USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1330 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 138 THR OG1 : rot 130:sc= 0 USER MOD Set 1.2: A 161 GLN : amide:sc=-0.00977 K(o=-0.0098,f=-0.54) USER MOD Set 2.1: A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot -7:sc= -0.275 USER MOD Single : A 9 THR OG1 : rot 87:sc= 0.0746 USER MOD Single : A 13 ASN : amide:sc= -0.132 K(o=-0.13,f=-1) USER MOD Single : A 16 GLN : amide:sc= -0.215 X(o=-0.21,f=-0.041) USER MOD Single : A 17 THR OG1 : rot 92:sc= 1.2 USER MOD Single : A 19 GLN : amide:sc= -0.962 K(o=-0.96,f=-1.9!) USER MOD Single : A 23 HIS : no HD1:sc= -0.0257 X(o=-0.026,f=-0.017) USER MOD Single : A 27 TYR OH : rot -136:sc= 0.169 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -136:sc= 1.03 (180deg=-0.556) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0112 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -1.09 K(o=-1.1,f=-0.085) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -143:sc= 0.343 (180deg=0.0132) USER MOD Single : A 66 ASN : amide:sc= -1.27 X(o=-1.3,f=-1.2!) USER MOD Single : A 68 HIS : no HD1:sc= -0.324 X(o=-0.32,f=-0.61) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl -161:sc= -1.93! (180deg=-2.11) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= -0.0105 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 HIS : no HE2:sc= -0.223 K(o=-0.22,f=-2.1) USER MOD Single : A 109 THR OG1 : rot -150:sc=-0.00315 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc=-0.00571 K(o=-0.0057,f=-1.2) USER MOD Single : A 119 ASN : amide:sc= -0.222 K(o=-0.22,f=-2.1!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot -130:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -4.84 K(o=-4.8,f=-7.7!) USER MOD Single : A 141 MET CE :methyl 174:sc= 0 (180deg=-0.0402) USER MOD Single : A 142 THR OG1 : rot 150:sc= 0.11 USER MOD Single : A 143 TYR OH : rot 180:sc= -0.676 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= -0.121 X(o=-0.12,f=-0.022) USER MOD Single : A 150 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 152 ASN : amide:sc= 0.427 K(o=0.43,f=-6!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.321 X(o=-0.32,f=-0.097) USER MOD Single : A 167 HIS : no HD1:sc= -0.0784 X(o=-0.078,f=0) USER MOD Single : A 168 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 169 HIS : no HD1:sc= 0 X(o=0,f=-0.0085) USER MOD Single : A 170 HIS : no HD1:sc= -0.0519 X(o=-0.052,f=-0.33) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.666 1.161 43.138 1.00 0.00 N ATOM 2 CA MET A 1 -2.477 -0.153 42.469 1.00 0.00 C ATOM 3 C MET A 1 -3.812 -0.855 42.244 1.00 0.00 C ATOM 4 O MET A 1 -4.109 -1.309 41.139 1.00 0.00 O ATOM 5 CB MET A 1 -1.566 -1.018 43.341 1.00 0.00 C ATOM 6 CG MET A 1 -0.085 -0.808 43.069 1.00 0.00 C ATOM 7 SD MET A 1 0.917 -0.901 44.565 1.00 0.00 S ATOM 8 CE MET A 1 1.107 0.837 44.953 1.00 0.00 C ATOM 0 H1 MET A 1 -1.741 1.615 43.278 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.265 1.770 42.544 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.125 1.018 44.060 1.00 0.00 H new ATOM 0 HA MET A 1 -2.021 0.006 41.492 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.769 -0.802 44.390 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.811 -2.068 43.179 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.260 -1.559 42.358 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.060 0.165 42.600 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.706 0.945 45.857 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.605 1.342 44.125 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.126 1.284 45.113 1.00 0.00 H new ATOM 20 N ASN A 2 -4.615 -0.940 43.300 1.00 0.00 N ATOM 21 CA ASN A 2 -5.919 -1.587 43.219 1.00 0.00 C ATOM 22 C ASN A 2 -5.777 -3.049 42.806 1.00 0.00 C ATOM 23 O ASN A 2 -5.491 -3.352 41.648 1.00 0.00 O ATOM 24 CB ASN A 2 -6.817 -0.847 42.224 1.00 0.00 C ATOM 25 CG ASN A 2 -7.838 0.036 42.915 1.00 0.00 C ATOM 26 OD1 ASN A 2 -7.498 1.079 43.473 1.00 0.00 O ATOM 27 ND2 ASN A 2 -9.099 -0.379 42.881 1.00 0.00 N ATOM 0 H ASN A 2 -4.385 -0.569 44.222 1.00 0.00 H new ATOM 0 HA ASN A 2 -6.377 -1.552 44.207 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -6.199 -0.237 41.565 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -7.334 -1.572 41.595 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -9.830 0.174 43.329 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -9.337 -1.250 42.407 1.00 0.00 H new ATOM 34 N ALA A 3 -5.979 -3.951 43.761 1.00 0.00 N ATOM 35 CA ALA A 3 -5.875 -5.380 43.498 1.00 0.00 C ATOM 36 C ALA A 3 -6.863 -5.818 42.420 1.00 0.00 C ATOM 37 O ALA A 3 -6.651 -6.822 41.741 1.00 0.00 O ATOM 38 CB ALA A 3 -6.103 -6.170 44.778 1.00 0.00 C ATOM 0 H ALA A 3 -6.216 -3.716 44.725 1.00 0.00 H new ATOM 0 HA ALA A 3 -4.868 -5.583 43.132 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -6.022 -7.236 44.567 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.353 -5.889 45.517 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.097 -5.952 45.168 1.00 0.00 H new ATOM 44 N ASP A 4 -7.944 -5.058 42.269 1.00 0.00 N ATOM 45 CA ASP A 4 -8.962 -5.369 41.272 1.00 0.00 C ATOM 46 C ASP A 4 -8.495 -4.964 39.880 1.00 0.00 C ATOM 47 O ASP A 4 -8.436 -5.789 38.968 1.00 0.00 O ATOM 48 CB ASP A 4 -10.272 -4.657 41.612 1.00 0.00 C ATOM 49 CG ASP A 4 -11.491 -5.486 41.258 1.00 0.00 C ATOM 50 OD1 ASP A 4 -11.464 -6.711 41.496 1.00 0.00 O ATOM 51 OD2 ASP A 4 -12.472 -4.910 40.742 1.00 0.00 O ATOM 0 H ASP A 4 -8.137 -4.224 42.824 1.00 0.00 H new ATOM 0 HA ASP A 4 -9.131 -6.446 41.281 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -10.290 -4.426 42.677 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -10.315 -3.707 41.079 1.00 0.00 H new ATOM 57 N GLU A 5 -8.159 -3.688 39.724 1.00 0.00 N ATOM 58 CA GLU A 5 -7.690 -3.173 38.445 1.00 0.00 C ATOM 59 C GLU A 5 -6.303 -3.716 38.118 1.00 0.00 C ATOM 60 O GLU A 5 -5.923 -3.813 36.951 1.00 0.00 O ATOM 61 CB GLU A 5 -7.660 -1.643 38.467 1.00 0.00 C ATOM 62 CG GLU A 5 -9.030 -1.010 38.643 1.00 0.00 C ATOM 63 CD GLU A 5 -9.206 0.243 37.808 1.00 0.00 C ATOM 64 OE1 GLU A 5 -8.182 0.834 37.403 1.00 0.00 O ATOM 65 OE2 GLU A 5 -10.365 0.634 37.559 1.00 0.00 O ATOM 0 H GLU A 5 -8.203 -2.992 40.468 1.00 0.00 H new ATOM 0 HA GLU A 5 -8.383 -3.504 37.671 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -7.010 -1.312 39.277 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -7.220 -1.283 37.537 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -9.798 -1.734 38.371 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -9.181 -0.765 39.694 1.00 0.00 H new ATOM 73 N TRP A 6 -5.550 -4.069 39.157 1.00 0.00 N ATOM 74 CA TRP A 6 -4.205 -4.603 38.977 1.00 0.00 C ATOM 75 C TRP A 6 -4.253 -6.010 38.388 1.00 0.00 C ATOM 76 O TRP A 6 -3.438 -6.364 37.536 1.00 0.00 O ATOM 77 CB TRP A 6 -3.458 -4.622 40.312 1.00 0.00 C ATOM 78 CG TRP A 6 -2.036 -5.077 40.190 1.00 0.00 C ATOM 79 CD1 TRP A 6 -1.149 -4.740 39.210 1.00 0.00 C ATOM 80 CD2 TRP A 6 -1.338 -5.955 41.080 1.00 0.00 C ATOM 81 NE1 TRP A 6 0.059 -5.355 39.434 1.00 0.00 N ATOM 82 CE2 TRP A 6 -0.031 -6.106 40.577 1.00 0.00 C ATOM 83 CE3 TRP A 6 -1.689 -6.628 42.254 1.00 0.00 C ATOM 84 CZ2 TRP A 6 0.922 -6.901 41.207 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -0.741 -7.418 42.878 1.00 0.00 C ATOM 86 CH2 TRP A 6 0.551 -7.549 42.354 1.00 0.00 C ATOM 0 H TRP A 6 -5.849 -3.995 40.130 1.00 0.00 H new ATOM 0 HA TRP A 6 -3.674 -3.954 38.281 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -3.476 -3.622 40.745 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -3.984 -5.279 41.005 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -1.365 -4.085 38.379 1.00 0.00 H new ATOM 0 HE1 TRP A 6 0.888 -5.267 38.846 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -2.683 -6.533 42.666 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 1.919 -7.003 40.805 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -1.002 -7.943 43.785 1.00 0.00 H new ATOM 0 HH2 TRP A 6 1.269 -8.174 42.865 1.00 0.00 H new ATOM 97 N MET A 7 -5.211 -6.806 38.849 1.00 0.00 N ATOM 98 CA MET A 7 -5.366 -8.174 38.368 1.00 0.00 C ATOM 99 C MET A 7 -6.046 -8.198 37.003 1.00 0.00 C ATOM 100 O MET A 7 -5.751 -9.051 36.167 1.00 0.00 O ATOM 101 CB MET A 7 -6.176 -9.000 39.369 1.00 0.00 C ATOM 102 CG MET A 7 -5.326 -9.657 40.445 1.00 0.00 C ATOM 103 SD MET A 7 -4.972 -11.389 40.091 1.00 0.00 S ATOM 104 CE MET A 7 -3.233 -11.302 39.674 1.00 0.00 C ATOM 0 H MET A 7 -5.892 -6.528 39.555 1.00 0.00 H new ATOM 0 HA MET A 7 -4.373 -8.611 38.266 1.00 0.00 H new ATOM 0 HB2 MET A 7 -6.915 -8.356 39.845 1.00 0.00 H new ATOM 0 HB3 MET A 7 -6.725 -9.772 38.830 1.00 0.00 H new ATOM 0 HG2 MET A 7 -4.388 -9.112 40.544 1.00 0.00 H new ATOM 0 HG3 MET A 7 -5.840 -9.584 41.403 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.867 -12.299 39.430 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.097 -10.645 38.815 1.00 0.00 H new ATOM 0 HE3 MET A 7 -2.674 -10.908 40.523 1.00 0.00 H new ATOM 114 N THR A 8 -6.956 -7.255 36.785 1.00 0.00 N ATOM 115 CA THR A 8 -7.679 -7.167 35.522 1.00 0.00 C ATOM 116 C THR A 8 -6.716 -6.960 34.357 1.00 0.00 C ATOM 117 O THR A 8 -6.985 -7.387 33.233 1.00 0.00 O ATOM 118 CB THR A 8 -8.693 -6.024 35.569 1.00 0.00 C ATOM 119 OG1 THR A 8 -8.054 -4.798 35.880 1.00 0.00 O ATOM 120 CG2 THR A 8 -9.791 -6.240 36.588 1.00 0.00 C ATOM 0 H THR A 8 -7.210 -6.541 37.467 1.00 0.00 H new ATOM 0 HA THR A 8 -8.209 -8.107 35.370 1.00 0.00 H new ATOM 0 HB THR A 8 -9.141 -5.995 34.576 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.116 -4.967 36.108 1.00 0.00 H new ATOM 0 HG21 THR A 8 -10.476 -5.392 36.570 1.00 0.00 H new ATOM 0 HG22 THR A 8 -10.336 -7.153 36.347 1.00 0.00 H new ATOM 0 HG23 THR A 8 -9.352 -6.331 37.582 1.00 0.00 H new ATOM 128 N THR A 9 -5.595 -6.301 34.630 1.00 0.00 N ATOM 129 CA THR A 9 -4.592 -6.038 33.604 1.00 0.00 C ATOM 130 C THR A 9 -4.084 -7.338 32.991 1.00 0.00 C ATOM 131 O THR A 9 -3.718 -7.381 31.816 1.00 0.00 O ATOM 132 CB THR A 9 -3.423 -5.248 34.196 1.00 0.00 C ATOM 133 OG1 THR A 9 -3.894 -4.179 34.996 1.00 0.00 O ATOM 134 CG2 THR A 9 -2.503 -4.664 33.145 1.00 0.00 C ATOM 0 H THR A 9 -5.358 -5.939 35.554 1.00 0.00 H new ATOM 0 HA THR A 9 -5.061 -5.447 32.817 1.00 0.00 H new ATOM 0 HB THR A 9 -2.860 -5.967 34.790 1.00 0.00 H new ATOM 0 HG1 THR A 9 -4.049 -4.498 35.910 1.00 0.00 H new ATOM 0 HG21 THR A 9 -1.696 -4.117 33.632 1.00 0.00 H new ATOM 0 HG22 THR A 9 -2.083 -5.469 32.541 1.00 0.00 H new ATOM 0 HG23 THR A 9 -3.067 -3.986 32.504 1.00 0.00 H new ATOM 142 N PHE A 10 -4.064 -8.397 33.794 1.00 0.00 N ATOM 143 CA PHE A 10 -3.601 -9.700 33.330 1.00 0.00 C ATOM 144 C PHE A 10 -4.559 -10.281 32.295 1.00 0.00 C ATOM 145 O PHE A 10 -4.141 -10.709 31.219 1.00 0.00 O ATOM 146 CB PHE A 10 -3.461 -10.664 34.509 1.00 0.00 C ATOM 147 CG PHE A 10 -2.141 -10.556 35.219 1.00 0.00 C ATOM 148 CD1 PHE A 10 -1.931 -9.572 36.172 1.00 0.00 C ATOM 149 CD2 PHE A 10 -1.112 -11.439 34.934 1.00 0.00 C ATOM 150 CE1 PHE A 10 -0.719 -9.471 36.827 1.00 0.00 C ATOM 151 CE2 PHE A 10 0.102 -11.343 35.586 1.00 0.00 C ATOM 152 CZ PHE A 10 0.300 -10.357 36.534 1.00 0.00 C ATOM 0 H PHE A 10 -4.363 -8.378 34.769 1.00 0.00 H new ATOM 0 HA PHE A 10 -2.626 -9.565 32.861 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -4.264 -10.473 35.221 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -3.589 -11.685 34.150 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -2.724 -8.876 36.405 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -1.261 -12.211 34.194 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -0.568 -8.700 37.568 1.00 0.00 H new ATOM 0 HE2 PHE A 10 0.896 -12.038 35.355 1.00 0.00 H new ATOM 0 HZ PHE A 10 1.249 -10.279 37.044 1.00 0.00 H new ATOM 162 N ARG A 11 -5.845 -10.291 32.627 1.00 0.00 N ATOM 163 CA ARG A 11 -6.864 -10.820 31.727 1.00 0.00 C ATOM 164 C ARG A 11 -6.993 -9.951 30.480 1.00 0.00 C ATOM 165 O ARG A 11 -7.287 -10.447 29.393 1.00 0.00 O ATOM 166 CB ARG A 11 -8.212 -10.908 32.444 1.00 0.00 C ATOM 167 CG ARG A 11 -8.998 -12.166 32.109 1.00 0.00 C ATOM 168 CD ARG A 11 -9.279 -12.268 30.620 1.00 0.00 C ATOM 169 NE ARG A 11 -8.328 -13.146 29.942 1.00 0.00 N ATOM 170 CZ ARG A 11 -8.540 -13.687 28.745 1.00 0.00 C ATOM 171 NH1 ARG A 11 -9.668 -13.441 28.089 1.00 0.00 N ATOM 172 NH2 ARG A 11 -7.623 -14.474 28.201 1.00 0.00 N ATOM 0 H ARG A 11 -6.207 -9.939 33.513 1.00 0.00 H new ATOM 0 HA ARG A 11 -6.558 -11.820 31.420 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -8.045 -10.870 33.520 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -8.811 -10.035 32.183 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -8.439 -13.043 32.436 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -9.939 -12.165 32.659 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -10.291 -12.643 30.467 