.52 H new ATOM 0 HG3 MET A 128 -4.292 -1.400 -0.142 1.00 55.52 H new ATOM 0 HE1 MET A 128 -4.529 0.575 -3.341 1.00 11.22 H new ATOM 0 HE2 MET A 128 -4.903 0.443 -1.606 1.00 11.22 H new ATOM 0 HE3 MET A 128 -3.394 1.224 -2.134 1.00 11.22 H new ATOM 2007 N GLU A 129 0.022 0.762 -1.832 1.00 65.11 N ATOM 2008 CA GLU A 129 0.661 1.933 -2.455 1.00 0.24 C ATOM 2009 C GLU A 129 -0.312 2.594 -3.436 1.00 60.03 C ATOM 2010 O GLU A 129 -0.881 1.932 -4.310 1.00 50.33 O ATOM 2011 CB GLU A 129 1.965 1.512 -3.169 1.00 24.10 C ATOM 2012 CG GLU A 129 2.723 2.653 -3.887 1.00 31.24 C ATOM 2013 CD GLU A 129 3.884 2.132 -4.752 1.00 23.41 C ATOM 2014 OE1 GLU A 129 3.625 1.650 -5.880 1.00 61.31 O ATOM 2015 OE2 GLU A 129 5.056 2.182 -4.305 1.00 12.34 O ATOM 0 H GLU A 129 -0.219 0.022 -2.492 1.00 65.11 H new ATOM 0 HA GLU A 129 0.917 2.657 -1.682 1.00 0.24 H new ATOM 0 HB2 GLU A 129 2.632 1.060 -2.435 1.00 24.10 H new ATOM 0 HB3 GLU A 129 1.726 0.740 -3.900 1.00 24.10 H new ATOM 0 HG2 GLU A 129 2.027 3.209 -4.515 1.00 31.24 H new ATOM 0 HG3 GLU A 129 3.111 3.351 -3.145 1.00 31.24 H new ATOM 2022 N LEU A 130 -0.512 3.893 -3.248 1.00 54.25 N ATOM 2023 CA LEU A 130 -1.369 4.724 -4.088 1.00 3.43 C ATOM 2024 C LEU A 130 -0.495 5.684 -4.887 1.00 12.51 C ATOM 2025 O LEU A 130 0.431 6.285 -4.329 1.00 11.41 O ATOM 2026 CB LEU A 130 -2.303 5.544 -3.178 1.00 34.04 C ATOM 2027 CG LEU A 130 -3.103 4.724 -2.117 1.00 60.13 C ATOM 2028 CD1 LEU A 130 -3.318 5.561 -0.857 1.00 41.22 C ATOM 2029 CD2 LEU A 130 -4.447 4.228 -2.679 1.00 25.14 C ATOM 0 H LEU A 130 -0.072 4.412 -2.488 1.00 54.25 H new ATOM 0 HA LEU A 130 -1.953 4.100 -4.764 1.00 3.43 H new ATOM 0 HB2 LEU A 130 -1.707 6.294 -2.657 1.00 34.04 H new ATOM 0 HB3 LEU A 130 -3.013 6.081 -3.806 1.00 34.04 H new ATOM 0 HG LEU A 130 -2.515 3.844 -1.859 1.00 60.13 H new ATOM 0 HD11 LEU A 130 -3.877 4.979 -0.124 1.00 41.22 H new ATOM 0 HD12 LEU A 130 -2.352 5.841 -0.437 1.00 41.22 H new ATOM 0 HD13 LEU A 130 -3.879 6.461 -1.109 1.00 41.22 H new ATOM 0 HD21 LEU A 130 -4.975 3.662 -1.912 1.00 25.14 H new ATOM 0 HD22 LEU A 130 -5.053 5.082 -2.981 1.00 25.14 H new ATOM 0 HD23 LEU A 130 -4.266 3.588 -3.543 1.00 25.14 H new ATOM 2041 N GLU A 131 -0.770 5.810 -6.180 1.00 54.44 N ATOM 2042 CA GLU A 131 -0.298 6.936 -6.988 1.00 54.25 C ATOM 2043 C GLU A 131 -1.505 7.501 -7.756 1.00 31.31 C ATOM 2044 O GLU A 131 -1.888 6.945 -8.789 1.00 22.35 O ATOM 2045 CB GLU A 131 0.870 6.544 -7.939 1.00 42.22 C ATOM 2046 CG GLU A 131 2.157 6.097 -7.201 1.00 63.11 C ATOM 2047 CD GLU A 131 3.373 5.914 -8.120 1.00 25.24 C ATOM 2048 OE1 GLU A 131 3.303 5.069 -9.039 1.00 41.12 O ATOM 2049 OE2 GLU A 131 4.404 6.602 -7.926 1.00 60.44 O ATOM 0 H GLU A 131 -1.328 5.134 -6.702 1.00 54.44 H new ATOM 0 HA GLU A 131 0.120 7.701 -6.334 1.00 54.25 H new ATOM 0 HB2 GLU A 131 0.538 5.737 -8.592 1.00 42.22 H new ATOM 0 HB3 GLU A 131 1.106 7.395 -8.578 1.00 42.22 H new ATOM 0 HG2 GLU A 131 2.400 6.835 -6.437 1.00 63.11 H new ATOM 0 HG3 GLU A 131 1.960 5.157 -6.685 1.00 63.11 H new ATOM 2056 N PRO A 132 -2.194 8.559 -7.197 1.00 63.30 N ATOM 2057 CA PRO A 132 -3.282 9.278 -7.902 1.00 20.02 C ATOM 2058 C PRO A 132 -2.792 9.928 -9.212 1.00 63.23 C ATOM 2059 O PRO A 132 -1.585 10.092 -9.433 1.00 62.43 O ATOM 2060 CB PRO A 132 -3.751 10.349 -6.869 1.00 43.34 C ATOM 2061 CG PRO A 132 -2.598 10.483 -5.917 1.00 22.45 C ATOM 2062 CD PRO A 132 -1.988 9.112 -5.831 1.00 33.43 C ATOM 0 HA PRO A 132 -4.087 8.611 -8.211 1.00 20.02 H new ATOM 0 HB2 PRO A 132 -3.976 11.298 -7.356 1.00 43.34 H new ATOM 0 HB3 PRO A 132 -4.657 10.032 -6.353 1.00 43.34 H new ATOM 0 HG2 PRO A 132 -1.874 11.213 -6.278 1.00 22.45 H new ATOM 0 HG3 PRO A 132 -2.935 10.825 -4.938 1.00 22.45 H new ATOM 0 HD2 PRO A 132 -0.930 9.158 -5.571 1.00 33.43 H new ATOM 0 HD3 PRO A 132 -2.477 8.501 -5.072 1.00 33.43 H new ATOM 2070 N ASP A 133 -3.756 10.333 -10.054 1.00 53.21 N ATOM 2071 CA ASP A 133 -3.473 10.944 -11.377 1.00 43.05 C ATOM 2072 C ASP A 133 -3.003 12.406 -11.209 1.00 73.14 C ATOM 2073 O ASP A 133 -2.566 13.056 -12.162 1.00 24.12 O ATOM 2074 CB ASP A 133 -4.749 10.850 -12.272 1.00 61.41 C ATOM 2075 CG ASP A 133 -4.504 11.172 -13.764 1.00 43.42 C ATOM 2076 OD1 ASP A 133 -4.041 10.271 -14.506 1.00 11.22 O ATOM 2077 OD2 ASP A 133 -4.788 12.313 -14.207 1.00 1.53 O ATOM 0 H ASP A 133 -4.751 10.250 -9.845 1.00 53.21 H new ATOM 0 HA ASP A 133 -2.666 10.399 -11.867 1.00 43.05 H new ATOM 0 HB2 ASP A 133 -5.161 9.844 -12.192 1.00 61.41 H new ATOM 0 HB3 ASP A 133 -5.503 11.535 -11.883 1.00 61.41 H new ATOM 2082 N ARG A 134 -3.059 12.878 -9.964 1.00 62.01 N ATOM 2083 CA ARG A 134 -2.690 14.226 -9.545 1.00 44.35 C ATOM 2084 C ARG A 134 -2.053 14.129 -8.154 1.00 14.44 C ATOM 2085 O ARG A 134 -1.920 13.030 -7.609 1.00 31.40 O ATOM 2086 CB ARG A 134 -3.965 15.085 -9.471 1.00 53.55 C ATOM 2087 CG ARG A 134 -5.070 14.444 -8.599 1.00 21.33 C ATOM 2088 CD ARG A 134 -6.213 15.394 -8.296 1.00 72.53 C ATOM 2089 NE ARG A 134 -7.274 14.766 -7.489 1.00 35.21 N ATOM 2090 CZ ARG A 134 -8.201 13.905 -7.940 1.00 54.35 C ATOM 2091 NH1 ARG A 134 -8.230 13.531 -9.219 1.00 3.11 N ATOM 2092 NH2 ARG A 134 -9.093 13.410 -7.094 1.00 15.43 N ATOM 0 H ARG A 134 -3.378 12.302 -9.185 1.00 62.01 H new ATOM 0 HA ARG A 134 -1.990 14.677 -10.248 1.00 44.35 H new ATOM 0 HB2 ARG A 134 -3.714 16.066 -9.068 1.00 53.55 H new ATOM 0 HB3 ARG A 134 -4.350 15.243 -10.478 1.00 53.55 H new ATOM 0 HG2 ARG A 134 -5.462 13.564 -9.109 1.00 21.33 H new ATOM 0 HG3 ARG A 134 -4.632 14.101 -7.662 1.00 21.33 H new ATOM 0 HD2 ARG A 134 -5.826 16.265 -7.766 1.00 