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -9.236 -11.274 30.174 1.00 0.00 H new ATOM 0 HE ARG A 11 -7.449 -13.357 30.415 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -10.377 -12.835 28.502 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -9.826 -13.858 27.172 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -6.754 -14.665 28.700 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -7.786 -14.888 27.283 1.00 0.00 H new ATOM 186 N GLU A 12 -6.771 -8.650 30.645 1.00 0.00 N ATOM 187 CA GLU A 12 -6.863 -7.712 29.533 1.00 0.00 C ATOM 188 C GLU A 12 -5.686 -7.881 28.578 1.00 0.00 C ATOM 189 O GLU A 12 -5.821 -7.680 27.370 1.00 0.00 O ATOM 190 CB GLU A 12 -6.910 -6.274 30.054 1.00 0.00 C ATOM 191 CG GLU A 12 -7.814 -5.362 29.241 1.00 0.00 C ATOM 192 CD GLU A 12 -7.943 -3.978 29.848 1.00 0.00 C ATOM 193 OE1 GLU A 12 -6.906 -3.302 30.009 1.00 0.00 O ATOM 194 OE2 GLU A 12 -9.081 -3.572 30.161 1.00 0.00 O ATOM 0 H GLU A 12 -6.526 -8.223 31.538 1.00 0.00 H new ATOM 0 HA GLU A 12 -7.782 -7.924 28.987 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -7.252 -6.282 31.089 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -5.900 -5.864 30.055 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -7.421 -5.275 28.228 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -8.803 -5.814 29.161 1.00 0.00 H new ATOM 202 N ASN A 13 -4.534 -8.249 29.126 1.00 0.00 N ATOM 203 CA ASN A 13 -3.333 -8.443 28.321 1.00 0.00 C ATOM 204 C ASN A 13 -3.441 -9.712 27.480 1.00 0.00 C ATOM 205 O ASN A 13 -3.026 -9.736 26.321 1.00 0.00 O ATOM 206 CB ASN A 13 -2.097 -8.516 29.221 1.00 0.00 C ATOM 207 CG ASN A 13 -1.372 -7.188 29.314 1.00 0.00 C ATOM 208 OD1 ASN A 13 -1.276 -6.450 28.334 1.00 0.00 O ATOM 209 ND2 ASN A 13 -0.856 -6.878 30.498 1.00 0.00 N ATOM 0 H ASN A 13 -4.406 -8.419 30.123 1.00 0.00 H new ATOM 0 HA ASN A 13 -3.234 -7.591 27.649 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.396 -8.835 30.220 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.414 -9.274 28.836 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -0.356 -5.998 30.622 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.960 -7.520 31.284 1.00 0.00 H new ATOM 216 N ILE A 14 -4.000 -10.763 28.071 1.00 0.00 N ATOM 217 CA ILE A 14 -4.161 -12.033 27.374 1.00 0.00 C ATOM 218 C ILE A 14 -5.287 -11.957 26.347 1.00 0.00 C ATOM 219 O ILE A 14 -5.169 -12.485 25.242 1.00 0.00 O ATOM 220 CB ILE A 14 -4.456 -13.181 28.359 1.00 0.00 C ATOM 221 CG1 ILE A 14 -3.437 -13.179 29.500 1.00 0.00 C ATOM 222 CG2 ILE A 14 -4.442 -14.518 27.633 1.00 0.00 C ATOM 223 CD1 ILE A 14 -3.916 -13.906 30.738 1.00 0.00 C ATOM 0 H ILE A 14 -4.349 -10.760 29.030 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.220 -12.236 26.863 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.449 -13.029 28.783 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -2.513 -13.640 29.152 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -3.199 -12.148 29.763 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.652 -15.319 28.342 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.202 -14.516 26.852 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -3.462 -14.678 27.184 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -3.144 -13.865 31.506 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -4.824 -13.431 31.110 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -4.126 -14.946 30.490 1.00 0.00 H new ATOM 235 N ALA A 15 -6.379 -11.298 26.722 1.00 0.00 N ATOM 236 CA ALA A 15 -7.526 -11.154 25.833 1.00 0.00 C ATOM 237 C ALA A 15 -7.189 -10.263 24.642 1.00 0.00 C ATOM 238 O ALA A 15 -7.726 -10.442 23.549 1.00 0.00 O ATOM 239 CB ALA A 15 -8.716 -10.591 26.596 1.00 0.00 C ATOM 0 H ALA A 15 -6.493 -10.856 27.634 1.00 0.00 H new ATOM 0 HA ALA A 15 -7.786 -12.142 25.452 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.566 -10.488 25.921 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.979 -11.267 27.410 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.457 -9.614 27.004 1.00 0.00 H new ATOM 245 N GLN A 16 -6.296 -9.304 24.860 1.00 0.00 N ATOM 246 CA GLN A 16 -5.887 -8.386 23.804 1.00 0.00 C ATOM 247 C GLN A 16 -4.986 -9.086 22.792 1.00 0.00 C ATOM 248 O GLN A 16 -5.223 -9.020 21.586 1.00 0.00 O ATOM 249 CB GLN A 16 -5.161 -7.179 24.401 1.00 0.00 C ATOM 250 CG GLN A 16 -6.089 -6.034 24.775 1.00 0.00 C ATOM 251 CD GLN A 16 -6.112 -4.938 23.727 1.00 0.00 C ATOM 252 OE1 GLN A 16 -7.175 -4.545 23.246 1.00 0.00 O ATOM 253 NE2 GLN A 16 -4.935 -4.437 23.370 1.00 0.00 N ATOM 0 H GLN A 16 -5.842 -9.142 25.759 1.00 0.00 H new ATOM 0 HA GLN A 16 -6.784 -8.043 23.288 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -4.614 -7.497 25.289 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -4.423 -6.818 23.684 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -7.099 -6.420 24.914 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -5.774 -5.613 25.730 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -4.079 -4.793 23.795 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.887 -3.696 22.671 1.00 0.00 H new ATOM 262 N THR A 17 -3.952 -9.756 23.292 1.00 0.00 N ATOM 263 CA THR A 17 -3.016 -10.469 22.431 1.00 0.00 C ATOM 264 C THR A 17 -3.732 -11.552 21.629 1.00 0.00 C ATOM 265 O THR A 17 -3.388 -11.813 20.477 1.00 0.00 O ATOM 266 CB THR A 17 -1.897 -11.092 23.265 1.00 0.00 C ATOM 267 OG1 THR A 17 -1.576 -10.267 24.372 1.00 0.00 O ATOM 268 CG2 THR A 17 -0.622 -11.322 22.481 1.00 0.00 C ATOM 0 H THR A 17 -3.742 -9.820 24.288 1.00 0.00 H new ATOM 0 HA THR A 17 -2.583 -9.752 21.734 1.00 0.00 H new ATOM 0 HB THR A 17 -2.284 -12.057 23.590 1.00 0.00 H new ATOM 0 HG1 THR A 17 -2.106 -10.541 25.149 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.131 -11.766 23.132 1.00 0.00 H new ATOM 0 HG22 THR A 17 -0.824 -11.995 21.648 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.254 -10.370 22.098 1.00 0.00 H new ATOM 276 N TRP A 18 -4.729 -12.178 22.247 1.00 0.00 N ATOM 277 CA TRP A 18 -5.492 -13.231 21.590 1.00 0.00 C ATOM 278 C TRP A 18 -6.356 -12.659 20.471 1.00 0.00 C ATOM 279 O TRP A 18 -6.288 -13.112 19.328 1.00 0.00 O ATOM 280 CB TRP A 18 -6.369 -13.964 22.609 1.00 0.00 C ATOM 281 CG TRP A 18 -5.988 -15.401 22.794 1.00 0.00 C ATOM 282 CD1 TRP A 18 -5.947 -16.094 23.970 1.00 0.00 C ATOM 283 CD2 TRP A 18 -5.591 -16.322 21.772 1.00 0.00 C ATOM 284 NE1 TRP A 18 -5.550 -17.389 23.742 1.00 0.00 N ATOM 285 CE2 TRP A 18 -5.325 -17.554 22.400 1.00 0.00 C ATOM 286 CE3 TRP A 18 -5.435 -16.225 20.386 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -4.913 -18.679 21.690 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -5.026 -17.342 19.682 1.00 0.00 C ATOM 289 CH2 TRP A 18 -4.769 -18.555 20.335 1.00 0.00 C ATOM 0 H TRP A 18 -5.026 -11.974 23.201 1.00 0.00 H new ATOM 0 HA TRP A 18 -4.788 -13.939 21.152 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -6.304 -13.452 23.569 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.409 -13.910 22.288 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -6.191 -15.683 24.939 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.440 -18.110 24.455 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -5.631 -15.294 19.875 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -4.714 -19.615 22.191 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -4.902 -17.279 18.611 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -4.451 -19.410 19.757 1.00 0.00 H new ATOM 300 N GLN A 19 -7.167 -11.661 20.806 1.00 0.00 N ATOM 301 CA GLN A 19 -8.042 -11.025 19.828 1.00 0.00 C ATOM 302 C GLN A 19 -7.231 -10.412 18.691 1.00 0.00 C ATOM 303 O GLN A 19 -7.656 -10.425 17.535 1.00 0.00 O ATOM 304 CB GLN A 19 -8.897 -9.950 20.501 1.00 0.00 C ATOM 305 CG GLN A 19 -10.261 -10.449 20.951 1.00 0.00 C ATOM 306 CD GLN A 19 -10.656 -9.913 22.313 1.00 0.00 C ATOM 307 OE1 GLN A 19 -10.210 -10.415 23.344 1.00 0.00 O ATOM 308 NE2 GLN A 19 -11.500 -8.888 22.323 1.00 0.00 N ATOM 0 H GLN A 19 -7.236 -11.275 21.748 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.697 -11.790 19.410 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.360 -9.559 21.365 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.034 -9.120 19.808 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -11.012 -10.156 20.217 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -10.254 -11.539 20.981 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -11.845 -8.503 21.444 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -11.803 -8.486 23.210 1.00 0.00 H new ATOM 317 N GLN A 20 -6.062 -9.878 19.027 1.00 0.00 N ATOM 318 CA GLN A 20 -5.191 -9.261 18.034 1.00 0.00 C ATOM 319 C GLN A 20 -4.708 -10.293 17.017 1.00 0.00 C ATOM 320 O GLN A 20 -4.552 -11.470 17.342 1.00 0.00 O ATOM 321 CB GLN A 20 -3.990 -8.602 18.717 1.00 0.00 C ATOM 322 CG GLN A 20 -4.214 -7.138 19.060 1.00 0.00 C ATOM 323 CD GLN A 20 -2.921 -6.411 19.376 1.00 0.00 C ATOM 324 OE1 GLN A 20 -2.109 -6.882 20.173 1.00 0.00 O ATOM 325 NE2 GLN A 20 -2.724 -5.255 18.753 1.00 0.00 N ATOM 0 H GLN A 20 -5.696 -9.860 19.979 1.00 0.00 H new ATOM 0 HA GLN A 20 -5.765 -8.499 17.508 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -3.757 -9.149 19.630 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -3.121 -8.685 18.065 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -4.710 -6.644 18.224 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -4.885 -7.067 19.916 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -3.424 -4.902 18.100 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -1.873 -4.720 18.927 1.00 0.00 H new ATOM 334 N PRO A 21 -4.465 -9.864 15.766 1.00 0.00 N ATOM 335 CA PRO A 21 -3.998 -10.758 14.702 1.00 0.00 C ATOM 336 C PRO A 21 -2.766 -11.556 15.116 1.00 0.00 C ATOM 337 O PRO A 21 -2.265 -11.409 16.231 1.00 0.00 O ATOM 338 CB PRO A 21 -3.654 -9.801 13.557 1.00 0.00 C ATOM 339 CG PRO A 21 -4.501 -8.601 13.800 1.00 0.00 C ATOM 340 CD PRO A 21 -4.624 -8.475 15.293 1.00 0.00 C ATOM 0 HA PRO A 21 -4.747 -11.505 14.440 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -2.594 -9.545 13.560 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.871 -10.249 12.587 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -4.046 -7.709 13.369 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -5.481 -8.715 13.336 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -3.857 -7.819 15.706 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.589 -8.059 15.583 1.00 0.00 H new ATOM 348 N GLU A 22 -2.282 -12.400 14.211 1.00 0.00 N ATOM 349 CA GLU A 22 -1.108 -13.221 14.483 1.00 0.00 C ATOM 350 C GLU A 22 0.122 -12.663 13.775 1.00 0.00 C ATOM 351 O GLU A 22 1.244 -12.784 14.268 1.00 0.00 O ATOM 352 CB GLU A 22 -1.356 -14.664 14.040 1.00 0.00 C ATOM 353 CG GLU A 22 -0.755 -15.700 14.976 1.00 0.00 C ATOM 354 CD GLU A 22 -1.636 -15.980 16.178 1.00 0.00 C ATOM 355 OE1 GLU A 22 -1.606 -15.180 17.136 1.00 0.00 O ATOM 356 OE2 GLU A 22 -2.357 -17.001 16.161 1.00 0.00 O ATOM 0 H GLU A 22 -2.684 -12.533 13.283 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.924 -13.205 15.557 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -2.430 -14.833 13.966 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.942 -14.805 13.042 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.589 -16.627 14.428 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.220 -15.353 15.318 1.00 0.00 H new ATOM 364 N HIS A 23 -0.096 -12.050 12.616 1.00 0.00 N ATOM 365 CA HIS A 23 0.995 -11.473 11.840 1.00 0.00 C ATOM 366 C HIS A 23 1.100 -9.970 12.084 1.00 0.00 C ATOM 367 O HIS A 23 0.103 -9.306 12.364 1.00 0.00 O ATOM 368 CB HIS A 23 0.789 -11.744 10.349 1.00 0.00 C ATOM 369 CG HIS A 23 0.849 -13.197 9.992 1.00 0.00 C ATOM 370 ND1 HIS A 23 -0.195 -13.869 9.391 1.00 0.00 N ATOM 371 CD2 HIS A 23 1.837 -14.109 10.153 1.00 0.00 C ATOM 372 CE1 HIS A 23 0.148 -15.131 9.200 1.00 0.00 C ATOM 373 NE2 HIS A 23 1.376 -15.302 9.652 1.00 0.00 N ATOM 0 H HIS A 23 -1.018 -11.940 12.194 1.00 0.00 H new ATOM 0 HA HIS A 23 1.924 -11.943 12.163 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.178 -11.343 10.045 1.00 0.00 H new ATOM 0 HB3 HIS A 23 1.549 -11.207 9.782 1.00 0.00 H new ATOM 0 HD2 HIS A 23 2.807 -13.931 10.593 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -0.471 -15.893 8.750 1.00 0.00 H new ATOM 0 HE2 HIS A 23 1.898 -16.178 9.632 1.00 0.00 H new ATOM 382 N TYR A 24 2.315 -9.442 11.978 1.00 0.00 N ATOM 383 CA TYR A 24 2.551 -8.018 12.188 1.00 0.00 C ATOM 384 C TYR A 24 3.334 -7.419 11.025 1.00 0.00 C ATOM 385 O TYR A 24 4.286 -8.023 10.528 1.00 0.00 O ATOM 386 CB TYR A 24 3.307 -7.793 13.498 1.00 0.00 C ATOM 387 CG TYR A 24 2.402 -7.565 14.689 1.00 0.00 C ATOM 388 CD1 TYR A 24 1.723 -6.364 14.849 1.00 0.00 C ATOM 389 CD2 TYR A 24 2.228 -8.552 15.651 1.00 0.00 C ATOM 390 CE1 TYR A 24 0.895 -6.152 15.936 1.00 0.00 C ATOM 391 CE2 TYR A 24 1.402 -8.347 16.740 1.00 0.00 C ATOM 392 CZ TYR A 24 0.739 -7.147 16.878 1.00 0.00 C ATOM 393 OH TYR A 24 -0.084 -6.939 17.962 1.00 0.00 O ATOM 0 H TYR A 24 3.151 -9.979 11.748 1.00 0.00 H new ATOM 0 HA TYR A 24 1.584 -7.519 12.245 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.941 -8.657 13.695 1.00 0.00 H new ATOM 0 HB3 TYR A 24 3.967 -6.933 13.384 1.00 0.00 H new ATOM 0 HD1 TYR A 24 1.844 -5.583 14.113 1.00 0.00 H new ATOM 0 HD2 TYR A 24 2.746 -9.494 15.546 1.00 0.00 H new ATOM 0 HE1 TYR A 24 0.374 -5.213 16.047 1.00 0.00 H new ATOM 0 HE2 TYR A 24 1.277 -9.124 17.480 1.00 0.00 H new ATOM 0 HH TYR A 24 -0.085 -7.738 18.530 1.00 0.00 H new ATOM 403 N ASP A 25 2.929 -6.228 10.596 1.00 0.00 N ATOM 404 CA ASP A 25 3.594 -5.547 9.491 1.00 0.00 C ATOM 405 C ASP A 25 4.139 -4.193 9.937 1.00 0.00 C ATOM 406 O ASP A 25 3.775 -3.684 10.996 1.00 0.00 O ATOM 407 CB ASP A 25 2.624 -5.359 8.323 1.00 0.00 C ATOM 408 CG ASP A 25 2.435 -6.630 7.519 1.00 0.00 C ATOM 409 OD1 ASP A 25 3.377 -7.022 6.798 1.00 0.00 O ATOM 410 OD2 ASP A 25 1.346 -7.234 7.610 1.00 0.00 O ATOM 0 H ASP A 25 2.144 -5.715 10.997 1.00 0.00 H new ATOM 0 HA ASP A 25 4.430 -6.166 9.164 1.00 0.00 H new ATOM 0 HB2 ASP A 25 1.659 -5.027 8.706 1.00 0.00 H new ATOM 0 HB3 ASP A 25 2.996 -4.570 7.669 1.00 0.00 H new ATOM 416 N LEU A 26 5.013 -3.615 9.120 1.00 0.00 N ATOM 417 CA LEU A 26 5.608 -2.320 9.429 1.00 0.00 C ATOM 418 C LEU A 26 5.705 -1.453 8.177 1.00 0.00 C ATOM 419 O LEU A 26 6.162 -1.910 7.129 1.00 0.00 O ATOM 420 CB LEU A 26 6.996 -2.506 10.044 1.00 0.00 C ATOM 421 CG LEU A 26 7.440 -1.390 10.991 1.00 0.00 C ATOM 422 CD1 LEU A 26 6.499 -1.295 12.181 1.00 0.00 C ATOM 423 CD2 LEU A 26 8.870 -1.624 11.456 1.00 0.00 C ATOM 0 H LEU A 26 5.325 -4.023 8.239 1.00 0.00 H new ATOM 0 HA LEU A 26 4.964 -1.815 10.149 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.012 -3.451 10.588 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.725 -2.589 9.238 1.00 0.00 H new ATOM 0 HG LEU A 26 7.405 -0.444 10.450 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.830 -0.496 12.844 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.489 -1.080 11.830 1.00 0.00 H new ATOM 0 HD13 LEU A 26 6.501 -2.241 12.723 1.00 0.00 H new ATOM 0 HD21 LEU A 26 9.170 -0.821 12.129 1.00 0.00 H new ATOM 0 HD22 LEU A 26 8.931 -2.578 11.980 1.00 0.00 H new ATOM 0 HD23 LEU A 26 9.535 -1.641 10.593 1.00 0.00 H new ATOM 435 N TYR A 27 5.273 -0.203 8.295 1.00 0.00 N ATOM 436 CA TYR A 27 5.312 0.728 7.172 1.00 0.00 C ATOM 437 C TYR A 27 6.317 1.847 7.427 1.00 0.00 C ATOM 438 O TYR A 27 6.126 2.674 8.319 1.00 0.00 O ATOM 439 CB TYR A 27 3.923 1.319 6.925 1.00 0.00 C ATOM 440 CG TYR A 27 3.575 1.457 5.460 1.00 0.00 C ATOM 441 CD1 TYR A 27 2.999 0.404 4.761 1.00 0.00 C ATOM 442 CD2 TYR A 27 3.823 2.641 4.776 1.00 0.00 C ATOM 443 CE1 TYR A 27 2.680 0.527 3.422 1.00 0.00 C ATOM 444 CE2 TYR A 27 3.506 2.772 3.437 1.00 0.00 C ATOM 445 CZ TYR A 27 2.935 1.712 2.765 1.00 0.00 C ATOM 446 OH TYR A 27 2.618 1.838 1.433 1.00 0.00 O ATOM 0 H TYR A 27 4.892 0.190 9.156 1.00 0.00 H new ATOM 0 HA TYR A 27 5.627 0.177 6.286 1.00 0.00 H new ATOM 0 HB2 TYR A 27 3.178 0.688 7.409 1.00 0.00 H new ATOM 0 HB3 TYR A 27 3.865 2.300 7.397 1.00 0.00 H new ATOM 0 HD1 TYR A 27 2.797 -0.526 5.272 1.00 0.00 H new ATOM 0 HD2 TYR A 27 4.271 3.473 5.299 1.00 0.00 H new ATOM 0 HE1 TYR A 27 2.233 -0.301 2.893 1.00 0.00 H new ATOM 0 HE2 TYR A 27 3.704 3.699 2.920 1.00 0.00 H new ATOM 0 HH TYR A 27 3.356 2.277 0.961 1.00 0.00 H new ATOM 456 N ILE A 28 7.386 1.866 6.639 1.00 0.00 N ATOM 457 CA ILE A 28 8.421 2.884 6.780 1.00 0.00 C ATOM 458 C ILE A 28 8.681 3.589 5.450 1.00 0.00 C ATOM 459 O ILE A 28 8.774 2.943 4.406 1.00 0.00 O ATOM 460 CB ILE A 28 9.742 2.273 7.292 1.00 0.00 C ATOM 461 CG1 ILE A 28 9.491 1.427 8.543 1.00 0.00 C ATOM 462 CG2 ILE A 28 10.756 3.370 7.583 1.00 0.00 C ATOM 463 CD1 ILE A 28 10.257 0.123 8.552 1.00 0.00 C ATOM 0 H ILE A 28 7.559 1.189 5.896 1.00 0.00 H new ATOM 0 HA ILE A 28 8.058 3.609 7.508 1.00 0.00 H new ATOM 0 HB ILE A 28 10.148 1.625 6.515 1.00 0.00 H new ATOM 0 HG12 ILE A 28 9.765 2.006 9.425 1.00 0.00 H new ATOM 0 HG13 ILE A 28 8.425 1.214 8.620 1.00 0.00 H new ATOM 0 HG21 ILE A 28 11.682 2.923 7.943 1.00 0.00 H new ATOM 0 HG22 ILE A 28 10.955 3.933 6.671 1.00 0.00 H new ATOM 0 HG23 ILE A 28 10.357 4.041 8.344 1.00 0.00 H new ATOM 0 HD11 ILE A 28 10.032 -0.425 9.467 1.00 0.00 H new ATOM 0 HD12 ILE A 28 9.966 -0.476 7.689 1.00 0.00 H new ATOM 0 HD13 ILE A 28 11.326 0.329 8.506 1.00 0.00 H new ATOM 475 N PRO A 29 8.803 4.929 5.467 1.00 0.00 N ATOM 476 CA PRO A 29 9.053 5.712 4.252 1.00 0.00 C ATOM 477 C PRO A 29 10.461 5.499 3.707 1.00 0.00 C ATOM 478 O PRO A 29 11.417 5.357 4.469 1.00 0.00 O ATOM 479 CB PRO A 29 8.872 7.159 4.716 1.00 0.00 C ATOM 480 CG PRO A 29 9.172 7.128 6.174 1.00 0.00 C ATOM 481 CD PRO A 29 8.707 5.784 6.665 1.00 0.00 C ATOM 0 HA PRO A 29 8.386 5.426 3.439 1.00 0.00 H new ATOM 0 HB2 PRO A 29 9.547 7.832 4.187 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.858 7.511 4.528 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.238 7.262 6.356 1.00 0.00 H new ATOM 0 HG3 PRO A 29 8.656 7.934 6.696 1.00 0.00 H new ATOM 0 HD2 PRO A 29 9.335 5.413 7.475 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.687 5.827 7.047 1.00 0.00 H new ATOM 489 N ALA A 30 10.582 5.480 2.384 1.00 0.00 N ATOM 490 CA ALA A 30 11.874 5.285 1.737 1.00 0.00 C ATOM 491 C ALA A 30 12.553 6.621 1.454 1.00 0.00 C ATOM 492 O ALA A 30 13.615 6.917 2.000 1.00 0.00 O ATOM 493 CB ALA A 30 11.704 4.493 0.450 1.00 0.00 C ATOM 0 H ALA A 30 9.801 5.597 1.739 1.00 0.00 H new ATOM 0 HA ALA A 30 12.512 4.720 2.416 1.00 0.00 H new ATOM 0 HB1 ALA A 30 12.676 4.354 -0.023 1.00 0.00 H new ATOM 0 HB2 ALA A 30 11.269 3.520 0.677 1.00 0.00 H new ATOM 0 HB3 ALA A 30 11.045 5.036 -0.227 1.00 0.00 H new ATOM 499 N ILE A 31 11.932 7.424 0.596 1.00 0.00 N ATOM 500 CA ILE A 31 12.476 8.729 0.241 1.00 0.00 C ATOM 501 C ILE A 31 11.404 9.811 0.315 1.00 0.00 C ATOM 502 O ILE A 31 10.226 9.549 0.073 1.00 0.00 O ATOM 503 CB ILE A 31 13.081 8.718 -1.176 1.00 0.00 C ATOM 504 CG1 ILE A 31 12.059 8.193 -2.187 1.00 0.00 C ATOM 505 CG2 ILE A 31 14.346 7.874 -1.206 1.00 0.00 C ATOM 506 CD1 ILE A 31 12.265 8.729 -3.587 1.00 0.00 C ATOM 0 H ILE A 31 11.052 7.194 0.134 1.00 0.00 H new ATOM 0 HA ILE A 31 13.262 8.951 0.963 1.00 0.00 H new ATOM 0 HB ILE A 31 13.343 9.740 -1.451 1.00 0.00 H new ATOM 0 HG12 ILE A 31 12.111 7.105 -2.212 1.00 0.00 H new ATOM 0 HG13 ILE A 31 11.057 8.457 -1.849 1.00 0.00 H new ATOM 0 HG21 ILE A 31 14.761 7.876 -2.214 1.00 0.00 H new ATOM 0 HG22 ILE A 31 15.077 8.289 -0.512 1.00 0.00 H new ATOM 0 HG23 ILE A 31 14.108 6.851 -0.914 1.00 0.00 H new ATOM 0 HD11 ILE A 31 11.506 8.315 -4.250 1.00 0.00 H new ATOM 0 HD12 ILE A 31 12.184 9.816 -3.576 1.00 0.00 H new ATOM 0 HD13 ILE A 31 13.254 8.442 -3.944 1.00 0.00 H new ATOM 518 N THR A 32 11.821 11.027 0.650 1.00 0.00 N ATOM 519 CA THR A 32 10.896 12.151 0.754 1.00 0.00 C ATOM 520 C THR A 32 11.282 13.264 -0.213 1.00 0.00 C ATOM 521 O THR A 32 10.555 13.554 -1.163 1.00 0.00 O ATOM 522 CB THR A 32 10.875 12.689 2.186 1.00 0.00 C ATOM 523 OG1 THR A 32 10.685 11.636 3.114 1.00 0.00 O ATOM 524 CG2 THR A 32 9.786 13.712 2.425 1.00 0.00 C ATOM 0 H THR A 32 12.793 11.260 0.854 1.00 0.00 H new ATOM 0 HA THR A 32 9.900 11.795 0.491 1.00 0.00 H new ATOM 0 HB THR A 32 11.842 13.171 2.327 1.00 0.00 H new ATOM 0 HG1 THR A 32 10.676 12.000 4.024 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.827 14.052 3.460 1.00 0.00 H new ATOM 0 HG22 THR A 32 9.932 14.561 1.758 1.00 0.00 H new ATOM 0 HG23 THR A 32 8.813 13.260 2.230 1.00 0.00 H new ATOM 532 N TRP A 33 12.430 13.886 0.034 1.00 0.00 N ATOM 533 CA TRP A 33 12.913 14.967 -0.815 1.00 0.00 C ATOM 534 C TRP A 33 13.687 14.417 -2.009 1.00 0.00 C ATOM 535 O TRP A 33 13.779 13.204 -2.197 1.00 0.00 O ATOM 536 CB TRP A 33 13.800 15.919 -0.011 1.00 0.00 C ATOM 537 CG TRP A 33 13.056 17.089 0.556 1.00 0.00 C ATOM 538 CD1 TRP A 33 12.649 17.254 1.849 1.00 0.00 C ATOM 539 CD2 TRP A 33 12.628 18.258 -0.152 1.00 0.00 C ATOM 540 NE1 TRP A 33 11.995 18.453 1.988 1.00 0.00 N ATOM 541 CE2 TRP A 33 11.968 19.088 0.774 1.00 0.00 C ATOM 542 CE3 TRP A 33 12.738 18.683 -1.479 1.00 0.00 C ATOM 543 CZ2 TRP A 33 11.423 20.318 0.415 1.00 0.00 C ATOM 544 CZ3 TRP A 33 12.196 19.904 -1.834 1.00 0.00 C ATOM 545 CH2 TRP A 33 11.545 20.710 -0.890 1.00 0.00 C ATOM 0 H TRP A 33 13.043 13.659 0.817 1.00 0.00 H new ATOM 0 HA TRP A 33 12.048 15.516 -1.188 1.00 0.00 H new ATOM 0 HB2 TRP A 33 14.269 15.367 0.803 1.00 0.00 H new ATOM 0 HB3 TRP A 33 14.603 16.284 -0.652 1.00 0.00 H new ATOM 0 HD1 TRP A 33 12.817 16.545 2.646 1.00 0.00 H new ATOM 0 HE1 TRP A 33 11.594 18.813 2.854 1.00 0.00 H new ATOM 0 HE3 TRP A 33 13.237 18.069 -2.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 10.922 20.941 1.141 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 12.276 20.243 -2.856 1.00 0.00 H new ATOM 0 HH2 TRP A 33 11.132 21.659 -1.199 1.00 0.00 H new ATOM 556 N HIS A 34 14.244 15.317 -2.813 1.00 0.00 N ATOM 557 CA HIS A 34 15.011 14.921 -3.989 1.00 0.00 C ATOM 558 C HIS A 34 16.267 14.154 -3.587 1.00 0.00 C ATOM 559 O HIS A 34 17.330 14.744 -3.389 1.00 0.00 O ATOM 560 CB HIS A 34 15.393 16.153 -4.812 1.00 0.00 C ATOM 561 CG HIS A 34 14.229 16.798 -5.497 1.00 0.00 C ATOM 562 ND1 HIS A 34 13.558 16.216 -6.552 1.00 0.00 N ATOM 563 CD2 HIS A 34 13.614 17.984 -5.271 1.00 0.00 C ATOM 564 CE1 HIS A 34 12.583 17.016 -6.946 1.00 0.00 C ATOM 565 NE2 HIS A 34 12.595 18.094 -6.185 1.00 0.00 N ATOM 0 H HIS A 34 14.179 16.325 -2.672 1.00 0.00 H new ATOM 0 HA HIS A 34 14.386 14.266 -4.596 1.00 0.00 H new ATOM 0 HB2 HIS A 34 15.870 16.883 -4.158 1.00 0.00 H new ATOM 0 HB3 HIS A 34 16.131 15.865 -5.561 1.00 0.00 H new ATOM 0 HD2 HIS A 34 13.876 18.708 -4.513 1.00 0.00 H new ATOM 0 HE1 HIS A 34 11.893 16.821 -7.754 1.00 0.00 H new ATOM 0 HE2 HIS A 34 11.952 18.882 -6.263 1.00 0.00 H new ATOM 574 N ALA A 35 16.137 12.837 -3.466 1.00 0.00 N ATOM 575 CA ALA A 35 17.260 11.990 -3.089 1.00 0.00 C ATOM 576 C ALA A 35 16.900 10.513 -3.211 1.00 0.00 C ATOM 577 O ALA A 35 15.728 10.159 -3.335 1.00 0.00 O ATOM 578 CB ALA A 35 17.709 12.310 -1.671 1.00 0.00 C ATOM 0 H ALA A 35 15.264 12.334 -3.624 1.00 0.00 H new ATOM 0 HA ALA A 35 18.083 12.194 -3.774 1.00 0.00 H new ATOM 0 HB1 ALA A 35 18.549 11.670 -1.402 1.00 0.00 H new ATOM 0 HB2 ALA A 35 18.016 13.354 -1.613 1.00 0.00 H new ATOM 0 HB3 ALA A 35 16.884 12.136 -0.980 1.00 0.00 H new ATOM 584 N ARG A 36 17.915 9.656 -3.175 1.00 0.00 N ATOM 585 CA ARG A 36 17.704 8.217 -3.281 1.00 0.00 C ATOM 586 C ARG A 36 18.925 7.450 -2.782 1.00 0.00 C ATOM 587 O ARG A 36 20.037 7.647 -3.273 1.00 0.00 O ATOM 588 CB ARG A 36 17.401 7.831 -4.731 1.00 0.00 C ATOM 589 CG ARG A 36 16.329 6.761 -4.864 1.00 0.00 C ATOM 590 CD ARG A 36 16.092 6.388 -6.319 1.00 0.00 C ATOM 591 NE ARG A 36 14.672 6.223 -6.617 1.00 0.00 N ATOM 592 CZ ARG A 36 13.907 5.272 -6.085 1.00 0.00 C ATOM 593 NH1 ARG A 36 14.421 4.400 -5.228 1.00 0.00 N ATOM 594 NH2 ARG A 36 12.624 5.194 -6.411 1.00 0.00 N ATOM 0 H ARG A 36 18.891 9.933 -3.073 1.00 0.00 H new ATOM 0 HA ARG A 36 16.851 7.952 -2.656 1.00 0.00 H new ATOM 0 HB2 ARG A 36 17.085 8.720 -5.277 1.00 0.00 H new ATOM 0 HB3 ARG A 36 18.317 7.476 -5.203 1.00 0.00 H new ATOM 0 HG2 ARG A 36 16.627 5.875 -4.304 1.00 0.00 H new ATOM 0 HG3 ARG A 36 15.399 7.119 -4.423 1.00 0.00 H new ATOM 0 HD2 ARG A 36 16.510 7.161 -6.964 1.00 0.00 H new ATOM 0 HD3 ARG A 36 16.620 5.462 -6.547 1.00 0.00 H new ATOM 0 HE ARG A 36 14.240 6.875 -7.272 1.00 0.00 H new ATOM 0 HH11 ARG A 36 15.407 4.456 -4.973 1.00 0.00 H new ATOM 0 HH12 ARG A 36 13.830 3.674 -4.824 1.00 0.00 H new ATOM 0 HH21 ARG A 36 12.223 5.862 -7.069 1.00 0.00 H new ATOM 0 HH22 ARG A 36 12.038 4.466 -6.004 1.00 0.00 H new ATOM 608 N PHE A 37 18.709 6.577 -1.805 1.00 0.00 N ATOM 609 CA PHE A 37 19.792 5.780 -1.239 1.00 0.00 C ATOM 610 C PHE A 37 20.863 6.675 -0.626 1.00 0.00 C ATOM 611 O PHE A 37 21.881 6.963 -1.256 1.00 0.00 O ATOM 612 CB PHE A 37 20.413 4.887 -2.316 1.00 0.00 C ATOM 613 CG PHE A 37 19.447 3.898 -2.905 1.00 0.00 C ATOM 614 CD1 PHE A 37 19.169 2.709 -2.252 1.00 0.00 C ATOM 615 CD2 PHE A 37 18.819 4.158 -4.112 1.00 0.00 C ATOM 616 CE1 PHE A 37 18.282 1.796 -2.792 1.00 0.00 C ATOM 617 CE2 PHE A 37 17.931 3.251 -4.657 1.00 0.00 C ATOM 618 CZ PHE A 37 17.663 2.068 -3.996 1.00 0.00 C ATOM 0 H PHE A 37 17.795 6.403 -1.388 1.00 0.00 H new ATOM 0 HA PHE A 37 19.374 5.152 -0.452 1.00 0.00 H new ATOM 0 HB2 PHE A 37 20.809 5.515 -3.114 1.00 0.00 H new ATOM 0 HB3 PHE A 37 21.257 4.347 -1.887 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.651 2.492 -1.310 1.00 0.00 H new ATOM 0 HD2 PHE A 37 19.026 5.081 -4.633 1.00 0.00 H new ATOM 0 HE1 PHE A 37 18.074 0.872 -2.273 1.00 0.00 H new