72.53 H new ATOM 0 HD3 ARG A 134 -6.639 15.754 -9.232 1.00 72.53 H new ATOM 0 HE ARG A 134 -7.307 15.007 -6.498 1.00 35.21 H new ATOM 0 HH11 ARG A 134 -7.540 13.900 -9.874 1.00 3.11 H new ATOM 0 HH12 ARG A 134 -8.942 12.876 -9.543 1.00 3.11 H new ATOM 0 HH21 ARG A 134 -9.071 13.684 -6.112 1.00 15.43 H new ATOM 0 HH22 ARG A 134 -9.802 12.755 -7.425 1.00 15.43 H new ATOM 2106 N ASP A 135 -1.645 15.262 -7.576 1.00 54.42 N ATOM 2107 CA ASP A 135 -1.219 15.301 -6.160 1.00 12.41 C ATOM 2108 C ASP A 135 -2.412 15.790 -5.319 1.00 53.45 C ATOM 2109 O ASP A 135 -3.096 16.742 -5.717 1.00 14.15 O ATOM 2110 CB ASP A 135 0.024 16.211 -5.973 1.00 63.44 C ATOM 2111 CG ASP A 135 0.889 15.800 -4.764 1.00 50.55 C ATOM 2112 OD1 ASP A 135 0.561 16.188 -3.619 1.00 65.02 O ATOM 2113 OD2 ASP A 135 1.882 15.047 -4.955 1.00 4.35 O ATOM 0 H ASP A 135 -1.598 16.161 -8.055 1.00 54.42 H new ATOM 0 HA ASP A 135 -0.922 14.305 -5.831 1.00 12.41 H new ATOM 0 HB2 ASP A 135 0.632 16.178 -6.877 1.00 63.44 H new ATOM 0 HB3 ASP A 135 -0.303 17.243 -5.846 1.00 63.44 H new ATOM 2118 N LEU A 136 -2.661 15.152 -4.161 1.00 71.32 N ATOM 2119 CA LEU A 136 -3.920 15.343 -3.402 1.00 32.13 C ATOM 2120 C LEU A 136 -3.774 16.395 -2.286 1.00 11.12 C ATOM 2121 O LEU A 136 -2.734 16.489 -1.625 1.00 71.34 O ATOM 2122 CB LEU A 136 -4.398 13.995 -2.798 1.00 14.31 C ATOM 2123 CG LEU A 136 -4.646 12.837 -3.815 1.00 63.50 C ATOM 2124 CD1 LEU A 136 -5.108 11.558 -3.094 1.00 44.10 C ATOM 2125 CD2 LEU A 136 -5.657 13.235 -4.913 1.00 0.42 C ATOM 0 H LEU A 136 -2.009 14.498 -3.727 1.00 71.32 H new ATOM 0 HA LEU A 136 -4.665 15.711 -4.107 1.00 32.13 H new ATOM 0 HB2 LEU A 136 -3.656 13.662 -2.073 1.00 14.31 H new ATOM 0 HB3 LEU A 136 -5.323 14.174 -2.249 1.00 14.31 H new ATOM 0 HG LEU A 136 -3.693 12.635 -4.305 1.00 63.50 H new ATOM 0 HD11 LEU A 136 -5.274 10.767 -3.826 1.00 44.10 H new ATOM 0 HD12 LEU A 136 -4.342 11.242 -2.386 1.00 44.10 H new ATOM 0 HD13 LEU A 136 -6.036 11.757 -2.559 1.00 44.10 H new ATOM 0 HD21 LEU A 136 -5.798 12.399 -5.598 1.00 0.42 H new ATOM 0 HD22 LEU A 136 -6.611 13.493 -4.453 1.00 0.42 H new ATOM 0 HD23 LEU A 136 -5.276 14.095 -5.464 1.00 0.42 H new ATOM 2137 N SER A 137 -4.847 17.173 -2.101 1.00 74.35 N ATOM 2138 CA SER A 137 -5.015 18.123 -0.989 1.00 34.54 C ATOM 2139 C SER A 137 -6.328 17.785 -0.248 1.00 1.13 C ATOM 2140 O SER A 137 -7.043 16.847 -0.636 1.00 55.00 O ATOM 2141 CB SER A 137 -4.993 19.583 -1.516 1.00 61.41 C ATOM 2142 OG SER A 137 -5.912 19.779 -2.583 1.00 41.02 O ATOM 0 H SER A 137 -5.645 17.161 -2.736 1.00 74.35 H new ATOM 0 HA SER A 137 -4.188 18.035 -0.284 1.00 34.54 H new ATOM 0 HB2 SER A 137 -5.233 20.266 -0.701 1.00 61.41 H new ATOM 0 HB3 SER A 137 -3.987 19.831 -1.854 1.00 61.41 H new ATOM 0 HG SER A 137 -6.447 18.967 -2.707 1.00 41.02 H new ATOM 2148 N ASP A 138 -6.636 18.526 0.825 1.00 62.02 N ATOM 2149 CA ASP A 138 -7.809 18.242 1.672 1.00 45.11 C ATOM 2150 C ASP A 138 -9.120 18.504 0.890 1.00 10.45 C ATOM 2151 O ASP A 138 -9.360 19.613 0.403 1.00 61.31 O ATOM 2152 CB ASP A 138 -7.752 19.080 2.983 1.00 2.23 C ATOM 2153 CG ASP A 138 -7.905 20.594 2.768 1.00 25.21 C ATOM 2154 OD1 ASP A 138 -6.994 21.211 2.176 1.00 13.51 O ATOM 2155 OD2 ASP A 138 -8.954 21.164 3.149 1.00 15.11 O ATOM 0 H ASP A 138 -6.088 19.331 1.130 1.00 62.02 H new ATOM 0 HA ASP A 138 -7.792 17.188 1.950 1.00 45.11 H new ATOM 0 HB2 ASP A 138 -8.540 18.738 3.654 1.00 2.23 H new ATOM 0 HB3 ASP A 138 -6.802 18.889 3.482 1.00 2.23 H new ATOM 2160 N GLY A 139 -9.919 17.445 0.712 1.00 11.21 N ATOM 2161 CA GLY A 139 -11.215 17.541 0.020 1.00 12.24 C ATOM 2162 C GLY A 139 -11.245 16.763 -1.285 1.00 43.15 C ATOM 2163 O GLY A 139 -12.317 16.603 -1.879 1.00 44.53 O ATOM 0 H GLY A 139 -9.691 16.506 1.039 1.00 11.21 H new ATOM 0 HA2 GLY A 139 -12.001 17.169 0.677 1.00 12.24 H new ATOM 0 HA3 GLY A 139 -11.437 18.589 -0.182 1.00 12.24 H new ATOM 2167 N ASP A 140 -10.063 16.289 -1.746 1.00 13.33 N ATOM 2168 CA ASP A 140 -9.967 15.370 -2.906 1.00 54.13 C ATOM 2169 C ASP A 140 -10.467 13.972 -2.520 1.00 1.13 C ATOM 2170 O ASP A 140 -10.718 13.691 -1.346 1.00 24.11 O ATOM 2171 CB ASP A 140 -8.511 15.264 -3.431 1.00 33.42 C ATOM 2172 CG ASP A 140 -8.039 16.520 -4.172 1.00 73.12 C ATOM 2173 OD1 ASP A 140 -8.222 16.605 -5.406 1.00 12.14 O ATOM 2174 OD2 ASP A 140 -7.484 17.426 -3.526 1.00 43.33 O ATOM 0 H ASP A 140 -9.162 16.528 -1.332 1.00 13.33 H new ATOM 0 HA ASP A 140 -10.592 15.781 -3.699 1.00 54.13 H new ATOM 0 HB2 ASP A 140 -7.843 15.074 -2.591 1.00 33.42 H new ATOM 0 HB3 ASP A 140 -8.435 14.406 -4.100 1.00 33.42 H new ATOM 2179 N GLU A 141 -10.628 13.099 -3.521 1.00 23.22 N ATOM 2180 CA GLU A 141 -10.962 11.683 -3.302 1.00 24.21 C ATOM 2181 C GLU A 141 -9.825 10.787 -3.815 1.00 71.21 C ATOM 2182 O GLU A 141 -8.996 11.217 -4.634 1.00 22.42 O ATOM 2183 CB GLU A 141 -12.304 11.357 -4.000 1.00 54.14 C ATOM 2184 CG GLU A 141 -13.482 12.221 -3.504 1.00 50.34 C ATOM 2185 CD GLU A 141 -14.758 12.040 -4.330 1.00 13.33 C ATOM 2186 OE1 GLU A 141 -14.802 12.545 -5.475 1.00 11.53 O ATOM 2187 OE2 GLU A 141 -15.721 11.403 -3.844 1.00 11.11 O ATOM 0 H GLU A 141 -10.531 13.351 -4.505 1.00 23.22 H new ATOM 0 HA GLU A 141 -11.076 11.491 -2.235 1.00 24.21 H new ATOM 0 HB2 GLU A 141 -12.189 11.497 -5.075 1.00 54.14 H new ATOM 0 HB3 GLU A 141 -12.542 10.306 -3.839 1.00 54.14 H new ATOM 0 HG2 GLU A 141 -13.693 11.972 -2.464 1.00 50.34 H new ATOM 0 HG3 GLU A 141 -13.188 13.270 -3.528 1.00 50.34 H new ATOM 2194 N ILE A 142 -9.808 9.541 -3.327 1.00 11.32 N ATOM 2195 CA ILE A 142 -8.758 8.551 -3.618 1.00 12.05 C ATOM 2196 C ILE A 142 -9.377 7.149 -3.471 1.00 54.54 C ATOM 2197 O ILE A 142 -10.282 6.949 -2.653 1.00 71.35 O ATOM 2198 CB ILE A 142 -7.534 8.720 -2.643 1.00 31.51 C ATOM 2199 CG1 ILE A 142 -6.368 7.719 -2.965 1.00 30.44 C ATOM 2200 CG2 ILE A 142 -7.985 8.601 -1.173 1.00 13.31 C ATOM 2201 CD1 ILE A 142 -5.727 7.887 -4.340 1.00 72.43 C ATOM 0 H ILE A 142 -10.535 9.184 -2.708 1.00 11.32 H new ATOM 0 HA ILE A 142 -8.383 8.696 -4.631 1.00 12.05 H new ATOM 0 HB ILE A 142 -7.135 9.722 -2.800 1.00 31.51 H new ATOM 0 HG12 ILE A 142 -5.594 7.831 -2.205 1.00 30.44 H new ATOM 0 HG13 ILE A 142 -6.751 6.702 -2.882 1.00 30.44 H new ATOM 0 HG21 ILE A 142 -7.123 8.721 -0.517 1.00 13.31 H new ATOM 0 HG22 ILE A 142 -8.719 9.377 -0.954 1.00 13.31 H new ATOM 0 HG23 ILE A 142 -8.433 7.621 -1.008 1.00 13.31 H new ATOM 0 HD11 ILE A 142 -4.934 7.150 -4.464 1.00 72.43 H new ATOM 0 HD12 ILE A 142 -6.481 7.742 -5.113 1.00 72.43 H new ATOM 0 HD13 ILE A 142 -5.307 8.889 -4.426 1.00 72.43 H new ATOM 2213 N THR A 143 -8.907 6.187 -4.263 1.00 24.14 N ATOM 2214 CA THR A 143 -9.487 4.839 -4.297 1.00 43.04 C ATOM 2215 C THR A 143 -8.511 3.829 -3.656 1.00 55.45 C ATOM 2216 O THR A 143 -7.363 3.716 -4.091 1.00 54.23 O ATOM 2217 CB THR A 143 -9.833 4.446 -5.774 1.00 32.24 C ATOM 2218 OG1 THR A 143 -10.182 5.627 -6.519 1.00 44.23 O ATOM 2219 CG2 THR A 143 -11.019 3.480 -5.837 1.00 14.23 C ATOM 0 H THR A 143 -8.118 6.315 -4.897 1.00 24.14 H new ATOM 0 HA THR A 143 -10.411 4.824 -3.719 1.00 43.04 H new ATOM 0 HB THR A 143 -8.954 3.960 -6.198 1.00 32.24 H new ATOM 0 HG1 THR A 143 -10.396 5.380 -7.443 1.00 44.23 H new ATOM 0 HG21 THR A 143 -11.230 3.230 -6.877 1.00 14.23 H new ATOM 0 HG22 THR A 143 -10.777 2.571 -5.287 1.00 14.23 H new ATOM 0 HG23 THR A 143 -11.896 3.951 -5.392 1.00 14.23 H new ATOM 2227 N LEU A 144 -8.991 3.104 -2.624 1.00 24.10 N ATOM 2228 CA LEU A 144 -8.203 2.154 -1.816 1.00 3.24 C ATOM 2229 C LEU A 144 -8.548 0.718 -2.266 1.00 51.33 C ATOM 2230 O LEU A 144 -9.555 0.137 -1.826 1.00 14.15 O ATOM 2231 CB LEU A 144 -8.528 2.328 -0.292 1.00 31.33 C ATOM 2232 CG LEU A 144 -7.882 3.532 0.473 1.00 23.21 C ATOM 2233 CD1 LEU A 144 -6.343 3.407 0.531 1.00 42.30 C ATOM 2234 CD2 LEU A 144 -8.327 4.897 -0.104 1.00 4.31 C ATOM 0 H LEU A 144 -9.964 3.166 -2.323 1.00 24.10 H new ATOM 0 HA LEU A 144 -7.140 2.347 -1.962 1.00 3.24 H new ATOM 0 HB2 LEU A 144 -9.610 2.412 -0.190 1.00 31.33 H new ATOM 0 HB3 LEU A 144 -8.230 1.412 0.218 1.00 31.33 H new ATOM 0 HG LEU A 144 -8.250 3.492 1.498 1.00 23.21 H new ATOM 0 HD11 LEU A 144 -5.929 4.260 1.069 1.00 42.30 H new ATOM 0 HD12 LEU A 144 -6.072 2.486 1.047 1.00 42.30 H new ATOM 0 HD13 LEU A 144 -5.941 3.387 -0.482 1.00 42.30 H new ATOM 0 HD21 LEU A 144 -7.853 5.702 0.459 1.00 4.31 H new ATOM 0 HD22 LEU A 144 -8.031 4.963 -1.151 1.00 4.31 H new ATOM 0 HD23 LEU A 144 -9.410 4.989 -0.027 1.00 4.31 H new ATOM 2246 N ASP A 145 -7.744 0.167 -3.178 1.00 70.33 N ATOM 2247 CA ASP A 145 -7.918 -1.205 -3.700 1.00 54.42 C ATOM 2248 C ASP A 145 -6.915 -2.156 -3.029 1.00 33.22 C ATOM 2249 O ASP A 145 -5.798 -2.349 -3.509 1.00 64.24 O ATOM 2250 CB ASP A 145 -7.810 -1.247 -5.265 1.00 44.34 C ATOM 2251 CG ASP A 145 -6.979 -0.096 -5.858 1.00 3.53 C ATOM 2252 OD1 ASP A 145 -5.736 -0.182 -5.870 1.00 52.12 O ATOM 2253 OD2 ASP A 145 -7.581 0.912 -6.311 1.00 35.12 O ATOM 0 H ASP A 145 -6.946 0.657 -3.583 1.00 70.33 H new ATOM 0 HA ASP A 145 -8.924 -1.543 -3.451 1.00 54.42 H new ATOM 0 HB2 ASP A 145 -7.366 -2.196 -5.564 1.00 44.34 H new ATOM 0 HB3 ASP A 145 -8.813 -1.216 -5.691 1.00 44.34 H new ATOM 2258 N PHE A 146 -7.351 -2.744 -1.898 1.00 24.12 N ATOM 2259 CA PHE A 146 -6.538 -3.698 -1.089 1.00 44.24 C ATOM 2260 C PHE A 146 -6.352 -5.026 -1.828 1.00 73.21 C ATOM 2261 O PHE A 146 -5.483 -5.841 -1.491 1.00 75.41 O ATOM 2262 CB PHE A 146 -7.214 -3.956 0.280 1.00 62.33 C ATOM 2263 CG PHE A 146 -7.744 -2.697 0.940 1.00 52.43 C ATOM 2264 CD1 PHE A 146 -6.894 -1.628 1.194 1.00 54.42 C ATOM 2265 CD2 PHE A 146 -9.096 -2.570 1.278 1.00 4.12 C ATOM 2266 CE1 PHE A 146 -7.372 -0.478 1.764 1.00 45.05 C ATOM 2267 CE2 PHE A 146 -9.572 -1.410 1.850 1.00 24.54 C ATOM 2268 CZ PHE A 146 -8.708 -0.365 2.093 1.00 21.22 C ATOM 0 H PHE A 146 -8.280 -2.576 -1.511 1.00 24.12 H new ATOM 0 HA PHE A 146 -5.558 -3.249 -0.929 1.00 44.24 H new ATOM 0 HB2 PHE A 146 -8.036 -4.659 0.144 1.00 62.33 H new ATOM 0 HB3 PHE A 146 -6.495 -4.432 0.947 1.00 62.33 H new ATOM 0 HD1 PHE A 146 -5.847 -1.704 0.940 1.00 54.42 H new ATOM 0 HD2 PHE A 146 -9.773 -3.390 1.089 1.00 4.12 H new ATOM 0 HE1 PHE A 146 -6.700 0.345 1.957 1.00 45.05 H new ATOM 0 HE2 PHE A 146 -10.617 -1.321 2.106 1.00 24.54 H new ATOM 0 HZ PHE A 146 -9.077 0.545 2.542 1.00 21.22 H new ATOM 2278 N ASN A 147 -7.203 -5.218 -2.832 1.00 51.12 N ATOM 2279 CA ASN A 147 -7.150 -6.354 -3.742 1.00 62.12 C ATOM 2280 C ASN A 147 -6.035 -6.176 -4.802 1.00 44.23 C ATOM 2281 O ASN A 147 -5.931 -6.987 -5.705 1.00 11.53 O ATOM 2282 CB ASN A 147 -8.538 -6.542 -4.407 1.00 73.35 C ATOM 2283 CG ASN A 147 -8.966 -5.344 -5.260 1.00 63.05 C ATOM 2284 OD1 ASN A 147 -8.580 -5.349 -6.522 1.00 70.21 O flip ATOM 2285 ND2 ASN A 147 -9.619 -4.414 -4.779 1.00 21.40 N flip ATOM 0 H ASN A 147 -7.965 -4.572 -3.039 1.00 51.12 H new ATOM 0 HA ASN A 147 -6.904 -7.252 -3.175 1.00 62.12 H new ATOM 0 HB2 ASN A 147 -8.516 -7.435 -5.031 1.00 73.35 H new ATOM 0 HB3 ASN A 147 -9.285 -6.713 -3.632 1.00 73.35 H new ATOM 0 HD21 ASN A 147 -9.901 -4.442 -3.799 1.00 21.40 H new ATOM 0 HD22 ASN A 147 -9.877 -3.617 -5.361 1.00 21.40 H new ATOM 2292 N LEU A 