ATOM 0 HE2 PHE A 37 17.447 3.466 -5.598 1.00 0.00 H new ATOM 0 HZ PHE A 37 16.970 1.357 -4.420 1.00 0.00 H new ATOM 628 N ALA A 38 20.628 7.113 0.607 1.00 0.00 N ATOM 629 CA ALA A 38 21.572 7.975 1.305 1.00 0.00 C ATOM 630 C ALA A 38 22.891 7.252 1.560 1.00 0.00 C ATOM 631 O ALA A 38 23.059 6.590 2.583 1.00 0.00 O ATOM 632 CB ALA A 38 20.973 8.462 2.616 1.00 0.00 C ATOM 0 H ALA A 38 19.791 6.884 1.143 1.00 0.00 H new ATOM 0 HA ALA A 38 21.777 8.837 0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 38 21.690 9.105 3.127 1.00 0.00 H new ATOM 0 HB2 ALA A 38 20.061 9.024 2.413 1.00 0.00 H new ATOM 0 HB3 ALA A 38 20.738 7.606 3.249 1.00 0.00 H new ATOM 638 N TYR A 39 23.822 7.382 0.620 1.00 0.00 N ATOM 639 CA TYR A 39 25.126 6.739 0.742 1.00 0.00 C ATOM 640 C TYR A 39 25.936 7.362 1.875 1.00 0.00 C ATOM 641 O TYR A 39 25.576 8.414 2.403 1.00 0.00 O ATOM 642 CB TYR A 39 25.896 6.848 -0.575 1.00 0.00 C ATOM 643 CG TYR A 39 26.521 5.546 -1.020 1.00 0.00 C ATOM 644 CD1 TYR A 39 25.784 4.369 -1.039 1.00 0.00 C ATOM 645 CD2 TYR A 39 27.851 5.493 -1.422 1.00 0.00 C ATOM 646 CE1 TYR A 39 26.352 3.176 -1.445 1.00 0.00 C ATOM 647 CE2 TYR A 39 28.426 4.305 -1.830 1.00 0.00 C ATOM 648 CZ TYR A 39 27.673 3.150 -1.840 1.00 0.00 C ATOM 649 OH TYR A 39 28.243 1.964 -2.245 1.00 0.00 O ATOM 0 H TYR A 39 23.698 7.926 -0.234 1.00 0.00 H new ATOM 0 HA TYR A 39 24.965 5.686 0.973 1.00 0.00 H new ATOM 0 HB2 TYR A 39 25.220 7.201 -1.353 1.00 0.00 H new ATOM 0 HB3 TYR A 39 26.679 7.599 -0.468 1.00 0.00 H new ATOM 0 HD1 TYR A 39 24.749 4.386 -0.731 1.00 0.00 H new ATOM 0 HD2 TYR A 39 28.444 6.395 -1.415 1.00 0.00 H new ATOM 0 HE1 TYR A 39 25.765 2.270 -1.453 1.00 0.00 H new ATOM 0 HE2 TYR A 39 29.460 4.281 -2.140 1.00 0.00 H new ATOM 0 HH TYR A 39 29.179 2.118 -2.492 1.00 0.00 H new ATOM 659 N ASP A 40 27.030 6.705 2.243 1.00 0.00 N ATOM 660 CA ASP A 40 27.891 7.195 3.313 1.00 0.00 C ATOM 661 C ASP A 40 28.662 8.433 2.868 1.00 0.00 C ATOM 662 O ASP A 40 29.615 8.339 2.095 1.00 0.00 O ATOM 663 CB ASP A 40 28.868 6.101 3.750 1.00 0.00 C ATOM 664 CG ASP A 40 28.326 5.264 4.891 1.00 0.00 C ATOM 665 OD1 ASP A 40 27.787 5.849 5.854 1.00 0.00 O ATOM 666 OD2 ASP A 40 28.439 4.021 4.822 1.00 0.00 O ATOM 0 H ASP A 40 27.342 5.832 1.817 1.00 0.00 H new ATOM 0 HA ASP A 40 27.259 7.468 4.158 1.00 0.00 H new ATOM 0 HB2 ASP A 40 29.088 5.454 2.901 1.00 0.00 H new ATOM 0 HB3 ASP A 40 29.809 6.559 4.054 1.00 0.00 H new ATOM 672 N LYS A 41 28.243 9.594 3.362 1.00 0.00 N ATOM 673 CA LYS A 41 28.895 10.852 3.016 1.00 0.00 C ATOM 674 C LYS A 41 30.267 10.959 3.674 1.00 0.00 C ATOM 675 O LYS A 41 31.144 11.673 3.188 1.00 0.00 O ATOM 676 CB LYS A 41 28.020 12.035 3.438 1.00 0.00 C ATOM 677 CG LYS A 41 28.018 13.176 2.434 1.00 0.00 C ATOM 678 CD LYS A 41 28.036 14.530 3.126 1.00 0.00 C ATOM 679 CE LYS A 41 29.435 15.126 3.149 1.00 0.00 C ATOM 680 NZ LYS A 41 29.428 16.544 3.602 1.00 0.00 N ATOM 0 H LYS A 41 27.455 9.690 4.003 1.00 0.00 H new ATOM 0 HA LYS A 41 29.031 10.874 1.935 1.00 0.00 H new ATOM 0 HB2 LYS A 41 26.997 11.687 3.582 1.00 0.00 H new ATOM 0 HB3 LYS A 41 28.368 12.409 4.401 1.00 0.00 H new ATOM 0 HG2 LYS A 41 28.887 13.089 1.781 1.00 0.00 H new ATOM 0 HG3 LYS A 41 27.134 13.102 1.800 1.00 0.00 H new ATOM 0 HD2 LYS A 41 27.358 15.211 2.612 1.00 0.00 H new ATOM 0 HD3 LYS A 41 27.668 14.423 4.146 1.00 0.00 H new ATOM 0 HE2 LYS A 41 30.070 14.537 3.811 1.00 0.00 H new ATOM 0 HE3 LYS A 41 29.872 15.066 2.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 30.050 17.108 2.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 28.459 16.920 3.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 29.770 16.597 4.583 1.00 0.00 H new ATOM 694 N GLU A 42 30.448 10.243 4.782 1.00 0.00 N ATOM 695 CA GLU A 42 31.716 10.258 5.507 1.00 0.00 C ATOM 696 C GLU A 42 31.940 11.607 6.182 1.00 0.00 C ATOM 697 O GLU A 42 31.940 11.707 7.410 1.00 0.00 O ATOM 698 CB GLU A 42 32.879 9.945 4.563 1.00 0.00 C ATOM 699 CG GLU A 42 33.944 9.055 5.184 1.00 0.00 C ATOM 700 CD GLU A 42 33.718 7.585 4.891 1.00 0.00 C ATOM 701 OE1 GLU A 42 33.879 7.180 3.721 1.00 0.00 O ATOM 702 OE2 GLU A 42 33.379 6.838 5.833 1.00 0.00 O ATOM 0 H GLU A 42 29.733 9.646 5.197 1.00 0.00 H new ATOM 0 HA GLU A 42 31.671 9.488 6.278 1.00 0.00 H new ATOM 0 HB2 GLU A 42 32.489 9.460 3.668 1.00 0.00 H new ATOM 0 HB3 GLU A 42 33.339 10.880 4.244 1.00 0.00 H new ATOM 0 HG2 GLU A 42 34.924 9.350 4.808 1.00 0.00 H new ATOM 0 HG3 GLU A 42 33.957 9.209 6.263 1.00 0.00 H new ATOM 710 N LYS A 43 32.131 12.644 5.374 1.00 0.00 N ATOM 711 CA LYS A 43 32.356 13.988 5.894 1.00 0.00 C ATOM 712 C LYS A 43 31.063 14.579 6.447 1.00 0.00 C ATOM 713 O LYS A 43 30.456 15.456 5.832 1.00 0.00 O ATOM 714 CB LYS A 43 32.920 14.895 4.797 1.00 0.00 C ATOM 715 CG LYS A 43 34.439 14.938 4.765 1.00 0.00 C ATOM 716 CD LYS A 43 35.012 13.786 3.955 1.00 0.00 C ATOM 717 CE LYS A 43 36.403 13.406 4.436 1.00 0.00 C ATOM 718 NZ LYS A 43 36.373 12.231 5.351 1.00 0.00 N ATOM 0 H LYS A 43 32.135 12.580 4.356 1.00 0.00 H new ATOM 0 HA LYS A 43 33.080 13.921 6.706 1.00 0.00 H new ATOM 0 HB2 LYS A 43 32.554 14.552 3.829 1.00 0.00 H new ATOM 0 HB3 LYS A 43 32.539 15.906 4.941 1.00 0.00 H new ATOM 0 HG2 LYS A 43 34.768 15.885 4.337 1.00 0.00 H new ATOM 0 HG3 LYS A 43 34.827 14.897 5.783 1.00 0.00 H new ATOM 0 HD2 LYS A 43 34.351 12.922 4.030 1.00 0.00 H new ATOM 0 HD3 LYS A 43 35.053 14.065 2.902 1.00 0.00 H new ATOM 0 HE2 LYS A 43 37.035 13.181 3.577 1.00 0.00 H new ATOM 0 HE3 LYS A 43 36.854 14.255 4.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 37.341 12.004 5.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 35.791 12.454 6.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 35.966 11.413 4.853 1.00 0.00 H new ATOM 732 N THR A 44 30.647 14.092 7.611 1.00 0.00 N ATOM 733 CA THR A 44 29.426 14.572 8.248 1.00 0.00 C ATOM 734 C THR A 44 29.684 14.957 9.701 1.00 0.00 C ATOM 735 O THR A 44 30.048 14.115 10.522 1.00 0.00 O ATOM 736 CB THR A 44 28.336 13.501 8.180 1.00 0.00 C ATOM 737 OG1 THR A 44 28.219 12.988 6.864 1.00 0.00 O ATOM 738 CG2 THR A 44 26.972 14.007 8.598 1.00 0.00 C ATOM 0 H THR A 44 31.137 13.365 8.133 1.00 0.00 H new ATOM 0 HA THR A 44 29.091 15.459 7.710 1.00 0.00 H new ATOM 0 HB THR A 44 28.648 12.726 8.880 1.00 0.00 H new ATOM 0 HG1 THR A 44 27.518 12.303 6.841 1.00 0.00 H new ATOM 0 HG21 THR A 44 26.246 13.197 8.526 1.00 0.00 H new ATOM 0 HG22 THR A 44 27.016 14.365 9.627 1.00 0.00 H new ATOM 0 HG23 THR A 44 26.670 14.824 7.942 1.00 0.00 H new ATOM 746 N ASP A 45 29.492 16.235 10.012 1.00 0.00 N ATOM 747 CA ASP A 45 29.705 16.732 11.367 1.00 0.00 C ATOM 748 C ASP A 45 28.411 16.680 12.173 1.00 0.00 C ATOM 749 O ASP A 45 28.424 16.381 13.367 1.00 0.00 O ATOM 750 CB ASP A 45 30.238 18.165 11.329 1.00 0.00 C ATOM 751 CG ASP A 45 31.753 18.217 11.309 1.00 0.00 C ATOM 752 OD1 ASP A 45 32.356 17.627 10.387 1.00 0.00 O ATOM 753 OD2 ASP A 45 32.338 18.847 12.214 1.00 0.00 O ATOM 0 H ASP A 45 29.190 16.945 9.345 1.00 0.00 H new ATOM 0 HA ASP A 45 30.441 16.091 11.852 1.00 0.00 H new ATOM 0 HB2 ASP A 45 29.848 18.672 10.446 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.870 18.710 12.198 1.00 0.00 H new ATOM 759 N ARG A 46 27.295 16.972 11.512 1.00 0.00 N ATOM 760 CA ARG A 46 25.993 16.958 12.168 1.00 0.00 C ATOM 761 C ARG A 46 25.395 15.555 12.160 1.00 0.00 C ATOM 762 O ARG A 46 25.671 14.756 11.265 1.00 0.00 O ATOM 763 CB ARG A 46 25.040 17.935 11.474 1.00 0.00 C ATOM 764 CG ARG A 46 23.998 18.532 12.406 1.00 0.00 C ATOM 765 CD ARG A 46 24.590 19.628 13.279 1.00 0.00 C ATOM 766 NE ARG A 46 24.166 20.958 12.850 1.00 0.00 N ATOM 767 CZ ARG A 46 22.981 21.489 13.144 1.00 0.00 C ATOM 768 NH1 ARG A 46 22.100 20.806 13.864 1.00 0.00 N ATOM 769 NH2 ARG A 46 22.675 22.705 12.715 1.00 0.00 N ATOM 0 H ARG A 46 27.267 17.221 10.523 1.00 0.00 H new ATOM 0 HA ARG A 46 26.132 17.268 13.204 1.00 0.00 H new ATOM 0 HB2 ARG A 46 25.621 18.742 11.028 1.00 0.00 H new ATOM 0 HB3 ARG A 46 24.533 17.418 10.659 1.00 0.00 H new ATOM 0 HG2 ARG A 46 23.174 18.939 11.819 1.00 0.00 H new ATOM 0 HG3 ARG A 46 23.582 17.747 13.038 1.00 0.00 H new ATOM 0 HD2 ARG A 46 24.290 19.468 14.315 1.00 0.00 H new ATOM 0 HD3 ARG A 46 25.678 19.567 13.249 1.00 0.00 H new ATOM 0 HE ARG A 46 24.816 21.513 12.293 1.00 0.00 H new ATOM 0 HH11 ARG A 46 22.329 19.869 14.195 1.00 0.00 H new ATOM 0 HH12 ARG A 46 21.194 21.218 14.086 1.00 0.00 H new ATOM 0 HH21 ARG A 46 23.347 23.234 12.160 1.00 0.00 H new ATOM 0 HH22 ARG A 46 21.767 23.112 12.940 1.00 0.00 H new ATOM 783 N TYR A 47 24.575 15.262 13.164 1.00 0.00 N ATOM 784 CA TYR A 47 23.938 13.954 13.274 1.00 0.00 C ATOM 785 C TYR A 47 22.896 13.764 12.176 1.00 0.00 C ATOM 786 O TYR A 47 22.334 14.731 11.665 1.00 0.00 O ATOM 787 CB TYR A 47 23.283 13.797 14.647 1.00 0.00 C ATOM 788 CG TYR A 47 23.393 12.399 15.213 1.00 0.00 C ATOM 789 CD1 TYR A 47 24.632 11.837 15.493 1.00 0.00 C ATOM 790 CD2 TYR A 47 22.256 11.641 15.469 1.00 0.00 C ATOM 791 CE1 TYR A 47 24.736 10.560 16.010 1.00 0.00 C ATOM 792 CE2 TYR A 47 22.353 10.364 15.986 1.00 0.00 C ATOM 793 CZ TYR A 47 23.594 9.828 16.256 1.00 0.00 C ATOM 794 OH TYR A 47 23.694 8.556 16.771 1.00 0.00 O ATOM 0 H TYR A 47 24.336 15.912 13.913 1.00 0.00 H new ATOM 0 HA TYR A 47 24.707 13.191 13.157 1.00 0.00 H new ATOM 0 HB2 TYR A 47 23.743 14.499 15.342 1.00 0.00 H new ATOM 0 HB3 TYR A 47 22.230 14.068 14.571 1.00 0.00 H new ATOM 0 HD1 TYR A 47 25.529 12.408 15.303 1.00 0.00 H new ATOM 0 HD2 TYR A 47 21.282 12.057 15.260 1.00 0.00 H new ATOM 0 HE1 TYR A 47 25.707 10.137 16.220 1.00 0.00 H new ATOM 0 HE2 TYR A 47 21.460 9.788 16.178 1.00 0.00 H new ATOM 0 HH TYR A 47 22.797 8.178 16.886 1.00 0.00 H new ATOM 804 N ASN A 48 22.643 12.509 11.819 1.00 0.00 N ATOM 805 CA ASN A 48 21.670 12.190 10.781 1.00 0.00 C ATOM 806 C ASN A 48 20.444 11.506 11.377 1.00 0.00 C ATOM 807 O ASN A 48 20.521 10.369 11.843 1.00 0.00 O ATOM 808 CB ASN A 48 22.302 11.293 9.715 1.00 0.00 C ATOM 809 CG ASN A 48 22.966 12.089 8.609 1.00 0.00 C ATOM 810 OD1 ASN A 48 22.713 11.859 7.427 1.00 0.00 O ATOM 811 ND2 ASN A 48 23.822 13.030 8.989 1.00 0.00 N ATOM 0 H ASN A 48 23.099 11.696 12.234 1.00 0.00 H new ATOM 0 HA ASN A 48 21.353 13.124 10.317 1.00 0.00 H new ATOM 0 HB2 ASN A 48 23.040 10.642 10.183 1.00 0.00 H new ATOM 0 HB3 ASN A 48 21.535 10.649 9.285 1.00 0.00 H new ATOM 0 HD21 ASN A 48 24.300 13.597 8.289 1.00 0.00 H new ATOM 0 HD22 ASN A 48 24.001 13.186 9.981 1.00 0.00 H new ATOM 818 N GLU A 49 19.313 12.204 11.357 1.00 0.00 N ATOM 819 CA GLU A 49 18.071 11.662 11.893 1.00 0.00 C ATOM 820 C GLU A 49 17.061 11.410 10.778 1.00 0.00 C ATOM 821 O GLU A 49 17.160 11.988 9.696 1.00 0.00 O ATOM 822 CB GLU A 49 17.477 12.621 12.928 1.00 0.00 C ATOM 823 CG GLU A 49 17.957 12.359 14.346 1.00 0.00 C ATOM 824 CD GLU A 49 18.160 13.635 15.138 1.00 0.00 C ATOM 825 OE1 GLU A 49 17.159 14.329 15.415 1.00 0.00 O ATOM 826 OE2 GLU A 49 19.322 13.942 15.481 1.00 0.00 O ATOM 0 H GLU A 49 19.232 13.146 10.975 1.00 0.00 H new ATOM 0 HA GLU A 49 18.297 10.711 12.375 1.00 0.00 H new ATOM 0 HB2 GLU A 49 17.731 13.644 12.651 1.00 0.00 H new ATOM 0 HB3 GLU A 49 16.390 12.544 12.901 1.00 0.00 H new ATOM 0 HG2 GLU A 49 17.232 11.728 14.860 1.00 0.00 H new ATOM 0 HG3 GLU A 49 18.895 11.804 14.312 1.00 0.00 H new ATOM 834 N ARG A 50 16.092 10.542 11.049 1.00 0.00 N ATOM 835 CA ARG A 50 15.065 10.213 10.068 1.00 0.00 C ATOM 836 C ARG A 50 13.784 11.001 10.333 1.00 0.00 C ATOM 837 O ARG A 50 13.527 11.422 11.461 1.00 0.00 O ATOM 838 CB ARG A 50 14.768 8.712 10.094 1.00 0.00 C ATOM 839 CG ARG A 50 15.937 7.853 9.637 1.00 0.00 C ATOM 840 CD ARG A 50 15.914 6.481 10.293 1.00 0.00 C ATOM 841 NE ARG A 50 15.861 5.404 9.307 1.00 0.00 N ATOM 842 CZ ARG A 50 14.765 5.077 8.625 1.00 0.00 C ATOM 843 NH1 ARG A 50 13.631 5.739 8.819 1.00 0.00 N ATOM 844 NH2 ARG A 50 14.804 4.084 7.746 1.00 0.00 N ATOM 0 H ARG A 50 15.997 10.054 11.940 1.00 0.00 H new ATOM 0 HA ARG A 50 15.440 10.486 9.082 1.00 0.00 H new ATOM 0 HB2 ARG A 50 14.489 8.423 11.107 1.00 0.00 H new ATOM 0 HB3 ARG A 50 13.908 8.509 9.456 1.00 0.00 H new ATOM 0 HG2 ARG A 50 15.904 7.739 8.553 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.874 8.356 9.876 1.00 0.00 H new ATOM 0 HD2 ARG A 50 16.802 6.361 10.914 1.00 0.00 H new ATOM 0 HD3 ARG A 50 15.051 6.410 10.955 1.00 0.00 H new ATOM 0 HE ARG A 50 16.713 4.872 9.131 1.00 0.00 H new ATOM 0 HH11 ARG A 50 13.596 6.503 9.494 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.795 5.484 8.293 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.673 3.572 7.593 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.965 3.833 7.223 1.00 0.00 H new ATOM 858 N PRO A 51 12.960 11.209 9.291 1.00 0.00 N ATOM 859 CA PRO A 51 11.701 11.950 9.417 1.00 0.00 C ATOM 860 C PRO A 51 10.657 11.183 10.220 1.00 0.00 C ATOM 861 O PRO A 51 10.623 