148 -5.220 -5.104 -4.701 1.00 34.14 N ATOM 2293 CA LEU A 148 -4.006 -4.925 -5.535 1.00 31.42 C ATOM 2294 C LEU A 148 -2.749 -4.810 -4.663 1.00 74.32 C ATOM 2295 O LEU A 148 -1.666 -4.493 -5.180 1.00 3.23 O ATOM 2296 CB LEU A 148 -4.121 -3.668 -6.433 1.00 14.15 C ATOM 2297 CG LEU A 148 -5.280 -3.635 -7.471 1.00 72.11 C ATOM 2298 CD1 LEU A 148 -5.080 -2.463 -8.455 1.00 74.14 C ATOM 2299 CD2 LEU A 148 -5.429 -4.980 -8.218 1.00 21.33 C ATOM 0 H LEU A 148 -5.381 -4.341 -4.044 1.00 34.14 H new ATOM 0 HA LEU A 148 -3.922 -5.807 -6.170 1.00 31.42 H new ATOM 0 HB2 LEU A 148 -4.225 -2.798 -5.784 1.00 14.15 H new ATOM 0 HB3 LEU A 148 -3.181 -3.552 -6.973 1.00 14.15 H new ATOM 0 HG LEU A 148 -6.212 -3.477 -6.928 1.00 72.11 H new ATOM 0 HD11 LEU A 148 -5.897 -2.450 -9.176 1.00 74.14 H new ATOM 0 HD12 LEU A 148 -5.068 -1.523 -7.904 1.00 74.14 H new ATOM 0 HD13 LEU A 148 -4.133 -2.587 -8.981 1.00 74.14 H new ATOM 0 HD21 LEU A 148 -6.250 -4.911 -8.932 1.00 21.33 H new ATOM 0 HD22 LEU A 148 -4.504 -5.206 -8.749 1.00 21.33 H new ATOM 0 HD23 LEU A 148 -5.638 -5.773 -7.501 1.00 21.33 H new ATOM 2311 N ALA A 149 -2.894 -5.072 -3.350 1.00 31.53 N ATOM 2312 CA ALA A 149 -1.774 -5.008 -2.398 1.00 15.23 C ATOM 2313 C ALA A 149 -0.670 -6.019 -2.773 1.00 1.45 C ATOM 2314 O ALA A 149 -0.950 -7.065 -3.365 1.00 23.23 O ATOM 2315 CB ALA A 149 -2.272 -5.249 -0.969 1.00 65.11 C ATOM 0 H ALA A 149 -3.784 -5.332 -2.924 1.00 31.53 H new ATOM 0 HA ALA A 149 -1.341 -4.009 -2.448 1.00 15.23 H new ATOM 0 HB1 ALA A 149 -1.431 -5.198 -0.277 1.00 65.11 H new ATOM 0 HB2 ALA A 149 -3.005 -4.486 -0.706 1.00 65.11 H new ATOM 0 HB3 ALA A 149 -2.735 -6.234 -0.906 1.00 65.11 H new ATOM 2321 N TYR A 150 0.579 -5.692 -2.429 1.00 51.00 N ATOM 2322 CA TYR A 150 1.749 -6.516 -2.794 1.00 74.03 C ATOM 2323 C TYR A 150 2.146 -7.392 -1.599 1.00 34.31 C ATOM 2324 O TYR A 150 1.795 -7.079 -0.450 1.00 11.22 O ATOM 2325 CB TYR A 150 2.941 -5.613 -3.223 1.00 51.32 C ATOM 2326 CG TYR A 150 2.544 -4.354 -4.013 1.00 13.51 C ATOM 2327 CD1 TYR A 150 2.182 -4.418 -5.362 1.00 41.32 C ATOM 2328 CD2 TYR A 150 2.535 -3.095 -3.399 1.00 52.14 C ATOM 2329 CE1 TYR A 150 1.832 -3.274 -6.063 1.00 60.22 C ATOM 2330 CE2 TYR A 150 2.184 -1.957 -4.096 1.00 2.52 C ATOM 2331 CZ TYR A 150 1.836 -2.047 -5.427 1.00 51.32 C ATOM 2332 OH TYR A 150 1.493 -0.905 -6.128 1.00 13.44 O ATOM 0 H TYR A 150 0.813 -4.856 -1.894 1.00 51.00 H new ATOM 0 HA TYR A 150 1.487 -7.154 -3.638 1.00 74.03 H new ATOM 0 HB2 TYR A 150 3.487 -5.308 -2.330 1.00 51.32 H new ATOM 0 HB3 TYR A 150 3.627 -6.204 -3.830 1.00 51.32 H new ATOM 0 HD1 TYR A 150 2.175 -5.373 -5.866 1.00 41.32 H new ATOM 0 HD2 TYR A 150 2.809 -3.013 -2.357 1.00 52.14 H new ATOM 0 HE1 TYR A 150 1.557 -3.342 -7.105 1.00 60.22 H new ATOM 0 HE2 TYR A 150 2.182 -0.998 -3.600 1.00 2.52 H new ATOM 0 HH TYR A 150 2.170 -0.213 -5.977 1.00 13.44 H new ATOM 2342 N SER A 151 2.840 -8.502 -1.879 1.00 13.41 N ATOM 2343 CA SER A 151 3.468 -9.352 -0.857 1.00 44.23 C ATOM 2344 C SER A 151 4.459 -8.541 0.022 1.00 72.40 C ATOM 2345 O SER A 151 5.337 -7.863 -0.523 1.00 30.14 O ATOM 2346 CB SER A 151 4.180 -10.511 -1.573 1.00 11.54 C ATOM 2347 OG SER A 151 3.273 -11.216 -2.404 1.00 54.34 O ATOM 0 H SER A 151 2.983 -8.840 -2.831 1.00 13.41 H new ATOM 0 HA SER A 151 2.705 -9.744 -0.184 1.00 44.23 H new ATOM 0 HB2 SER A 151 5.005 -10.124 -2.172 1.00 11.54 H new ATOM 0 HB3 SER A 151 4.611 -11.190 -0.837 1.00 11.54 H new ATOM 0 HG SER A 151 3.743 -11.949 -2.853 1.00 54.34 H new ATOM 2353 N PRO A 152 4.320 -8.580 1.391 1.00 10.02 N ATOM 2354 CA PRO A 152 5.086 -7.699 2.298 1.00 41.25 C ATOM 2355 C PRO A 152 6.565 -8.107 2.409 1.00 24.10 C ATOM 2356 O PRO A 152 6.861 -9.251 2.778 1.00 3.51 O ATOM 2357 CB PRO A 152 4.351 -7.840 3.670 1.00 41.10 C ATOM 2358 CG PRO A 152 3.142 -8.706 3.415 1.00 20.31 C ATOM 2359 CD PRO A 152 3.438 -9.492 2.161 1.00 42.43 C ATOM 0 HA PRO A 152 5.115 -6.672 1.935 1.00 41.25 H new ATOM 0 HB2 PRO A 152 5.004 -8.293 4.416 1.00 41.10 H new ATOM 0 HB3 PRO A 152 4.056 -6.864 4.055 1.00 41.10 H new ATOM 0 HG2 PRO A 152 2.958 -9.373 4.257 1.00 20.31 H new ATOM 0 HG3 PRO A 152 2.247 -8.096 3.289 1.00 20.31 H new ATOM 0 HD2 PRO A 152 3.933 -10.437 2.385 1.00 42.43 H new ATOM 0 HD3 PRO A 152 2.528 -9.731 1.611 1.00 42.43 H new ATOM 2367 N PHE A 153 7.475 -7.159 2.070 1.00 64.43 N ATOM 2368 CA PHE A 153 8.932 -7.269 2.315 1.00 51.25 C ATOM 2369 C PHE A 153 9.256 -7.844 3.713 1.00 43.01 C ATOM 2370 O PHE A 153 10.046 -8.777 3.827 1.00 42.43 O ATOM 2371 CB PHE A 153 9.611 -5.878 2.173 1.00 31.03 C ATOM 2372 CG PHE A 153 9.492 -5.224 0.791 1.00 14.41 C ATOM 2373 CD1 PHE A 153 10.354 -5.581 -0.249 1.00 73.35 C ATOM 2374 CD2 PHE A 153 8.538 -4.231 0.539 1.00 41.13 C ATOM 2375 CE1 PHE A 153 10.261 -4.976 -1.492 1.00 61.45 C ATOM 2376 CE2 PHE A 153 8.453 -3.624 -0.705 1.00 41.14 C ATOM 2377 CZ PHE A 153 9.313 -3.996 -1.718 1.00 21.55 C ATOM 0 H PHE A 153 7.212 -6.286 1.613 1.00 64.43 H new ATOM 0 HA PHE A 153 9.321 -7.959 1.567 1.00 51.25 H new ATOM 0 HB2 PHE A 153 9.178 -5.205 2.913 1.00 31.03 H new ATOM 0 HB3 PHE A 153 10.668 -5.982 2.417 1.00 31.03 H new ATOM 0 HD1 PHE A 153 11.104 -6.340 -0.082 1.00 73.35 H new ATOM 0 HD2 PHE A 153 7.859 -3.934 1.324 1.00 41.13 H new ATOM 0 HE1 PHE A 153 10.931 -5.271 -2.286 1.00 61.45 H new ATOM 0 HE2 PHE A 153 7.712 -2.858 -0.881 1.00 41.14 H new ATOM 0 HZ PHE A 153 9.245 -3.522 -2.686 1.00 21.55 H new ATOM 2387 N CYS A 154 8.610 -7.272 4.747 1.00 21.33 N ATOM 2388 CA CYS A 154 8.808 -7.664 6.157 1.00 10.41 C ATOM 2389 C CYS A 154 8.381 -9.121 6.429 1.00 21.35 C ATOM 2390 O CYS A 154 9.101 -9.860 7.108 1.00 0.30 O ATOM 2391 CB CYS A 154 8.032 -6.702 7.078 1.00 22.05 C ATOM 2392 SG CYS A 154 8.101 -7.126 8.834 1.00 14.04 S ATOM 0 H CYS A 154 7.931 -6.520 4.627 1.00 21.33 H new ATOM 0 HA CYS A 154 9.875 -7.600 6.368 1.00 10.41 H new ATOM 0 HB2 CYS A 154 8.426 -5.695 6.945 1.00 22.05 H new ATOM 0 HB3 CYS A 154 6.989 -6.680 6.763 1.00 22.05 H new ATOM 0 HG CYS A 154 7.170 -6.482 9.473 1.00 14.04 H new ATOM 2398 N ALA A 155 7.208 -9.519 5.892 1.00 40.22 N ATOM 2399 CA ALA A 155 6.642 -10.877 6.098 1.00 64.14 C ATOM 2400 C ALA A 155 7.458 -11.990 5.411 1.00 72.14 C ATOM 2401 O ALA A 155 7.225 -13.180 5.661 1.00 64.44 O ATOM 2402 CB ALA A 155 5.187 -10.915 5.622 1.00 34.10 C ATOM 0 H ALA A 155 6.628 -8.917 5.308 1.00 40.22 H new ATOM 0 HA ALA A 155 6.690 -11.077 7.168 1.00 64.14 H new ATOM 0 HB1 ALA A 155 4.780 -11.914 5.777 1.00 34.10 H new ATOM 0 HB2 ALA A 155 4.600 -10.192 6.188 1.00 34.10 H new ATOM 0 HB3 ALA A 155 5.144 -10.666 4.562 1.00 34.10 H new ATOM 2408 N TYR A 156 8.385 -11.604 4.525 1.00 45.11 N ATOM 2409 CA TYR A 156 9.265 -12.561 3.820 1.00 52.03 C ATOM 2410 C TYR A 156 10.747 -12.351 4.170 1.00 34.31 C ATOM 2411 O TYR A 156 11.566 -13.246 3.948 1.00 3.52 O ATOM 2412 CB TYR A 156 9.007 -12.487 2.294 1.00 44.34 C ATOM 2413 CG TYR A 156 7.606 -12.990 1.900 1.00 3.41 C ATOM 2414 CD1 TYR A 156 7.287 -14.346 1.998 1.00 32.44 C ATOM 2415 CD2 TYR A 156 6.598 -12.120 1.475 1.00 61.13 C ATOM 2416 CE1 TYR A 156 6.029 -14.812 1.680 1.00 74.01 C ATOM 2417 CE2 TYR A 156 5.333 -12.590 1.164 1.00 14.32 C ATOM 2418 CZ TYR A 156 5.056 -13.934 1.267 1.00 44.04 C ATOM 2419 OH TYR A 156 3.792 -14.406 0.970 1.00 14.43 O ATOM 0 H TYR A 156 8.550 -10.629 4.274 1.00 45.11 H new ATOM 0 HA TYR A 156 9.020 -13.567 4.160 1.00 52.03 H new ATOM 0 HB2 TYR A 156 9.125 -11.456 1.960 1.00 44.34 H new ATOM 0 HB3 TYR A 156 9.760 -13.079 1.774 1.00 44.34 H new ATOM 0 HD1 TYR A 156 8.041 -15.044 2.330 1.00 32.44 H new ATOM 0 HD2 TYR A 156 6.809 -11.064 1.388 1.00 61.13 H new ATOM 0 HE1 TYR A 156 5.808 -15.867 1.755 1.00 74.01 H new ATOM 0 HE2 TYR A 156 4.565 -11.903 0.841 1.00 14.32 H new ATOM 0 HH TYR A 156 3.220 -13.659 0.694 1.00 14.43 H new ATOM 2429 N SER A 157 11.090 -11.180 4.726 1.00 74.00 N ATOM 2430 CA SER A 157 12.453 -10.864 5.185 1.00 54.45 C ATOM 2431 C SER A 157 12.392 -9.806 6.309 1.00 40.33 C ATOM 2432 O SER A 157 11.945 -8.673 6.087 1.00 41.33 O ATOM 2433 CB SER A 157 13.336 -10.344 4.020 1.00 32.34 C ATOM 2434 OG SER A 157 13.656 -11.361 3.087 1.00 13.33 O ATOM 0 H SER A 157 10.426 -10.420 4.871 1.00 74.00 H new ATOM 0 HA SER A 157 12.904 -11.780 5.566 1.00 54.45 H new ATOM 0 HB2 SER A 157 12.816 -9.535 3.507 1.00 32.34 H new ATOM 0 HB3 SER A 157 14.257 -9.924 4.425 1.00 32.34 H new ATOM 0 HG SER A 157 12.913 -11.474 2.458 1.00 13.33 H new ATOM 2440 N ASP A 158 12.887 -10.179 7.503 1.00 24.14 N ATOM 2441 CA ASP A 158 12.936 -9.282 8.686 1.00 63.52 C ATOM 2442 C ASP A 158 14.115 -8.298 8.584 1.00 30.32 C ATOM 2443 O ASP A 158 14.243 -7.391 9.419 1.00 31.44 O ATOM 2444 CB ASP A 158 13.030 -10.101 10.002 1.00 62.15 C ATOM 2445 CG ASP A 158 11.851 -11.069 10.195 1.00 20.53 C ATOM 2446 OD1 ASP A 158 10.745 -10.614 10.562 1.00 30.14 O ATOM 2447 OD2 ASP A 158 12.022 -12.291 9.968 1.00 24.31 O ATOM 0 H ASP A 158 13.266 -11.109 7.681 1.00 24.14 H new ATOM 0 HA ASP A 158 12.010 -8.708 8.704 1.00 63.52 H new ATOM 0 HB2 ASP A 158 13.961 -10.667 10.005 1.00 62.15 H new ATOM 0 HB3 ASP A 158 13.071 -9.415 10.848 1.00 62.15 H new ATOM 2452 N THR A 159 14.959 -8.479 7.540 1.00 74.32 N ATOM 2453 CA THR A 159 16.078 -7.568 7.230 1.00 71.33 C ATOM 2454 C THR A 159 15.559 -6.165 6.856 1.00 14.20 C ATOM 2455 O THR A 159 16.292 -5.186 6.968 1.00 31.44 O ATOM 2456 CB THR A 159 16.994 -8.132 6.092 1.00 44.21 C ATOM 2457 OG1 THR A 159 18.216 -7.376 6.012 1.00 65.55 O ATOM 2458 CG2 THR A 159 16.314 -8.115 4.714 1.00 73.31 C ATOM 0 H THR A 159 14.880 -9.262 6.891 1.00 74.32 H new ATOM 0 HA THR A 159 16.684 -7.488 8.132 1.00 71.33 H new ATOM 0 HB THR A 159 17.200 -9.170 6.353 1.00 44.21 H new ATOM 0 HG1 THR A 159 18.780 -7.740 5.298 1.00 65.55 H new ATOM 0 HG21 THR A 159 16.997 -8.517 3.966 1.00 73.31 H new ATOM 0 HG22 THR A 159 15.411 -8.725 4.746 1.00 73.31 H new ATOM 0 HG23 THR A 159 16.051 -7.091 4.451 1.00 73.31 H new ATOM 2466 N PHE A 160 14.279 -6.095 6.438 1.00 42.20 N ATOM 2467 CA PHE A 160 13.566 -4.830 6.262 1.00 1.13 C ATOM 2468 C PHE A 160 12.901 -4.545 7.608 1.00 53.10 C ATOM 2469 O PHE A 160 11.950 -5.251 7.980 1.00 71.21 O ATOM 2470 CB PHE A 160 12.478 -4.922 5.152 1.00 23.10 C ATOM 2471 CG PHE A 160 12.986 -5.277 3.757 1.00 22.43 C ATOM 2472 CD1 PHE A 160 13.093 -6.609 3.353 1.00 40.02 C ATOM 2473 CD2 PHE A 160 13.333 -4.280 2.841 1.00 50.52 C ATOM 2474 CE1 PHE A 160 13.530 -6.931 2.084 1.00 61.40 C ATOM 2475 CE2 PHE A 160 13.767 -4.606 1.569 1.00 45.33 C ATOM 2476 CZ PHE A 160 13.864 -5.933 1.193 1.00 63.33 C ATOM 0 H PHE A 160 13.718 -6.917 6.215 1.00 42.20 H new ATOM 0 HA PHE A 160 14.255 -4.044 5.955 1.00 1.13 H new ATOM 0 HB2 PHE A 160 11.741 -5.668 5.451 1.00 23.10 H new ATOM 0 HB3 PHE A 160 11.959 -3.965 5.097 1.00 23.10 H new ATOM 0 HD1 PHE A 160 12.830 -7.398 4.042 1.00 40.02 H new ATOM 0 HD2 PHE A 160 13.261 -3.242 3.130 1.00 50.52 H new ATOM 0 HE1 PHE A 160 13.611 -7.967 1.788 1.00 61.40 H new ATOM 0 HE2 PHE A 160 14.030 -3.825 0.870 1.00 45.33 H new ATOM 0 HZ PHE A 160 14.202 -6.188 0.200 1.00 63.33 H new ATOM 2486 N SER A 161 13.426 -3.568 8.357 1.00 10.22 N ATOM 