9.953 10.199 1.00 0.00 O ATOM 862 CB PRO A 51 11.241 12.120 7.967 1.00 0.00 C ATOM 863 CG PRO A 51 11.871 10.986 7.235 1.00 0.00 C ATOM 864 CD PRO A 51 13.191 10.740 7.912 1.00 0.00 C ATOM 0 HA PRO A 51 11.834 12.892 9.949 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.154 12.086 7.890 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.560 13.080 7.560 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.241 10.098 7.274 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.012 11.231 6.182 1.00 0.00 H new ATOM 0 HD2 PRO A 51 13.465 9.685 7.887 1.00 0.00 H new ATOM 0 HD3 PRO A 51 13.999 11.291 7.430 1.00 0.00 H new ATOM 872 N TRP A 52 9.806 11.918 10.929 1.00 0.00 N ATOM 873 CA TRP A 52 8.760 11.306 11.740 1.00 0.00 C ATOM 874 C TRP A 52 7.499 11.068 10.915 1.00 0.00 C ATOM 875 O TRP A 52 6.594 11.900 10.893 1.00 0.00 O ATOM 876 CB TRP A 52 8.436 12.193 12.944 1.00 0.00 C ATOM 877 CG TRP A 52 9.258 11.874 14.154 1.00 0.00 C ATOM 878 CD1 TRP A 52 9.362 10.664 14.780 1.00 0.00 C ATOM 879 CD2 TRP A 52 10.091 12.779 14.888 1.00 0.00 C ATOM 880 NE1 TRP A 52 10.209 10.762 15.857 1.00 0.00 N ATOM 881 CE2 TRP A 52 10.670 12.050 15.944 1.00 0.00 C ATOM 882 CE3 TRP A 52 10.404 14.135 14.754 1.00 0.00 C ATOM 883 CZ2 TRP A 52 11.544 12.632 16.860 1.00 0.00 C ATOM 884 CZ3 TRP A 52 11.272 14.711 15.664 1.00 0.00 C ATOM 885 CH2 TRP A 52 11.833 13.961 16.704 1.00 0.00 C ATOM 0 H TRP A 52 9.820 12.937 10.958 1.00 0.00 H new ATOM 0 HA TRP A 52 9.127 10.343 12.094 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.594 13.236 12.671 1.00 0.00 H new ATOM 0 HB3 TRP A 52 7.380 12.085 13.192 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.853 9.762 14.473 1.00 0.00 H new ATOM 0 HE1 TRP A 52 10.455 10.000 16.489 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.976 14.722 13.955 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.978 12.056 17.664 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 11.521 15.758 15.570 1.00 0.00 H new ATOM 0 HH2 TRP A 52 12.508 14.441 17.398 1.00 0.00 H new ATOM 896 N GLY A 53 7.450 9.925 10.237 1.00 0.00 N ATOM 897 CA GLY A 53 6.297 9.598 9.420 1.00 0.00 C ATOM 898 C GLY A 53 6.205 8.116 9.112 1.00 0.00 C ATOM 899 O GLY A 53 6.810 7.636 8.153 1.00 0.00 O ATOM 0 H GLY A 53 8.188 9.221 10.239 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.390 9.916 9.934 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.347 10.158 8.486 1.00 0.00 H new ATOM 903 N GLY A 54 5.449 7.390 9.927 1.00 0.00 N ATOM 904 CA GLY A 54 5.295 5.962 9.722 1.00 0.00 C ATOM 905 C GLY A 54 4.496 5.298 10.826 1.00 0.00 C ATOM 906 O GLY A 54 3.974 5.973 11.714 1.00 0.00 O ATOM 0 H GLY A 54 4.939 7.765 10.727 1.00 0.00 H new ATOM 0 HA2 GLY A 54 4.802 5.787 8.766 1.00 0.00 H new ATOM 0 HA3 GLY A 54 6.280 5.499 9.662 1.00 0.00 H new ATOM 910 N GLY A 55 4.400 3.974 10.772 1.00 0.00 N ATOM 911 CA GLY A 55 3.658 3.243 11.782 1.00 0.00 C ATOM 912 C GLY A 55 3.693 1.744 11.557 1.00 0.00 C ATOM 913 O GLY A 55 4.688 1.205 11.075 1.00 0.00 O ATOM 0 H GLY A 55 4.823 3.394 10.047 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.070 3.469 12.766 1.00 0.00 H new ATOM 0 HA3 GLY A 55 2.622 3.583 11.784 1.00 0.00 H new ATOM 917 N PHE A 56 2.602 1.070 11.906 1.00 0.00 N ATOM 918 CA PHE A 56 2.510 -0.376 11.740 1.00 0.00 C ATOM 919 C PHE A 56 1.282 -0.752 10.916 1.00 0.00 C ATOM 920 O PHE A 56 0.463 0.103 10.579 1.00 0.00 O ATOM 921 CB PHE A 56 2.453 -1.066 13.103 1.00 0.00 C ATOM 922 CG PHE A 56 1.274 -0.654 13.936 1.00 0.00 C ATOM 923 CD1 PHE A 56 -0.002 -1.096 13.623 1.00 0.00 C ATOM 924 CD2 PHE A 56 1.440 0.177 15.034 1.00 0.00 C ATOM 925 CE1 PHE A 56 -1.089 -0.720 14.388 1.00 0.00 C ATOM 926 CE2 PHE A 56 0.356 0.557 15.802 1.00 0.00 C ATOM 927 CZ PHE A 56 -0.910 0.108 15.479 1.00 0.00 C ATOM 0 H PHE A 56 1.769 1.502 12.306 1.00 0.00 H new ATOM 0 HA PHE A 56 3.400 -0.712 11.208 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.422 -2.145 12.954 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.369 -0.846 13.651 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.148 -1.742 12.770 1.00 0.00 H new ATOM 0 HD2 PHE A 56 2.427 0.531 15.292 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -2.077 -1.073 14.133 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.498 1.205 16.654 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.758 0.404 16.078 1.00 0.00 H new ATOM 937 N GLY A 57 1.162 -2.035 10.594 1.00 0.00 N ATOM 938 CA GLY A 57 0.032 -2.501 9.812 1.00 0.00 C ATOM 939 C GLY A 57 -0.421 -3.890 10.217 1.00 0.00 C ATOM 940 O GLY A 57 0.400 -4.750 10.538 1.00 0.00 O ATOM 0 H GLY A 57 1.827 -2.761 10.861 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.798 -1.804 9.927 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.302 -2.504 8.756 1.00 0.00 H new ATOM 944 N LEU A 58 -1.732 -4.110 10.201 1.00 0.00 N ATOM 945 CA LEU A 58 -2.295 -5.404 10.568 1.00 0.00 C ATOM 946 C LEU A 58 -3.124 -5.979 9.424 1.00 0.00 C ATOM 947 O LEU A 58 -3.279 -5.348 8.379 1.00 0.00 O ATOM 948 CB LEU A 58 -3.160 -5.270 11.823 1.00 0.00 C ATOM 949 CG LEU A 58 -2.473 -4.603 13.015 1.00 0.00 C ATOM 950 CD1 LEU A 58 -3.479 -3.814 13.838 1.00 0.00 C ATOM 951 CD2 LEU A 58 -1.775 -5.644 13.878 1.00 0.00 C ATOM 0 H LEU A 58 -2.424 -3.409 9.938 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.471 -6.086 10.775 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -4.053 -4.698 11.571 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.493 -6.263 12.124 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.722 -3.910 12.636 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -2.972 -3.346 14.682 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -3.934 -3.043 13.216 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.254 -4.486 14.207 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.291 -5.152 14.722 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.508 -6.361 14.248 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.025 -6.166 13.284 1.00 0.00 H new ATOM 963 N SER A 59 -3.656 -7.179 9.630 1.00 0.00 N ATOM 964 CA SER A 59 -4.470 -7.838 8.615 1.00 0.00 C ATOM 965 C SER A 59 -5.153 -9.078 9.185 1.00 0.00 C ATOM 966 O SER A 59 -4.821 -9.534 10.279 1.00 0.00 O ATOM 967 CB SER A 59 -3.609 -8.223 7.411 1.00 0.00 C ATOM 968 OG SER A 59 -2.395 -8.827 7.823 1.00 0.00 O ATOM 0 H SER A 59 -3.538 -7.715 10.490 1.00 0.00 H new ATOM 0 HA SER A 59 -5.240 -7.138 8.292 1.00 0.00 H new ATOM 0 HB2 SER A 59 -4.161 -8.910 6.770 1.00 0.00 H new ATOM 0 HB3 SER A 59 -3.393 -7.336 6.816 1.00 0.00 H new ATOM 0 HG SER A 59 -1.864 -9.065 7.034 1.00 0.00 H new ATOM 974 N ARG A 60 -6.107 -9.619 8.434 1.00 0.00 N ATOM 975 CA ARG A 60 -6.837 -10.806 8.864 1.00 0.00 C ATOM 976 C ARG A 60 -6.896 -11.842 7.746 1.00 0.00 C ATOM 977 O ARG A 60 -6.545 -11.556 6.601 1.00 0.00 O ATOM 978 CB ARG A 60 -8.252 -10.428 9.304 1.00 0.00 C ATOM 979 CG ARG A 60 -8.705 -11.134 10.571 1.00 0.00 C ATOM 980 CD ARG A 60 -10.197 -10.959 10.804 1.00 0.00 C ATOM 981 NE ARG A 60 -10.585 -11.319 12.167 1.00 0.00 N ATOM 982 CZ ARG A 60 -10.329 -10.567 13.234 1.00 0.00 C ATOM 983 NH1 ARG A 60 -9.689 -9.412 13.102 1.00 0.00 N ATOM 984 NH2 ARG A 60 -10.717 -10.970 14.436 1.00 0.00 N ATOM 0 H ARG A 60 -6.392 -9.254 7.525 1.00 0.00 H new ATOM 0 HA ARG A 60 -6.307 -11.243 9.710 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -8.298 -9.351 9.462 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.948 -10.662 8.499 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.469 -12.196 10.501 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -8.154 -10.740 11.425 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.475 -9.923 10.610 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.749 -11.576 10.095 1.00 0.00 H new ATOM 0 HE ARG A 60 -11.081 -12.199 12.308 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.391 -9.097 12.179 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.495 -8.839 13.924 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -11.211 -11.856 14.542 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -10.521 -10.394 15.255 1.00 0.00 H new ATOM 998 N TRP A 61 -7.344 -13.046 8.085 1.00 0.00 N ATOM 999 CA TRP A 61 -7.450 -14.125 7.110 1.00 0.00 C ATOM 1000 C TRP A 61 -8.906 -14.371 6.725 1.00 0.00 C ATOM 1001 O TRP A 61 -9.818 -14.094 7.503 1.00 0.00 O ATOM 1002 CB TRP A 61 -6.834 -15.410 7.669 1.00 0.00 C ATOM 1003 CG TRP A 61 -7.414 -15.821 8.988 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -8.440 -16.697 9.194 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -7.002 -15.372 10.283 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -8.691 -16.821 10.540 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -7.821 -16.017 11.229 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -6.019 -14.487 10.736 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -7.686 -15.805 12.599 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -5.887 -14.277 12.095 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -6.716 -14.933 13.013 1.00 0.00 C ATOM 0 H TRP A 61 -7.640 -13.299 9.028 1.00 0.00 H new ATOM 0 HA TRP A 61 -6.902 -13.827 6.216 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -6.978 -16.216 6.950 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -5.759 -15.270 7.781 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -8.976 -17.217 8.414 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -9.408 -17.415 10.958 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -5.374 -13.977 10.036 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -8.324 -16.311 13.309 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -5.131 -13.595 12.456 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -6.587 -14.747 14.069 1.00 0.00 H new ATOM 1022 N ASP A 62 -9.113 -14.893 5.520 1.00 0.00 N ATOM 1023 CA ASP A 62 -10.458 -15.176 5.032 1.00 0.00 C ATOM 1024 C ASP A 62 -10.478 -16.467 4.218 1.00 0.00 C ATOM 1025 O ASP A 62 -9.748 -16.605 3.236 1.00 0.00 O ATOM 1026 CB ASP A 62 -10.972 -14.012 4.182 1.00 0.00 C ATOM 1027 CG ASP A 62 -12.423 -13.683 4.472 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -13.244 -14.622 4.533 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -12.738 -12.486 4.640 1.00 0.00 O ATOM 0 H ASP A 62 -8.368 -15.128 4.865 1.00 0.00 H new ATOM 0 HA ASP A 62 -11.113 -15.300 5.894 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -10.358 -13.131 4.368 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -10.862 -14.260 3.126 1.00 0.00 H new ATOM 1035 N GLU A 63 -11.320 -17.407 4.638 1.00 0.00 N ATOM 1036 CA GLU A 63 -11.443 -18.694 3.958 1.00 0.00 C ATOM 1037 C GLU A 63 -11.776 -18.516 2.477 1.00 0.00 C ATOM 1038 O GLU A 63 -11.563 -19.424 1.674 1.00 0.00 O ATOM 1039 CB GLU A 63 -12.517 -19.547 4.632 1.00 0.00 C ATOM 1040 CG GLU A 63 -11.985 -20.418 5.758 1.00 0.00 C ATOM 1041 CD GLU A 63 -12.943 -20.506 6.930 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -13.460 -19.452 7.354 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -13.177 -21.630 7.423 1.00 0.00 O ATOM 0 H GLU A 63 -11.930 -17.301 5.449 1.00 0.00 H new ATOM 0 HA GLU A 63 -10.480 -19.200 4.030 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.294 -18.892 5.027 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.987 -20.184 3.882 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -11.791 -21.420 5.376 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.031 -20.018 6.102 1.00 0.00 H new ATOM 1051 N LYS A 64 -12.300 -17.347 2.119 1.00 0.00 N ATOM 1052 CA LYS A 64 -12.660 -17.064 0.734 1.00 0.00 C ATOM 1053 C LYS A 64 -11.491 -16.447 -0.032 1.00 0.00 C ATOM 1054 O LYS A 64 -11.691 -15.721 -1.005 1.00 0.00 O ATOM 1055 CB LYS A 64 -13.867 -16.124 0.684 1.00 0.00 C ATOM 1056 CG LYS A 64 -13.591 -14.750 1.272 1.00 0.00 C ATOM 1057 CD LYS A 64 -14.853 -14.126 1.846 1.00 0.00 C ATOM 1058 CE LYS A 64 -14.678 -12.635 2.082 1.00 0.00 C ATOM 1059 NZ LYS A 64 -15.389 -12.180 3.310 1.00 0.00 N ATOM 0 H LYS A 64 -12.484 -16.582 2.768 1.00 0.00 H new ATOM 0 HA LYS A 64 -12.917 -18.010 0.257 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -14.186 -16.010 -0.352 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -14.696 -16.581 1.224 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -12.836 -14.833 2.054 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.180 -14.099 0.501 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.686 -14.292 1.163 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.108 -14.617 2.785 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -13.617 -12.403 2.170 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -15.054 -12.084 1.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.791 -11.235 3.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -16.154 -12.848 3.