2487 CA SER A 161 12.878 -3.216 9.671 1.00 2.20 C ATOM 2488 C SER A 161 11.456 -2.654 9.483 1.00 30.10 C ATOM 2489 O SER A 161 11.259 -1.724 8.688 1.00 33.15 O ATOM 2490 CB SER A 161 13.804 -2.207 10.376 1.00 51.25 C ATOM 2491 OG SER A 161 15.122 -2.725 10.507 1.00 43.21 O ATOM 0 H SER A 161 14.230 -3.007 8.075 1.00 10.22 H new ATOM 0 HA SER A 161 12.819 -4.100 10.306 1.00 2.20 H new ATOM 0 HB2 SER A 161 13.831 -1.276 9.810 1.00 51.25 H new ATOM 0 HB3 SER A 161 13.404 -1.969 11.362 1.00 51.25 H new ATOM 0 HG SER A 161 15.690 -2.065 10.956 1.00 43.21 H new ATOM 2497 N CYS A 162 10.480 -3.235 10.204 1.00 44.15 N ATOM 2498 CA CYS A 162 9.044 -3.033 9.955 1.00 22.11 C ATOM 2499 C CYS A 162 8.596 -1.606 10.355 1.00 14.51 C ATOM 2500 O CYS A 162 9.245 -0.970 11.201 1.00 73.32 O ATOM 2501 CB CYS A 162 8.256 -4.119 10.738 1.00 22.41 C ATOM 2502 SG CYS A 162 8.704 -4.252 12.480 1.00 31.41 S ATOM 0 H CYS A 162 10.670 -3.864 10.984 1.00 44.15 H new ATOM 0 HA CYS A 162 8.839 -3.131 8.889 1.00 22.11 H new ATOM 0 HB2 CYS A 162 7.190 -3.901 10.665 1.00 22.41 H new ATOM 0 HB3 CYS A 162 8.418 -5.085 10.259 1.00 22.41 H new ATOM 0 HG CYS A 162 7.990 -5.182 13.042 1.00 31.41 H new ATOM 2508 N PRO A 163 7.471 -1.079 9.757 1.00 50.03 N ATOM 2509 CA PRO A 163 6.993 0.297 10.028 1.00 51.41 C ATOM 2510 C PRO A 163 6.464 0.471 11.462 1.00 33.20 C ATOM 2511 O PRO A 163 6.218 -0.505 12.175 1.00 42.24 O ATOM 2512 CB PRO A 163 5.857 0.493 8.992 1.00 1.20 C ATOM 2513 CG PRO A 163 5.363 -0.882 8.689 1.00 33.43 C ATOM 2514 CD PRO A 163 6.578 -1.780 8.782 1.00 23.10 C ATOM 0 HA PRO A 163 7.795 1.030 9.942 1.00 51.41 H new ATOM 0 HB2 PRO A 163 5.060 1.118 9.395 1.00 1.20 H new ATOM 0 HB3 PRO A 163 6.225 0.986 8.092 1.00 1.20 H new ATOM 0 HG2 PRO A 163 4.594 -1.188 9.399 1.00 33.43 H new ATOM 0 HG3 PRO A 163 4.916 -0.928 7.696 1.00 33.43 H new ATOM 0 HD2 PRO A 163 6.311 -2.778 9.131 1.00 23.10 H new ATOM 0 HD3 PRO A 163 7.061 -1.900 7.812 1.00 23.10 H new ATOM 2522 N LEU A 164 6.305 1.730 11.865 1.00 24.31 N ATOM 2523 CA LEU A 164 5.624 2.115 13.098 1.00 72.04 C ATOM 2524 C LEU A 164 4.171 2.370 12.670 1.00 70.41 C ATOM 2525 O LEU A 164 3.896 3.395 12.029 1.00 54.34 O ATOM 2526 CB LEU A 164 6.308 3.374 13.742 1.00 32.22 C ATOM 2527 CG LEU A 164 5.779 3.877 15.147 1.00 53.22 C ATOM 2528 CD1 LEU A 164 4.466 4.701 15.041 1.00 4.21 C ATOM 2529 CD2 LEU A 164 5.618 2.705 16.151 1.00 24.14 C ATOM 0 H LEU A 164 6.653 2.527 11.332 1.00 24.31 H new ATOM 0 HA LEU A 164 5.672 1.350 13.873 1.00 72.04 H new ATOM 0 HB2 LEU A 164 7.372 3.159 13.844 1.00 32.22 H new ATOM 0 HB3 LEU A 164 6.216 4.200 13.037 1.00 32.22 H new ATOM 0 HG LEU A 164 6.544 4.552 15.531 1.00 53.22 H new ATOM 0 HD11 LEU A 164 4.154 5.017 16.036 1.00 4.21 H new ATOM 0 HD12 LEU A 164 4.637 5.579 14.418 1.00 4.21 H new ATOM 0 HD13 LEU A 164 3.685 4.085 14.594 1.00 4.21 H new ATOM 0 HD21 LEU A 164 5.253 3.089 17.104 1.00 24.14 H new ATOM 0 HD22 LEU A 164 4.905 1.982 15.755 1.00 24.14 H new ATOM 0 HD23 LEU A 164 6.582 2.219 16.301 1.00 24.14 H new ATOM 2541 N PRO A 165 3.231 1.419 12.956 1.00 2.30 N ATOM 2542 CA PRO A 165 1.857 1.492 12.427 1.00 25.45 C ATOM 2543 C PRO A 165 1.007 2.552 13.168 1.00 32.22 C ATOM 2544 O PRO A 165 0.896 2.503 14.400 1.00 63.20 O ATOM 2545 CB PRO A 165 1.333 0.053 12.666 1.00 23.42 C ATOM 2546 CG PRO A 165 2.060 -0.427 13.885 1.00 5.01 C ATOM 2547 CD PRO A 165 3.430 0.216 13.825 1.00 33.35 C ATOM 0 HA PRO A 165 1.810 1.801 11.383 1.00 25.45 H new ATOM 0 HB2 PRO A 165 0.254 0.047 12.822 1.00 23.42 H new ATOM 0 HB3 PRO A 165 1.535 -0.588 11.808 1.00 23.42 H new ATOM 0 HG2 PRO A 165 1.532 -0.139 14.794 1.00 5.01 H new ATOM 0 HG3 PRO A 165 2.138 -1.514 13.892 1.00 5.01 H new ATOM 0 HD2 PRO A 165 3.783 0.495 14.818 1.00 33.35 H new ATOM 0 HD3 PRO A 165 4.171 -0.463 13.403 1.00 33.35 H new ATOM 2555 N PRO A 166 0.422 3.552 12.433 1.00 11.32 N ATOM 2556 CA PRO A 166 -0.597 4.449 13.013 1.00 33.44 C ATOM 2557 C PRO A 166 -1.865 3.623 13.305 1.00 50.33 C ATOM 2558 O PRO A 166 -2.439 3.077 12.377 1.00 14.54 O ATOM 2559 CB PRO A 166 -0.826 5.508 11.901 1.00 1.52 C ATOM 2560 CG PRO A 166 -0.440 4.809 10.631 1.00 22.45 C ATOM 2561 CD PRO A 166 0.707 3.893 11.002 1.00 51.04 C ATOM 0 HA PRO A 166 -0.311 4.921 13.953 1.00 33.44 H new ATOM 0 HB2 PRO A 166 -1.865 5.836 11.873 1.00 1.52 H new ATOM 0 HB3 PRO A 166 -0.216 6.396 12.067 1.00 1.52 H new ATOM 0 HG2 PRO A 166 -1.278 4.243 10.225 1.00 22.45 H new ATOM 0 HG3 PRO A 166 -0.138 5.524 9.866 1.00 22.45 H new ATOM 0 HD2 PRO A 166 0.732 3.003 10.373 1.00 51.04 H new ATOM 0 HD3 PRO A 166 1.671 4.389 10.890 1.00 51.04 H new ATOM 2569 N GLU A 167 -2.267 3.538 14.589 1.00 12.00 N ATOM 2570 CA GLU A 167 -3.303 2.579 15.104 1.00 32.40 C ATOM 2571 C GLU A 167 -4.614 2.514 14.270 1.00 33.14 C ATOM 2572 O GLU A 167 -5.339 1.513 14.326 1.00 31.10 O ATOM 2573 CB GLU A 167 -3.639 2.900 16.583 1.00 3.11 C ATOM 2574 CG GLU A 167 -2.422 2.924 17.529 1.00 21.32 C ATOM 2575 CD GLU A 167 -2.810 3.162 18.995 1.00 63.22 C ATOM 2576 OE1 GLU A 167 -3.252 4.285 19.327 1.00 3.53 O ATOM 2577 OE2 GLU A 167 -2.683 2.235 19.824 1.00 3.43 O ATOM 0 H GLU A 167 -1.884 4.137 15.320 1.00 12.00 H new ATOM 0 HA GLU A 167 -2.848 1.593 15.012 1.00 32.40 H new ATOM 0 HB2 GLU A 167 -4.135 3.870 16.627 1.00 3.11 H new ATOM 0 HB3 GLU A 167 -4.352 2.161 16.948 1.00 3.11 H new ATOM 0 HG2 GLU A 167 -1.887 1.978 17.449 1.00 21.32 H new ATOM 0 HG3 GLU A 167 -1.734 3.707 17.209 1.00 21.32 H new ATOM 2584 N SER A 168 -4.882 3.568 13.485 1.00 42.12 N ATOM 2585 CA SER A 168 -6.037 3.639 12.563 1.00 62.41 C ATOM 2586 C SER A 168 -5.921 2.632 11.383 1.00 34.45 C ATOM 2587 O SER A 168 -6.920 2.322 10.731 1.00 44.22 O ATOM 2588 CB SER A 168 -6.154 5.077 12.024 1.00 64.51 C ATOM 2589 OG SER A 168 -6.244 6.018 13.090 1.00 50.14 O ATOM 0 H SER A 168 -4.300 4.406 13.468 1.00 42.12 H new ATOM 0 HA SER A 168 -6.933 3.365 13.121 1.00 62.41 H new ATOM 0 HB2 SER A 168 -5.288 5.308 11.403 1.00 64.51 H new ATOM 0 HB3 SER A 168 -7.034 5.159 11.387 1.00 64.51 H new ATOM 0 HG SER A 168 -5.863 6.874 12.803 1.00 50.14 H new ATOM 2595 N ASN A 169 -4.708 2.084 11.166 1.00 63.12 N ATOM 2596 CA ASN A 169 -4.389 1.252 9.992 1.00 23.25 C ATOM 2597 C ASN A 169 -4.738 -0.215 10.263 1.00 13.42 C ATOM 2598 O ASN A 169 -4.735 -1.047 9.343 1.00 1.32 O ATOM 2599 CB ASN A 169 -2.893 1.395 9.568 1.00 60.33 C ATOM 2600 CG ASN A 169 -1.871 0.640 10.455 1.00 62.34 C ATOM 2601 OD1 ASN A 169 -2.052 0.485 11.658 1.00 25.41 O ATOM 2602 ND2 ASN A 169 -0.782 0.167 9.857 1.00 14.22 N ATOM 0 H ASN A 169 -3.921 2.208 11.803 1.00 63.12 H new ATOM 0 HA ASN A 169 -4.997 1.609 9.161 1.00 23.25 H new ATOM 0 HB2 ASN A 169 -2.789 1.040 8.543 1.00 60.33 H new ATOM 0 HB3 ASN A 169 -2.634 2.454 9.567 1.00 60.33 H new ATOM 0 HD21 ASN A 169 -0.079 -0.335 10.400 1.00 14.22 H new ATOM 0 HD22 ASN A 169 -0.649 0.306 8.855 1.00 14.22 H new ATOM 2609 N TRP A 170 -5.026 -0.527 11.536 1.00 25.44 N ATOM 2610 CA TRP A 170 -5.454 -1.859 11.944 1.00 3.01 C ATOM 2611 C TRP A 170 -6.921 -2.034 11.545 1.00 24.33 C ATOM 2612 O TRP A 170 -7.824 -1.532 12.226 1.00 23.02 O ATOM 2613 CB TRP A 170 -5.271 -2.070 13.470 1.00 43.52 C ATOM 2614 CG TRP A 170 -3.860 -1.862 13.977 1.00 54.20 C ATOM 2615 CD1 TRP A 170 -2.695 -2.014 13.278 1.00 50.44 C ATOM 2616 CD2 TRP A 170 -3.474 -1.489 15.310 1.00 24.44 C ATOM 2617 NE1 TRP A 170 -1.625 -1.717 14.078 1.00 45.34 N ATOM 2618 CE2 TRP A 170 -2.072 -1.408 15.331 1.00 72.33 C ATOM 2619 CE3 TRP A 170 -4.181 -1.211 16.484 1.00 1.34 C ATOM 2620 CZ2 TRP A 170 -1.360 -1.055 16.476 1.00 60.15 C ATOM 2621 CZ3 TRP A 170 -3.475 -0.865 17.623 1.00 2.40 C ATOM 2622 CH2 TRP A 170 -2.076 -0.793 17.613 1.00 52.15 C ATOM 0 H TRP A 170 -4.967 0.141 12.305 1.00 25.44 H new ATOM 0 HA TRP A 170 -4.838 -2.607 11.445 1.00 3.01 H new ATOM 0 HB2 TRP A 170 -5.936 -1.387 13.999 1.00 43.52 H new ATOM 0 HB3 TRP A 170 -5.587 -3.082 13.723 1.00 43.52 H new ATOM 0 HD1 TRP A 170 -2.629 -2.323 12.245 1.00 50.44 H new ATOM 0 HE1 TRP A 170 -0.648 -1.725 13.785 1.00 45.34 H new ATOM 0 HE3 TRP A 170 -5.259 -1.265 16.502 1.00 1.34 H new ATOM 0 HZ2 TRP A 170 -0.282 -0.990 16.467 1.00 60.15 H new ATOM 0 HZ3 TRP A 170 -4.011 -0.647 18.535 1.00 2.40 H new ATOM 0 HH2 TRP A 170 -1.553 -0.526 18.519 1.00 52.15 H new ATOM 2633 N LEU A 171 -7.149 -2.716 10.415 1.00 3.43 N ATOM 2634 CA LEU A 171 -8.494 -2.978 9.903 1.00 12.45 C ATOM 2635 C LEU A 171 -9.025 -4.190 10.679 1.00 21.13 C ATOM 2636 O LEU A 171 -8.405 -5.262 10.627 1.00 42.04 O ATOM 2637 CB LEU A 171 -8.454 -3.267 8.367 1.00 42.10 C ATOM 2638 CG LEU A 171 -7.563 -2.329 7.479 1.00 75.22 C ATOM 2639 CD1 LEU A 171 -7.669 -2.707 5.982 1.00 10.01 C ATOM 2640 CD2 LEU A 171 -7.890 -0.838 7.695 1.00 22.23 C ATOM 0 H LEU A 171 -6.405 -3.100 9.833 1.00 3.43 H new ATOM 0 HA LEU A 171 -9.144 -2.114 10.040 1.00 12.45 H new ATOM 0 HB2 LEU A 171 -8.109 -4.291 8.226 1.00 42.10 H new ATOM 0 HB3 LEU A 171 -9.475 -3.219 7.988 1.00 42.10 H new ATOM 0 HG LEU A 171 -6.531 -2.481 7.797 1.00 75.22 H new ATOM 0 HD11 LEU A 171 -7.041 -2.039 5.393 1.00 10.01 H new ATOM 0 HD12 LEU A 171 -7.337 -3.736 5.842 1.00 10.01 H new ATOM 0 HD13 LEU A 171 -8.705 -2.613 5.655 1.00 10.01 H new ATOM 0 HD21 LEU A 171 -7.248 -0.229 7.059 1.00 22.23 H new ATOM 0 HD22 LEU A 171 -8.934 -0.654 7.440 1.00 22.23 H new ATOM 0 HD23 LEU A 171 -7.720 -0.576 8.739 1.00 22.23 H new ATOM 2652 N GLU A 172 -10.123 -4.024 11.435 1.00 34.34 N ATOM 2653 CA GLU A 172 -10.683 -5.102 12.282 1.00 74.22 C ATOM 2654 C GLU A 172 -11.635 -5.979 11.434 1.00 2.20 C ATOM 2655 O GLU A 172 -12.799 -6.203 11.775 1.00 33.50 O ATOM 2656 CB GLU A 172 -11.386 -4.468 13.521 1.00 31.40 C ATOM 2657 CG GLU A 172 -11.761 -5.445 14.661 1.00 63.55 C ATOM 2658 CD GLU A 172 -10.557 -6.211 15.247 1.00 13.03 C ATOM 2659 OE1 GLU A 172 -9.738 -5.597 15.968 1.00 52.50 O ATOM 2660 OE2 GLU A 172 -10.425 -7.431 14.995 1.00 52.20 O ATOM 0 H GLU A 172 -10.646 -3.150 11.480 1.00 34.34 H new ATOM 0 HA GLU A 172 -9.893 -5.754 12.656 1.00 74.22 H new ATOM 0 HB2 GLU A 172 -10.733 -3.697 13.930 1.00 31.40 H new ATOM 0 HB3 GLU A 172 -12.294 -3.969 13.183 1.00 31.40 H new ATOM 0 HG2 GLU A 172 -12.248 -4.886 15.460 1.00 63.55 H new ATOM 0 HG3 GLU A 172 -12.489 -6.164 14.286 1.00 63.55 H new ATOM 2667 N THR A 173 -11.084 -6.469 10.317 1.00 32.45 N ATOM 2668 CA THR A 173 -11.793 -7.242 9.294 1.00 5.41 C ATOM 2669 C THR A 173 -10.761 -7.940 8.391 1.00 15.12 C ATOM 2670 O THR A 173 -9.604 -7.512 8.328 1.00 21.24 O ATOM 2671 CB THR A 173 -12.721 -6.335 8.429 1.00 52.30 C ATOM 2672 OG1 THR A 173 -13.362 -7.120 7.410 1.00 63.45 O ATOM 2673 CG2 THR A 173 -11.968 -5.149 7.785 1.00 44.43 C ATOM 0 H THR A 173 -10.098 -6.333 10.094 1.00 32.45 H new ATOM 0 HA THR A 173 -12.422 -7.979 9.793 1.00 5.41 H new ATOM 0 HB THR A 173 -13.469 -5.912 9.100 1.00 52.30 H new ATOM 0 HG1 THR A 173 -13.118 -6.772 6.527 1.00 63.45 H new ATOM 0 HG21 THR A 173 -12.664 -4.553 7.195 1.00 44.43 H new ATOM 0 HG22 THR A 173 -11.531 -4.528 8.567 1.00 44.43 H new ATOM 0 HG23 THR A 173 -11.177 -5.528 7.138 1.00 44.43 H new ATOM 2681 N ALA A 174 -11.180 -9.012 7.706 1.00 54.00 N