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -14.719 -12.139 4.104 1.00 0.00 H new ATOM 1073 N GLY A 65 -10.270 -16.739 0.411 1.00 0.00 N ATOM 1074 CA GLY A 65 -9.095 -16.202 -0.250 1.00 0.00 C ATOM 1075 C GLY A 65 -9.016 -14.692 -0.153 1.00 0.00 C ATOM 1076 O GLY A 65 -8.701 -14.016 -1.132 1.00 0.00 O ATOM 0 H GLY A 65 -10.075 -17.337 1.214 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -8.200 -16.639 0.194 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -9.106 -16.496 -1.300 1.00 0.00 H new ATOM 1080 N ASN A 66 -9.302 -14.163 1.032 1.00 0.00 N ATOM 1081 CA ASN A 66 -9.264 -12.722 1.253 1.00 0.00 C ATOM 1082 C ASN A 66 -8.488 -12.386 2.523 1.00 0.00 C ATOM 1083 O ASN A 66 -8.354 -13.220 3.418 1.00 0.00 O ATOM 1084 CB ASN A 66 -10.683 -12.159 1.341 1.00 0.00 C ATOM 1085 CG ASN A 66 -11.119 -11.488 0.053 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -10.315 -10.860 -0.636 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -12.399 -11.618 -0.279 1.00 0.00 N ATOM 0 H ASN A 66 -9.562 -14.710 1.853 1.00 0.00 H new ATOM 0 HA ASN A 66 -8.753 -12.264 0.406 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -11.377 -12.965 1.581 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -10.736 -11.440 2.158 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.750 -11.188 -1.135 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.030 -12.148 0.322 1.00 0.00 H new ATOM 1094 N TRP A 67 -7.980 -11.161 2.593 1.00 0.00 N ATOM 1095 CA TRP A 67 -7.219 -10.716 3.754 1.00 0.00 C ATOM 1096 C TRP A 67 -7.497 -9.247 4.058 1.00 0.00 C ATOM 1097 O TRP A 67 -7.345 -8.385 3.193 1.00 0.00 O ATOM 1098 CB TRP A 67 -5.722 -10.925 3.521 1.00 0.00 C ATOM 1099 CG TRP A 67 -5.336 -12.368 3.401 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -4.996 -13.213 4.418 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -5.250 -13.134 2.195 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -4.703 -14.458 3.917 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -4.852 -14.436 2.556 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -5.471 -12.847 0.845 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -4.671 -15.446 1.615 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -5.292 -13.851 -0.088 1.00 0.00 C ATOM 1107 CH2 TRP A 67 -4.895 -15.137 0.301 1.00 0.00 C ATOM 0 H TRP A 67 -8.081 -10.459 1.860 1.00 0.00 H new ATOM 0 HA TRP A 67 -7.533 -11.312 4.611 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.426 -10.400 2.613 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -5.167 -10.475 4.344 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -4.962 -12.942 5.463 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -4.420 -15.268 4.469 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -5.776 -11.858 0.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -4.365 -16.438 1.912 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -5.461 -13.641 -1.134 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -4.763 -15.900 -0.452 1.00 0.00 H new ATOM 1118 N HIS A 68 -7.906 -8.970 5.291 1.00 0.00 N ATOM 1119 CA HIS A 68 -8.205 -7.606 5.709 1.00 0.00 C ATOM 1120 C HIS A 68 -6.936 -6.762 5.756 1.00 0.00 C ATOM 1121 O HIS A 68 -5.875 -7.243 6.153 1.00 0.00 O ATOM 1122 CB HIS A 68 -8.883 -7.607 7.081 1.00 0.00 C ATOM 1123 CG HIS A 68 -9.865 -6.491 7.264 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -10.550 -6.278 8.441 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -10.275 -5.523 6.410 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -11.340 -5.228 8.304 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -11.191 -4.751 7.082 1.00 0.00 N ATOM 0 H HIS A 68 -8.038 -9.672 6.019 1.00 0.00 H new ATOM 0 HA HIS A 68 -8.884 -7.169 4.977 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -9.396 -8.558 7.223 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -8.119 -7.538 7.855 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -9.944 -5.384 5.391 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -11.996 -4.828 9.063 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -11.677 -3.940 6.699 1.00 0.00 H new ATOM 1136 N GLY A 69 -7.052 -5.503 5.349 1.00 0.00 N ATOM 1137 CA GLY A 69 -5.906 -4.613 5.352 1.00 0.00 C ATOM 1138 C GLY A 69 -6.096 -3.421 6.271 1.00 0.00 C ATOM 1139 O GLY A 69 -6.982 -2.596 6.051 1.00 0.00 O ATOM 0 H GLY A 69 -7.920 -5.082 5.017 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -5.020 -5.168 5.661 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -5.722 -4.259 4.337 1.00 0.00 H new ATOM 1143 N LEU A 70 -5.260 -3.332 7.299 1.00 0.00 N ATOM 1144 CA LEU A 70 -5.336 -2.233 8.254 1.00 0.00 C ATOM 1145 C LEU A 70 -3.969 -1.585 8.444 1.00 0.00 C ATOM 1146 O LEU A 70 -2.946 -2.270 8.479 1.00 0.00 O ATOM 1147 CB LEU A 70 -5.868 -2.732 9.599 1.00 0.00 C ATOM 1148 CG LEU A 70 -7.294 -3.283 9.568 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -7.285 -4.772 9.261 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -7.998 -3.013 10.889 1.00 0.00 C ATOM 0 H LEU A 70 -4.521 -4.008 7.493 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.022 -1.485 7.856 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.202 -3.511 9.969 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.828 -1.911 10.315 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.843 -2.774 8.776 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.309 -5.146 9.243 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.820 -4.940 8.290 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.720 -5.299 10.030 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.012 -3.412 10.849 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.450 -3.495 11.699 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.038 -1.938 11.067 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.955 -0.262 8.563 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.710 0.474 8.747 1.00 0.00 C ATOM 1164 C TYR A 71 -2.919 1.684 9.652 1.00 0.00 C ATOM 1165 O TYR A 71 -4.011 2.249 9.710 1.00 0.00 O ATOM 1166 CB TYR A 71 -2.156 0.925 7.394 1.00 0.00 C ATOM 1167 CG TYR A 71 -1.236 -0.087 6.748 1.00 0.00 C ATOM 1168 CD1 TYR A 71 0.026 -0.339 7.270 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -1.631 -0.790 5.617 1.00 0.00 C ATOM 1170 CE1 TYR A 71 0.870 -1.263 6.683 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -0.793 -1.716 5.024 1.00 0.00 C ATOM 1172 CZ TYR A 71 0.455 -1.948 5.560 1.00 0.00 C ATOM 1173 OH TYR A 71 1.292 -2.869 4.973 1.00 0.00 O ATOM 0 H TYR A 71 -4.791 0.322 8.535 1.00 0.00 H new ATOM 0 HA TYR A 71 -1.991 -0.192 9.224 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -2.988 1.129 6.720 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.616 1.862 7.526 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.353 0.196 8.149 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -2.608 -0.610 5.194 1.00 0.00 H new ATOM 0 HE1 TYR A 71 1.849 -1.447 7.101 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -1.115 -2.255 4.145 1.00 0.00 H new ATOM 0 HH TYR A 71 0.849 -3.263 4.193 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.862 2.077 10.355 1.00 0.00 N ATOM 1184 CA ALA A 72 -1.924 3.221 11.257 1.00 0.00 C ATOM 1185 C ALA A 72 -0.566 3.906 11.363 1.00 0.00 C ATOM 1186 O ALA A 72 0.374 3.357 11.938 1.00 0.00 O ATOM 1187 CB ALA A 72 -2.404 2.782 12.633 1.00 0.00 C ATOM 0 H ALA A 72 -0.951 1.619 10.317 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.635 3.939 10.848 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.446 3.646 13.297 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.397 2.341 12.548 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -1.713 2.044 13.041 1.00 0.00 H new ATOM 1193 N MET A 73 -0.470 5.107 10.801 1.00 0.00 N ATOM 1194 CA MET A 73 0.776 5.866 10.831 1.00 0.00 C ATOM 1195 C MET A 73 0.584 7.203 11.538 1.00 0.00 C ATOM 1196 O MET A 73 -0.521 7.539 11.965 1.00 0.00 O ATOM 1197 CB MET A 73 1.289 6.098 9.408 1.00 0.00 C ATOM 1198 CG MET A 73 1.912 4.863 8.777 1.00 0.00 C ATOM 1199 SD MET A 73 1.494 4.687 7.032 1.00 0.00 S ATOM 1200 CE MET A 73 0.809 3.033 7.013 1.00 0.00 C ATOM 0 H MET A 73 -1.238 5.575 10.320 1.00 0.00 H new ATOM 0 HA MET A 73 1.512 5.285 11.387 1.00 0.00 H new ATOM 0 HB2 MET A 73 0.463 6.437 8.784 1.00 0.00 H new ATOM 0 HB3 MET A 73 2.027 6.900 9.423 1.00 0.00 H new ATOM 0 HG2 MET A 73 2.996 4.913 8.884 1.00 0.00 H new ATOM 0 HG3 MET A 73 1.579 3.977 9.317 1.00 0.00 H new ATOM 0 HE1 MET A 73 0.816 2.648 5.993 1.00 0.00 H new ATOM 0 HE2 MET A 73 1.409 2.383 7.651 1.00 0.00 H new ATOM 0 HE3 MET A 73 -0.216 3.059 7.383 1.00 0.00 H new ATOM 1210 N ALA A 74 1.669 7.962 11.658 1.00 0.00 N ATOM 1211 CA ALA A 74 1.622 9.264 12.313 1.00 0.00 C ATOM 1212 C ALA A 74 2.700 10.192 11.764 1.00 0.00 C ATOM 1213 O ALA A 74 3.838 9.776 11.544 1.00 0.00 O ATOM 1214 CB ALA A 74 1.777 9.104 13.818 1.00 0.00 C ATOM 0 H ALA A 74 2.591 7.698 11.310 1.00 0.00 H new ATOM 0 HA ALA A 74 0.651 9.714 12.105 1.00 0.00 H new ATOM 0 HB1 ALA A 74 1.740 10.084 14.294 1.00 0.00 H new ATOM 0 HB2 ALA A 74 0.968 8.483 14.203 1.00 0.00 H new ATOM 0 HB3 ALA A 74 2.734 8.630 14.037 1.00 0.00 H new ATOM 1220 N PHE A 75 2.336 11.451 11.545 1.00 0.00 N ATOM 1221 CA PHE A 75 3.273 12.438 11.021 1.00 0.00 C ATOM 1222 C PHE A 75 3.228 13.721 11.842 1.00 0.00 C ATOM 1223 O PHE A 75 2.213 14.038 12.463 1.00 0.00 O ATOM 1224 CB PHE A 75 2.959 12.744 9.555 1.00 0.00 C ATOM 1225 CG PHE A 75 1.586 13.316 9.343 1.00 0.00 C ATOM 1226 CD1 PHE A 75 1.315 14.638 9.655 1.00 0.00 C ATOM 1227 CD2 PHE A 75 0.566 12.530 8.831 1.00 0.00 C ATOM 1228 CE1 PHE A 75 0.053 15.167 9.461 1.00 0.00 C ATOM 1229 CE2 PHE A 75 -0.698 13.053 8.633 1.00 0.00 C ATOM 1230 CZ PHE A 75 -0.954 14.373 8.949 1.00 0.00 C ATOM 0 H PHE A 75 1.399 11.812 11.722 1.00 0.00 H new ATOM 0 HA PHE A 75 4.277 12.020 11.090 1.00 0.00 H new ATOM 0 HB2 PHE A 75 3.700 13.446 9.172 1.00 0.00 H new ATOM 0 HB3 PHE A 75 3.056 11.828 8.972 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.100 15.263 10.055 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.761 11.497 8.584 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -0.145 16.199 9.709 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -1.484 12.431 8.232 1.00 0.00 H new ATOM 0 HZ PHE A 75 -1.941 14.784 8.796 1.00 0.00 H new ATOM 1240 N LYS A 76 4.335 14.457 11.843 1.00 0.00 N ATOM 1241 CA LYS A 76 4.420 15.708 12.590 1.00 0.00 C ATOM 1242 C LYS A 76 3.818 16.859 11.792 1.00 0.00 C ATOM 1243 O LYS A 76 4.015 16.959 10.581 1.00 0.00 O ATOM 1244 CB LYS A 76 5.878 16.020 12.937 1.00 0.00 C ATOM 1245 CG LYS A 76 6.812 15.971 11.740 1.00 0.00 C ATOM 1246 CD LYS A 76 7.923 17.001 11.858 1.00 0.00 C ATOM 1247 CE LYS A 76 9.154 16.587 11.068 1.00 0.00 C ATOM 1248 NZ LYS A 76 9.936 17.765 10.600 1.00 0.00 N ATOM 0 H LYS A 76 5.185 14.210 11.336 1.00 0.00 H new ATOM 0 HA LYS A 76 3.851 15.592 13.512 1.00 0.00 H new ATOM 0 HB2 LYS A 76 5.931 17.011 13.388 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.224 15.309 13.687 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.246 14.975 11.656 1.00 0.00 H new ATOM 0 HG3 LYS A 76 6.244 16.150 10.827 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.566 17.966 11.498 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.190 17.131 12.907 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.788 15.954 11.689 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.850 15.989 10.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.767 17.440 10.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.339 18.356 9.