ATOM 2682 CA ALA A 174 -10.300 -9.805 6.835 1.00 62.11 C ATOM 2683 C ALA A 174 -10.417 -9.312 5.387 1.00 55.52 C ATOM 2684 O ALA A 174 -11.530 -9.160 4.873 1.00 53.33 O ATOM 2685 CB ALA A 174 -10.662 -11.297 6.943 1.00 1.12 C ATOM 0 H ALA A 174 -12.140 -9.355 7.740 1.00 54.00 H new ATOM 0 HA ALA A 174 -9.265 -9.681 7.155 1.00 62.11 H new ATOM 0 HB1 ALA A 174 -10.006 -11.878 6.295 1.00 1.12 H new ATOM 0 HB2 ALA A 174 -10.539 -11.627 7.974 1.00 1.12 H new ATOM 0 HB3 ALA A 174 -11.698 -11.443 6.636 1.00 1.12 H new ATOM 2691 N VAL A 175 -9.265 -9.069 4.743 1.00 10.45 N ATOM 2692 CA VAL A 175 -9.202 -8.672 3.331 1.00 41.35 C ATOM 2693 C VAL A 175 -8.894 -9.933 2.514 1.00 30.44 C ATOM 2694 O VAL A 175 -7.726 -10.290 2.284 1.00 52.20 O ATOM 2695 CB VAL A 175 -8.132 -7.541 3.056 1.00 60.33 C ATOM 2696 CG1 VAL A 175 -8.046 -7.212 1.543 1.00 4.13 C ATOM 2697 CG2 VAL A 175 -8.443 -6.272 3.892 1.00 52.24 C ATOM 0 H VAL A 175 -8.351 -9.143 5.189 1.00 10.45 H new ATOM 0 HA VAL A 175 -10.159 -8.240 3.038 1.00 41.35 H new ATOM 0 HB VAL A 175 -7.157 -7.915 3.368 1.00 60.33 H new ATOM 0 HG11 VAL A 175 -7.303 -6.431 1.382 1.00 4.13 H new ATOM 0 HG12 VAL A 175 -7.757 -8.107 0.992 1.00 4.13 H new ATOM 0 HG13 VAL A 175 -9.018 -6.866 1.190 1.00 4.13 H new ATOM 0 HG21 VAL A 175 -7.693 -5.508 3.686 1.00 52.24 H new ATOM 0 HG22 VAL A 175 -9.430 -5.893 3.625 1.00 52.24 H new ATOM 0 HG23 VAL A 175 -8.425 -6.522 4.953 1.00 52.24 H new ATOM 2707 N THR A 176 -9.968 -10.628 2.133 1.00 55.14 N ATOM 2708 CA THR A 176 -9.905 -11.861 1.357 1.00 65.25 C ATOM 2709 C THR A 176 -9.883 -11.527 -0.139 1.00 11.35 C ATOM 2710 O THR A 176 -10.915 -11.186 -0.727 1.00 51.14 O ATOM 2711 CB THR A 176 -11.121 -12.786 1.713 1.00 23.22 C ATOM 2712 OG1 THR A 176 -12.357 -12.041 1.642 1.00 52.44 O ATOM 2713 CG2 THR A 176 -10.988 -13.384 3.122 1.00 11.31 C ATOM 0 H THR A 176 -10.920 -10.342 2.361 1.00 55.14 H new ATOM 0 HA THR A 176 -8.990 -12.400 1.604 1.00 65.25 H new ATOM 0 HB THR A 176 -11.128 -13.598 0.986 1.00 23.22 H new ATOM 0 HG1 THR A 176 -12.334 -11.442 0.867 1.00 52.44 H new ATOM 0 HG21 THR A 176 -11.849 -14.018 3.331 1.00 11.31 H new ATOM 0 HG22 THR A 176 -10.077 -13.979 3.180 1.00 11.31 H new ATOM 0 HG23 THR A 176 -10.943 -12.579 3.856 1.00 11.31 H new ATOM 2721 N ALA A 177 -8.695 -11.600 -0.740 1.00 15.44 N ATOM 2722 CA ALA A 177 -8.501 -11.283 -2.157 1.00 42.20 C ATOM 2723 C ALA A 177 -7.385 -12.146 -2.744 1.00 1.25 C ATOM 2724 O ALA A 177 -6.499 -12.617 -2.017 1.00 51.13 O ATOM 2725 CB ALA A 177 -8.202 -9.781 -2.333 1.00 71.20 C ATOM 0 H ALA A 177 -7.840 -11.880 -0.259 1.00 15.44 H new ATOM 0 HA ALA A 177 -9.419 -11.507 -2.701 1.00 42.20 H new ATOM 0 HB1 ALA A 177 -8.060 -9.560 -3.391 1.00 71.20 H new ATOM 0 HB2 ALA A 177 -9.038 -9.196 -1.949 1.00 71.20 H new ATOM 0 HB3 ALA A 177 -7.296 -9.524 -1.784 1.00 71.20 H new ATOM 2731 N GLY A 178 -7.459 -12.350 -4.062 1.00 44.15 N ATOM 2732 CA GLY A 178 -6.455 -13.077 -4.820 1.00 54.23 C ATOM 2733 C GLY A 178 -6.365 -14.553 -4.530 1.00 70.33 C ATOM 2734 O GLY A 178 -7.196 -15.131 -3.815 1.00 41.31 O ATOM 0 H GLY A 178 -8.231 -12.007 -4.634 1.00 44.15 H new ATOM 0 HA2 GLY A 178 -6.661 -12.945 -5.882 1.00 54.23 H new ATOM 0 HA3 GLY A 178 -5.482 -12.626 -4.626 1.00 54.23 H new ATOM 2738 N GLU A 179 -5.348 -15.155 -5.135 1.00 12.22 N ATOM 2739 CA GLU A 179 -4.901 -16.503 -4.837 1.00 23.15 C ATOM 2740 C GLU A 179 -4.082 -16.456 -3.526 1.00 20.11 C ATOM 2741 O GLU A 179 -3.513 -15.407 -3.178 1.00 71.30 O ATOM 2742 CB GLU A 179 -4.073 -17.025 -6.042 1.00 15.32 C ATOM 2743 CG GLU A 179 -3.741 -18.522 -6.014 1.00 43.35 C ATOM 2744 CD GLU A 179 -3.061 -19.008 -7.301 1.00 73.42 C ATOM 2745 OE1 GLU A 179 -1.820 -18.921 -7.403 1.00 61.21 O ATOM 2746 OE2 GLU A 179 -3.773 -19.461 -8.224 1.00 71.53 O ATOM 0 H GLU A 179 -4.799 -14.703 -5.866 1.00 12.22 H new ATOM 0 HA GLU A 179 -5.734 -17.190 -4.689 1.00 23.15 H new ATOM 0 HB2 GLU A 179 -4.622 -16.809 -6.959 1.00 15.32 H new ATOM 0 HB3 GLU A 179 -3.140 -16.464 -6.090 1.00 15.32 H new ATOM 0 HG2 GLU A 179 -3.090 -18.729 -5.165 1.00 43.35 H new ATOM 0 HG3 GLU A 179 -4.658 -19.089 -5.857 1.00 43.35 H new ATOM 2753 N ARG A 180 -4.010 -17.581 -2.812 1.00 32.42 N ATOM 2754 CA ARG A 180 -3.423 -17.633 -1.454 1.00 35.14 C ATOM 2755 C ARG A 180 -1.888 -17.725 -1.525 1.00 63.20 C ATOM 2756 O ARG A 180 -1.304 -17.806 -2.616 1.00 42.43 O ATOM 2757 CB ARG A 180 -4.018 -18.842 -0.673 1.00 60.22 C ATOM 2758 CG ARG A 180 -5.514 -18.699 -0.315 1.00 73.13 C ATOM 2759 CD ARG A 180 -6.139 -20.014 0.187 1.00 33.03 C ATOM 2760 NE ARG A 180 -6.124 -21.062 -0.854 1.00 35.23 N ATOM 2761 CZ ARG A 180 -6.900 -22.164 -0.874 1.00 61.44 C ATOM 2762 NH1 ARG A 180 -7.778 -22.408 0.099 1.00 24.22 N ATOM 2763 NH2 ARG A 180 -6.788 -23.018 -1.881 1.00 62.44 N ATOM 0 H ARG A 180 -4.352 -18.481 -3.148 1.00 32.42 H new ATOM 0 HA ARG A 180 -3.674 -16.714 -0.924 1.00 35.14 H new ATOM 0 HB2 ARG A 180 -3.885 -19.745 -1.269 1.00 60.22 H new ATOM 0 HB3 ARG A 180 -3.449 -18.980 0.246 1.00 60.22 H new ATOM 0 HG2 ARG A 180 -5.627 -17.933 0.452 1.00 73.13 H new ATOM 0 HG3 ARG A 180 -6.061 -18.355 -1.193 1.00 73.13 H new ATOM 0 HD2 ARG A 180 -5.593 -20.364 1.063 1.00 33.03 H new ATOM 0 HD3 ARG A 180 -7.166 -19.831 0.503 1.00 33.03 H new ATOM 0 HE ARG A 180 -5.468 -20.941 -1.626 1.00 35.23 H new ATOM 0 HH11 ARG A 180 -7.872 -21.755 0.877 1.00 24.22 H new ATOM 0 HH12 ARG A 180 -8.356 -23.248 0.065 1.00 24.22 H new ATOM 0 HH21 ARG A 180 -6.120 -22.838 -2.630 1.00 62.44 H new ATOM 0 HH22 ARG A 180 -7.370 -23.855 -1.907 1.00 62.44 H new