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.248 18.322 11.420 1.00 0.00 H new ATOM 1262 N ASP A 77 3.082 17.726 12.479 1.00 0.00 N ATOM 1263 CA ASP A 77 2.450 18.872 11.834 1.00 0.00 C ATOM 1264 C ASP A 77 3.347 20.104 11.915 1.00 0.00 C ATOM 1265 O ASP A 77 4.514 20.011 12.295 1.00 0.00 O ATOM 1266 CB ASP A 77 1.096 19.166 12.485 1.00 0.00 C ATOM 1267 CG ASP A 77 0.043 19.566 11.471 1.00 0.00 C ATOM 1268 OD1 ASP A 77 -0.141 18.825 10.482 1.00 0.00 O ATOM 1269 OD2 ASP A 77 -0.599 20.619 11.666 1.00 0.00 O ATOM 0 H ASP A 77 2.908 17.657 13.482 1.00 0.00 H new ATOM 0 HA ASP A 77 2.294 18.628 10.783 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.757 18.283 13.028 1.00 0.00 H new ATOM 0 HB3 ASP A 77 1.214 19.965 13.217 1.00 0.00 H new ATOM 1275 N SER A 78 2.792 21.257 11.554 1.00 0.00 N ATOM 1276 CA SER A 78 3.540 22.507 11.584 1.00 0.00 C ATOM 1277 C SER A 78 3.809 22.951 13.018 1.00 0.00 C ATOM 1278 O SER A 78 4.803 23.623 13.294 1.00 0.00 O ATOM 1279 CB SER A 78 2.776 23.600 10.835 1.00 0.00 C ATOM 1280 OG SER A 78 3.660 24.441 10.114 1.00 0.00 O ATOM 0 H SER A 78 1.827 21.350 11.237 1.00 0.00 H new ATOM 0 HA SER A 78 4.498 22.338 11.092 1.00 0.00 H new ATOM 0 HB2 SER A 78 2.063 23.144 10.148 1.00 0.00 H new ATOM 0 HB3 SER A 78 2.200 24.195 11.543 1.00 0.00 H new ATOM 0 HG SER A 78 3.145 25.130 9.643 1.00 0.00 H new ATOM 1286 N TRP A 79 2.919 22.572 13.929 1.00 0.00 N ATOM 1287 CA TRP A 79 3.062 22.933 15.335 1.00 0.00 C ATOM 1288 C TRP A 79 3.686 21.792 16.133 1.00 0.00 C ATOM 1289 O TRP A 79 3.431 21.647 17.329 1.00 0.00 O ATOM 1290 CB TRP A 79 1.702 23.303 15.929 1.00 0.00 C ATOM 1291 CG TRP A 79 1.086 24.512 15.295 1.00 0.00 C ATOM 1292 CD1 TRP A 79 -0.079 24.562 14.583 1.00 0.00 C ATOM 1293 CD2 TRP A 79 1.603 25.847 15.315 1.00 0.00 C ATOM 1294 NE1 TRP A 79 -0.317 25.847 14.159 1.00 0.00 N ATOM 1295 CE2 TRP A 79 0.700 26.655 14.596 1.00 0.00 C ATOM 1296 CE3 TRP A 79 2.740 26.439 15.871 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 0.901 28.021 14.419 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 2.938 27.797 15.695 1.00 0.00 C ATOM 1299 CH2 TRP A 79 2.023 28.574 14.974 1.00 0.00 C ATOM 0 H TRP A 79 2.091 22.015 13.719 1.00 0.00 H new ATOM 0 HA TRP A 79 3.725 23.796 15.395 1.00 0.00 H new ATOM 0 HB2 TRP A 79 1.023 22.458 15.818 1.00 0.00 H new ATOM 0 HB3 TRP A 79 1.817 23.481 16.998 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -0.719 23.715 14.383 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -1.120 26.150 13.608 1.00 0.00 H new ATOM 0 HE3 TRP A 79 3.451 25.847 16.428 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 0.197 28.623 13.864 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 3.813 28.266 16.121 1.00 0.00 H new ATOM 0 HH2 TRP A 79 2.207 29.631 14.853 1.00 0.00 H new ATOM 1310 N ASN A 80 4.505 20.985 15.466 1.00 0.00 N ATOM 1311 CA ASN A 80 5.165 19.857 16.115 1.00 0.00 C ATOM 1312 C ASN A 80 4.147 18.926 16.766 1.00 0.00 C ATOM 1313 O ASN A 80 4.435 18.284 17.777 1.00 0.00 O ATOM 1314 CB ASN A 80 6.160 20.357 17.165 1.00 0.00 C ATOM 1315 CG ASN A 80 7.535 20.615 16.583 1.00 0.00 C ATOM 1316 OD1 ASN A 80 7.957 21.764 16.443 1.00 0.00 O ATOM 1317 ND2 ASN A 80 8.243 19.545 16.240 1.00 0.00 N ATOM 0 H ASN A 80 4.728 21.091 14.476 1.00 0.00 H new ATOM 0 HA ASN A 80 5.703 19.297 15.350 1.00 0.00 H new ATOM 0 HB2 ASN A 80 5.780 21.275 17.613 1.00 0.00 H new ATOM 0 HB3 ASN A 80 6.240 19.621 17.965 1.00 0.00 H new ATOM 0 HD21 ASN A 80 9.176 19.657 15.843 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.854 18.612 16.374 1.00 0.00 H new ATOM 1324 N LYS A 81 2.955 18.858 16.183 1.00 0.00 N ATOM 1325 CA LYS A 81 1.894 18.007 16.707 1.00 0.00 C ATOM 1326 C LYS A 81 1.697 16.778 15.825 1.00 0.00 C ATOM 1327 O LYS A 81 1.242 16.886 14.685 1.00 0.00 O ATOM 1328 CB LYS A 81 0.585 18.794 16.811 1.00 0.00 C ATOM 1329 CG LYS A 81 -0.155 18.573 18.121 1.00 0.00 C ATOM 1330 CD LYS A 81 0.262 19.589 19.173 1.00 0.00 C ATOM 1331 CE LYS A 81 -0.466 20.911 18.991 1.00 0.00 C ATOM 1332 NZ LYS A 81 0.126 21.991 19.826 1.00 0.00 N ATOM 0 H LYS A 81 2.700 19.383 15.346 1.00 0.00 H new ATOM 0 HA LYS A 81 2.187 17.673 17.702 1.00 0.00 H new ATOM 0 HB2 LYS A 81 0.800 19.857 16.699 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -0.066 18.512 15.983 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -1.229 18.644 17.950 1.00 0.00 H new ATOM 0 HG3 LYS A 81 0.044 17.566 18.487 1.00 0.00 H new ATOM 0 HD2 LYS A 81 0.054 19.192 20.166 1.00 0.00 H new ATOM 0 HD3 LYS A 81 1.338 19.754 19.115 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -0.431 21.203 17.941 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -1.517 20.785 19.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -0.399 22.876 19.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 0.070 21.724 20.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 1.122 22.129 19.560 1.00 0.00 H new ATOM 1346 N TRP A 82 2.040 15.611 16.358 1.00 0.00 N ATOM 1347 CA TRP A 82 1.900 14.362 15.618 1.00 0.00 C ATOM 1348 C TRP A 82 0.430 14.006 15.424 1.00 0.00 C ATOM 1349 O TRP A 82 -0.294 13.766 16.390 1.00 0.00 O ATOM 1350 CB TRP A 82 2.619 13.227 16.349 1.00 0.00 C ATOM 1351 CG TRP A 82 2.052 12.939 17.706 1.00 0.00 C ATOM 1352 CD1 TRP A 82 2.409 13.528 18.885 1.00 0.00 C ATOM 1353 CD2 TRP A 82 1.027 11.991 18.024 1.00 0.00 C ATOM 1354 NE1 TRP A 82 1.669 13.004 19.917 1.00 0.00 N ATOM 1355 CE2 TRP A 82 0.813 12.059 19.414 1.00 0.00 C ATOM 1356 CE3 TRP A 82 0.268 11.093 17.269 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 -0.127 11.261 20.063 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 -0.664 10.302 17.913 1.00 0.00 C ATOM 1359 CH2 TRP A 82 -0.855 10.391 19.298 1.00 0.00 C ATOM 0 H TRP A 82 2.417 15.503 17.300 1.00 0.00 H new ATOM 0 HA TRP A 82 2.355 14.498 14.637 1.00 0.00 H new ATOM 0 HB2 TRP A 82 2.566 12.323 15.742 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.674 13.481 16.451 1.00 0.00 H new ATOM 0 HD1 TRP A 82 3.163 14.294 18.991 1.00 0.00 H new ATOM 0 HE1 TRP A 82 1.744 13.274 20.898 1.00 0.00 H new ATOM 0 HE3 TRP A 82 0.407 11.019 16.201 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -0.275 11.327 21.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -1.255 9.604 17.339 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -1.592 9.760 19.772 1.00 0.00 H new ATOM 1370 N GLU A 83 -0.006 13.975 14.168 1.00 0.00 N ATOM 1371 CA GLU A 83 -1.390 13.649 13.848 1.00 0.00 C ATOM 1372 C GLU A 83 -1.508 12.210 13.346 1.00 0.00 C ATOM 1373 O GLU A 83 -0.832 11.823 12.392 1.00 0.00 O ATOM 1374 CB GLU A 83 -1.930 14.614 12.791 1.00 0.00 C ATOM 1375 CG GLU A 83 -3.446 14.723 12.784 1.00 0.00 C ATOM 1376 CD GLU A 83 -3.974 15.574 13.922 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -4.396 16.720 13.661 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -3.968 15.093 15.076 1.00 0.00 O ATOM 0 H GLU A 83 0.580 14.172 13.356 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.981 13.748 14.758 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.504 15.603 12.962 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.593 14.288 11.807 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -3.772 15.149 11.835 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -3.879 13.725 12.850 1.00 0.00 H new ATOM 1386 N PRO A 84 -2.369 11.393 13.981 1.00 0.00 N ATOM 1387 CA PRO A 84 -2.563 9.996 13.587 1.00 0.00 C ATOM 1388 C PRO A 84 -3.381 9.862 12.306 1.00 0.00 C ATOM 1389 O PRO A 84 -4.065 10.799 11.893 1.00 0.00 O ATOM 1390 CB PRO A 84 -3.324 9.401 14.771 1.00 0.00 C ATOM 1391 CG PRO A 84 -4.079 10.549 15.344 1.00 0.00 C ATOM 1392 CD PRO A 84 -3.217 11.765 15.132 1.00 0.00 C ATOM 0 HA PRO A 84 -1.618 9.496 13.373 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.996 8.604 14.451 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -2.643 8.969 15.504 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -5.044 10.665 14.851 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -4.279 10.393 16.404 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -3.817 12.650 14.919 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -2.619 11.991 16.015 1.00 0.00 H new ATOM 1400 N ILE A 85 -3.308 8.691 11.682 1.00 0.00 N ATOM 1401 CA ILE A 85 -4.042 8.433 10.449 1.00 0.00 C ATOM 1402 C ILE A 85 -4.446 6.964 10.353 1.00 0.00 C ATOM 1403 O ILE A 85 -3.595 6.074 10.342 1.00 0.00 O ATOM 1404 CB ILE A 85 -3.211 8.827 9.209 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -4.090 8.841 7.951 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -2.022 7.891 9.032 1.00 0.00 C ATOM 1407 CD1 ILE A 85 -4.473 7.464 7.445 1.00 0.00 C ATOM 0 H ILE A 85 -2.747 7.905 12.011 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.942 9.047 10.473 1.00 0.00 H new ATOM 0 HB ILE A 85 -2.824 9.834 9.364 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -4.999 9.404 8.163 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -3.563 9.373 7.159 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.452 8.189 8.152 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -1.383 7.944 9.913 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.379 6.869 8.904 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -5.093 7.563 6.554 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -3.571 6.903 7.199 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -5.030 6.934 8.218 1.00 0.00 H new ATOM 1419 N ALA A 86 -5.751 6.717 10.286 1.00 0.00 N ATOM 1420 CA ALA A 86 -6.268 5.358 10.193 1.00 0.00 C ATOM 1421 C ALA A 86 -6.515 4.959 8.742 1.00 0.00 C ATOM 1422 O ALA A 86 -7.082 5.727 7.965 1.00 0.00 O ATOM 1423 CB ALA A 86 -7.549 5.225 11.003 1.00 0.00 C ATOM 0 H ALA A 86 -6.469 7.441 10.294 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.517 4.683 10.604 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.925 4.205 10.925 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.344 5.457 12.048 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -8.297 5.918 10.617 1.00 0.00 H new ATOM 1429 N GLY A 87 -6.088 3.753 8.384 1.00 0.00 N ATOM 1430 CA GLY A 87 -6.272 3.273 7.027 1.00 0.00 C ATOM 1431 C GLY A 87 -6.840 1.867 6.982 1.00 0.00 C ATOM 1432 O GLY A 87 -6.407 0.991 7.730 1.00 0.00 O ATOM 0 H GLY A 87 -5.618 3.099 9.010 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.940 3.949 6.493 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.315 3.292 6.505 1.00 0.00 H new ATOM 1436 N TYR A 88 -7.812 1.652 6.102 1.00 0.00 N ATOM 1437 CA TYR A 88 -8.441 0.343 5.963 1.00 0.00 C ATOM 1438 C TYR A 88 -8.745 0.038 4.500 1.00 0.00 C ATOM 1439 O TYR A 88 -8.941 0.948 3.694 1.00 0.00 O ATOM 1440 CB TYR A 88 -9.728 0.282 6.787 1.00 0.00 C ATOM 1441 CG TYR A 88 -9.575 0.820 8.192 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -9.005 0.045 9.194 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -9.999 2.103 8.515 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -8.865 0.533 10.479 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -9.862 2.598 9.798 1.00 0.00 C ATOM 1446 CZ TYR A 88 -9.293 1.809 10.776 1.00 0.00 C ATOM 1447 OH TYR A 88 -9.154 2.299 12.054 1.00 0.00 O ATOM 0 H TYR A 88 -8.181 2.366 5.475 1.00 0.00 H new ATOM 0 HA TYR A 88 -7.744 -0.408 6.335 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -10.505 0.848 6.273 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -10.068 -0.752 6.838 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -8.666 -0.955 8.965 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -10.443 2.724 7.751 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -8.422 -0.083 11.248 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -10.198 3.597 10.034 1.00 0.00 H new ATOM 0 HH TYR A 88 -9.505 3.213 12.094 1.00 0.00 H new ATOM 1457 N GLY A 89 -8.783 -1.247 4.165 1.00 0.00 N ATOM 1458 CA GLY A 89 -9.065 -1.650 2.799 1.00 0.00 C ATOM 1459 C GLY A 89 -8.980 -3.151 2.607 1.00 0.00 C ATOM 1460 O GLY A 89 -9.011 -3.910 3.576 1.00 0.00 O ATOM 0 H GLY A 89 -8.624 -2.017 4.815 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -10.062 -1.307 2.521 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -8.361 -1.161 2.126 1.00 0.00 H new ATOM 1464 N TRP A 90 -8.871 -3.580 1.354 1.00 0.00 N ATOM 1465 CA TRP A 90 -8.782 -5.001 1.037 1.00 0.00 C ATOM 1466 C TRP A 90 -7.374 -5.366 0.575 1.00 0.00 C ATOM 1467 O TRP A 90 -6.675 -4.548 -0.023 1.00 0.00 O ATOM 1468 CB TRP A 90 -9.801 -5.370 -0.042 1.00 0.00 C ATOM 1469 CG TRP A 90 -11.060 -5.965 0.509 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -11.183 -7.147 1.181 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -12.377 -5.406 0.436 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -12.495 -7.358 1.530 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -13.247 -6.304 1.084 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -12.904 -4.234 -0.114 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -14.614 -6.064 1.195 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -14.262 -3.998 -0.002 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -15.103 -4.909 0.649 1.00 0.00 C ATOM 0 H TRP A 90 -8.842 -2.964 0.541 1.00 0.00 H new ATOM 0 HA TRP A 90 -9.005 -5.566 1.942 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -10.050 -4.478 -0.616 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -9.346 -6.078 -0.735 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -10.368 -7.819 1.406 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -12.851 -8.168 2.038 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -12.262 -3.526 -0.617 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -15.266 -6.765 1.695 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -14.681 -3.096 -0.424 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -16.159 -4.695 0.721 1.00 0.00 H new ATOM 1488 N GLU A 91 -6.968 -6.600 0.854 1.00 0.00 N ATOM 1489 CA GLU A 91 -5.644 -7.074 0.466 1.00 0.00 C ATOM 1490 C GLU A 91 -5.716 -8.493 -0.089 1.00 0.00 C ATOM 1491 O GLU A 91 -6.428 -9.344 0.444 1.00 0.00 O ATOM 1492 CB GLU A 91 -4.692 -7.030 1.663 1.00 0.00 C ATOM 1493 CG GLU A 91 -4.502 -5.635 2.238 1.00 0.00 C ATOM 1494 CD GLU A 91 -3.104 -5.095 2.011 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -2.931 -4.259 1.100 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -2.181 -5.508 2.745 1.00 0.00 O ATOM 0 H GLU A 91 -7.536 -7.289 1.347 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.264 -6.416 -0.315 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.073 -7.687 2.444 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.722 -7.424 1.360 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.227 -4.958 1.786 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.710 -5.656 3.308 1.00 0.00 H new ATOM 1504 N SER A 92 -4.974 -8.740 -1.163 1.00 0.00 N ATOM 1505 CA SER A 92 -4.952 -10.057 -1.791 1.00 0.00 C ATOM 1506 C SER A 92 -3.526 -10.472 -2.135 1.00 0.00 C ATOM 1507 O SER A 92 -2.935 -9.970 -3.091 1.00 0.00 O ATOM 1508 CB SER A 92 -5.815 -10.055 -3.055 1.00 0.00 C ATOM 1509 OG SER A 92 -5.824 -11.333 -3.667 1.00 0.00 O ATOM 0 H SER A 92 -4.380 -8.046 -1.617 1.00 0.00 H new ATOM 0 HA SER A 92 -5.359 -10.778 -1.082 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.834 -9.762 -2.803 1.00 0.00 H new ATOM 0 HB3 SER A 92 -5.434 -9.314 -3.758 1.00 0.00 H new ATOM 0 HG SER A 92 -6.383 -11.307 -4.471 1.00 0.00 H new ATOM 1515 N THR A 93 -2.978 -11.394 -1.349 1.00 0.00 N ATOM 1516 CA THR A 93 -1.621 -11.878 -1.570 1.00 0.00 C ATOM 1517 C THR A 93 -1.623 -13.115 -2.462 1.00 0.00 C ATOM 1518 O THR A 93 -2.485 -13.985 -2.333 1.00 0.00 O ATOM 1519 CB THR A 93 -0.948 -12.199 -0.235 1.00 0.00 C ATOM 1520 OG1 THR A 93 -1.668 -13.201 0.461 1.00 0.00 O ATOM 1521 CG2 THR A 93 -0.830 -10.999 0.679 1.00 0.00 C ATOM 0 H THR A 93 -3.453 -11.820 -0.554 1.00 0.00 H new ATOM 0 HA THR A 93 -1.059 -11.091 -2.072 1.00 0.00 H new ATOM 0 HB THR A 93 0.055 -12.540 -0.491 1.00 0.00 H new ATOM 0 HG1 THR A 93 -1.221 -13.394 1.312 1.00 0.00 H new ATOM 0 HG21 THR A 93 -0.344 -11.296 1.608 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.237 -10.226 0.190 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.824 -10.609 0.898 1.00 0.00 H new ATOM 1529 N TRP A 94 -0.652 -13.188 -3.368 1.00 0.00 N ATOM 1530 CA TRP A 94 -0.543 -14.319 -4.282 1.00 0.00 C ATOM 1531 C TRP A 94 0.896 -14.817 -4.362 1.00 0.00 C ATOM 1532 O TRP A 94 1.821 -14.038 -4.598 1.00 0.00 O ATOM 1533 CB TRP A 94 -1.037 -13.925 -5.675 1.00 0.00 C ATOM 1534 CG TRP A 94 -1.625 -15.069 -6.442 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -1.323 -15.441 -7.721 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -2.619 -15.991 -5.980 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -2.067 -16.538 -8.081 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -2.871 -16.895 -7.030 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -3.321 -16.141 -4.780 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -3.793 -17.932 -6.915 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 -4.235 -17.171 -4.668 1.00 0.00 C ATOM 1542 CH2 TRP A 94 -4.465 -18.055 -5.730 1.00 0.00 C ATOM 0 H TRP A 94 0.070 -12.477 -3.488 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.167 -15.126 -3.898 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.786 -13.139 -5.578 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -0.206 -13.506 -6.242 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -0.604 -14.945 -8.356 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -2.028 -17.010 -8.984 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.152 -15.464 -3.956 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -3.971 -18.615 -7.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -4.782 -17.297 -3.745 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -5.187 -18.849 -5.611 1.00 0.00 H new ATOM 1553 N ARG A 95 1.078 -16.118 -4.164 1.00 0.00 N ATOM 1554 CA ARG A 95 2.405 -16.721 -4.214 1.00 0.00 C ATOM 1555 C ARG A 95 2.372 -18.043 -4.980 1.00 0.00 C ATOM 1556 O ARG A 95 1.408 -18.801 -4.881 1.00 0.00 O ATOM 1557 CB ARG A 95 2.937 -16.950 -2.798 1.00 0.00 C ATOM 1558 CG ARG A 95 4.311 -17.600 -2.760 1.00 0.00 C ATOM 1559 CD ARG A 95 4.612 -18.192 -1.391 1.00 0.00 C ATOM 1560 NE ARG A 95 5.644 -17.437 -0.684 1.00 0.00 N ATOM 1561 CZ ARG A 95 6.007 -17.677 0.574 1.00 0.00 C ATOM 1562 NH1 ARG A 95 5.423 -18.648 1.267 1.00 0.00 N ATOM 1563 NH2 ARG A 95 6.955 -16.944 1.142 1.00 0.00 N ATOM 0 H ARG A 95 0.323 -16.775 -3.967 1.00 0.00 H new ATOM 0 HA ARG A 95 3.071 -16.035 -4.737 1.00 0.00 H new ATOM 0 HB2 ARG A 95 2.983 -15.994 -2.277 1.00 0.00 H new ATOM 0 HB3 ARG A 95 2.233 -17.577 -2.252 1.00 0.00 H new ATOM 0 HG2 ARG A 95 4.365 -18.384 -3.516 1.00 0.00 H new ATOM 0 HG3 ARG A 95 5.071 -16.861 -3.013 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.700 -18.207 -0.794 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.934 -19.227 -1.506 1.00 0.00 H new ATOM 0 HE ARG A 95 6.114 -16.682 -1.184 1.00 0.00 H new ATOM 0 HH11 ARG A 95 4.692 -19.214 0.836 1.00 0.00 H new ATOM 0 HH12 ARG A 95 5.705 -18.828 2.231 1.00 0.00 H new ATOM 0 HH21 ARG A 95 7.406 -16.196 0.615 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.233 -17.128 2.106 1.00 0.00 H new ATOM 1577 N PRO A 96 3.429 -18.337 -5.759 1.00 0.00 N ATOM 1578 CA PRO A 96 3.511 -19.576 -6.540 1.00 0.00 C ATOM 1579 C PRO A 96 3.283 -20.817 -5.683 1.00 0.00 C ATOM 1580 O PRO A 96 2.961 -20.713 -4.499 1.00 0.00 O ATOM 1581 CB PRO A 96 4.940 -19.561 -7.088 1.00 0.00 C ATOM 1582 CG PRO A 96 5.324 -18.123 -7.110 1.00 0.00 C ATOM 1583 CD PRO A 96 4.624 -17.491 -5.938 1.00 0.00 C ATOM 0 HA PRO A 96 2.745 -19.619 -7.314 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.612 -20.140 -6.455 1.00 0.00 H new ATOM 0 HB3 PRO A 96 4.986 -19.998 -8.086 1.00 0.00 H new ATOM 0 HG2 PRO A 96 6.405 -18.006 -7.029 1.00 0.00 H new ATOM 0 HG3 PRO A 96 5.022 -17.652 -8.046 1.00 0.00 H new ATOM 0 HD2 PRO A 96 5.252 -17.489 -5.047 1.00 0.00 H new ATOM 0 HD3 PRO A 96 4.356 -16.454 -6.141 1.00 0.00 H new ATOM 1591 N LEU A 97 3.452 -21.987 -6.288 1.00 0.00 N ATOM 1592 CA LEU A 97 3.266 -23.247 -5.579 1.00 0.00 C ATOM 1593 C LEU A 97 4.586 -23.744 -4.997 1.00 0.00 C ATOM 1594 O LEU A 97 4.983 -24.889 -5.215 1.00 0.00 O ATOM 1595 CB LEU A 97 2.677 -24.302 -6.519 1.00 0.00 C ATOM 1596 CG LEU A 97 1.322 -23.943 -7.129 1.00 0.00 C ATOM 1597 CD1 LEU A 97 1.155 -24.606 -8.487 1.00 0.00 C ATOM 1598 CD2 LEU A 97 0.193 -24.350 -6.194 1.00 0.00 C ATOM 0 H LEU A 97 3.717 -22.089 -7.268 1.00 0.00 H new ATOM 0 HA LEU A 97 2.571 -23.075 -4.757 1.00 0.00 H new ATOM 0 HB2 LEU A 97 3.386 -24.482 -7.327 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.574 -25.238 -5.970 1.00 0.00 H new ATOM 0 HG LEU A 97 1.282 -22.863 -7.268 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.185 -24.339 -8.905 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.945 -24.267 -9.157 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.215 -25.688 -8.373 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.764 -24.087 -6.644 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.231 -25.426 -6.024 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.302 -23.829 -5.243 1.00 0.00 H new ATOM 1610 N ALA A 98 5.263 -22.872 -4.256 1.00 0.00 N ATOM 1611 CA ALA A 98 6.540 -23.220 -3.643 1.00 0.00 C ATOM 1612 C ALA A 98 7.577 -23.574 -4.702 1.00 0.00 C ATOM 1613 O ALA A 98 8.442 -24.420 -4.480 1.00 0.00 O ATOM 1614 CB ALA A 98 6.360 -24.376 -2.669 1.00 0.00 C ATOM 0 H ALA A 98 4.949 -21.920 -4.066 1.00 0.00 H new ATOM 0 HA ALA A 98 6.902 -22.350 -3.094 1.00 0.00 H new ATOM 0 HB1 ALA A 98 7.321 -24.625 -2.219 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.657 -24.087 -1.888 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.973 -25.244 -3.202 1.00 0.00 H new ATOM 1620 N ASP A 99 7.485 -22.920 -5.856 1.00 0.00 N ATOM 1621 CA ASP A 99 8.415 -23.165 -6.951 1.00 0.00 C ATOM 1622 C ASP A 99 9.352 -21.977 -7.147 1.00 0.00 C ATOM 1623 O ASP A 99 10.572 -22.135 -7.173 1.00 0.00 O ATOM 1624 CB ASP A 99 7.648 -23.444 -8.245 1.00 0.00 C ATOM 1625 CG ASP A 99 8.533 -24.035 -9.326 1.00 0.00 C ATOM 1626 OD1 ASP A 99 9.293 -24.977 -9.021 1.00 0.00 O ATOM 1627 OD2 ASP A 99 8.464 -23.555 -10.477 1.00 0.00 O ATOM 0 H ASP A 99 6.775 -22.216 -6.056 1.00 0.00 H new ATOM 0 HA ASP A 99 9.015 -24.038 -6.696 1.00 0.00 H new ATOM 0 HB2 ASP A 99 6.827 -24.130 -8.037 1.00 0.00 H new ATOM 0 HB3 ASP A 99 7.205 -22.517 -8.609 1.00 0.00 H new ATOM 1633 N GLU A 100 8.772 -20.790 -7.288 1.00 0.00 N ATOM 1634 CA GLU A 100 9.556 -19.575 -7.483 1.00 0.00 C ATOM 1635 C GLU A 100 9.722 -18.816 -6.170 1.00 0.00 C ATOM 1636 O GLU A 100 10.726 -18.138 -5.958 1.00 0.00 O ATOM 1637 CB GLU A 100 8.890 -18.675 -8.526 1.00 0.00 C ATOM 1638 CG GLU A 100 9.837 -17.665 -9.151 1.00 0.00 C ATOM 1639 CD GLU A 100 10.823 -18.306 -10.108 1.00 0.00 C ATOM 1640 OE1 GLU A 100 11.385 -17.580 -10.955 1.00 0.00 O ATOM 1641 OE2 GLU A 100 11.036 -19.532 -10.008 1.00 0.00 O ATOM 0 H GLU A 100 7.763 -20.643 -7.271 1.00 0.00 H new ATOM 0 HA GLU A 100 10.544 -19.864 -7.841 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.465 -19.298 -9.313 1.00 0.00 H new ATOM 0 HB3 GLU A 100 8.061 -18.143 -8.059 1.00 0.00 H new ATOM 0 HG2 GLU A 100 9.258 -16.910 -9.683 1.00 0.00 H new ATOM 0 HG3 GLU A 100 10.385 -17.149 -8.362 1.00 0.00 H new ATOM 1649 N ASN A 101 8.729 -18.934 -5.294 1.00 0.00 N ATOM 1650 CA ASN A 101 8.766 -18.257 -4.002 1.00 0.00 C ATOM 1651 C ASN A 101 8.794 -16.742 -4.182 1.00 0.00 C ATOM 1652 O ASN A 101 9.472 -16.031 -3.441 1.00 0.00 O ATOM 1653 CB ASN A 101 9.986 -18.709 -3.198 1.00 0.00 C ATOM 1654 CG ASN A 101 10.101 -20.219 -3.123 1.00 0.00 C ATOM 1655 OD1 ASN A 101 9.225 -20.893 -2.581 1.00 0.00 O ATOM 1656 ND2 ASN A 101 11.186 -20.758 -3.665 1.00 0.00 N ATOM 0 H ASN A 101 7.890 -19.491 -5.455 1.00 0.00 H new ATOM 0 HA ASN A 101 7.861 -18.524 -3.455 1.00 0.00 H new ATOM 0 HB2 ASN A 101 10.889 -18.301 -3.652 1.00 0.00 H new ATOM 0 HB3 ASN A 101 9.924 -18.301 -2.189 1.00 0.00 H new ATOM 0 HD21 ASN A 101 11.319 -21.769 -3.642 1.00 0.00 H new ATOM 0 HD22 ASN A 101 11.887 -20.161 -4.104 1.00 0.00 H new ATOM 1663 N PHE A 102 8.052 -16.255 -5.172 1.00 0.00 N ATOM 1664 CA PHE A 102 7.992 -14.825 -5.449 1.00 0.00 C ATOM 1665 C PHE A 102 6.715 -14.214 -4.880 1.00 0.00 C ATOM 1666 O PHE A 102 5.617 -14.723 -5.108 1.00 0.00 O ATOM 1667 CB PHE A 102 8.064 -14.572 -6.957 1.00 0.00 C ATOM 1668 CG PHE A 102 8.858 -13.351 -7.324 1.00 0.00 C ATOM 1669 CD1 PHE A 102 10.149 -13.181 -6.852 1.00 0.00 C ATOM 1670 CD2 PHE A 102 8.312 -12.374 -8.140 1.00 0.00 C ATOM 1671 CE1 PHE A 102 10.882 -12.058 -7.189 1.00 0.00 C ATOM 1672 CE2 PHE A 102 9.040 -11.249 -8.480 1.00 0.00 C ATOM 1673 CZ PHE A 102 10.327 -11.091 -8.003 1.00 0.00 C ATOM 0 H PHE A 102 7.485 -16.830 -5.795 1.00 0.00 H new ATOM 0 HA PHE A 102 8.847 -14.351 -4.967 1.00 0.00 H new ATOM 0 HB2 PHE A 102 8.506 -15.442 -7.442 1.00 0.00 H new ATOM 0 HB3 PHE A 102 7.052 -14.468 -7.348 1.00 0.00 H new ATOM 0 HD1 PHE A 102 10.588 -13.934 -6.214 1.00 0.00 H new ATOM 0 HD2 PHE A 102 7.306 -12.492 -8.515 1.00 0.00 H new ATOM 0 HE1 PHE A 102 11.888 -11.937 -6.816 1.00 0.00 H new ATOM 0 HE2 PHE A 102 8.603 -10.495 -9.118 1.00 0.00 H new ATOM 0 HZ PHE A 102 10.898 -10.213 -8.266 1.00 0.00 H new ATOM 1683 N HIS A 103 6.867 -13.120 -4.141 1.00 0.00 N ATOM 1684 CA HIS A 103 5.725 -12.441 -3.539 1.00 0.00 C ATOM 1685 C HIS A 103 5.119 -11.432 -4.510 1.00 0.00 C ATOM 1686 O HIS A 103 5.797 -10.514 -4.972 1.00 0.00 O ATOM 1687 CB HIS A 103 6.147 -11.735 -2.250 1.00 0.00 C ATOM 1688 CG HIS A 103 6.354 -12.667 -1.097 1.00 0.00 C ATOM 1689 ND1 HIS A 103 7.512 -12.695 -0.350 1.00 0.00 N ATOM 1690 CD2 HIS A 103 5.541 -13.610 -0.563 1.00 0.00 C ATOM 1691 CE1 HIS A 103 7.403 -13.614 0.594 1.00 0.00 C ATOM 1692 NE2 HIS A 103 6.217 -14.182 0.486 1.00 0.00 N ATOM 0 H HIS A 103 7.768 -12.685 -3.945 1.00 0.00 H new ATOM 0 HA HIS A 103 4.970 -13.191 -3.304 1.00 0.00 H new ATOM 0 HB2 HIS A 103 7.070 -11.185 -2.432 1.00 0.00 H new ATOM 0 HB3 HIS A 103 5.387 -11.001 -1.982 1.00 0.00 H new ATOM 0 HD1 HIS A 103 8.326 -12.100 -0.502 1.00 0.00 H new ATOM 0 HD2 HIS A 103 4.547 -13.864 -0.900 1.00 0.00 H new ATOM 0 HE1 HIS A 103 8.156 -13.858 1.328 1.00 0.00 H new ATOM 1701 N LEU A 104 3.838 -11.609 -4.815 1.00 0.00 N ATOM 1702 CA LEU A 104 3.140 -10.714 -5.730 1.00 0.00 C ATOM 1703 C LEU A 104 1.656 -10.632 -5.387 1.00 0.00 C ATOM 1704 O LEU A 104 0.948 -11.639 -5.403 1.00 0.00 O ATOM 1705 CB LEU A 104 3.315 -11.189 -7.174 1.00 0.00 C ATOM 1706 CG LEU A 104 3.410 -10.074 -8.216 1.00 0.00 C ATOM 1707 CD1 LEU A 104 4.073 -10.585 -9.486 1.00 0.00 C ATOM 1708 CD2 LEU A 104 2.030 -9.512 -8.522 1.00 0.00 C ATOM 0 H LEU A 104 3.262 -12.364 -4.442 1.00 0.00 H new ATOM 0 HA LEU A 104 3.574 -9.719 -5.626 1.00 0.00 H new ATOM 0 HB2 LEU A 104 4.217 -11.798 -7.233 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.476 -11.836 -7.432 1.00 0.00 H new ATOM 0 HG LEU A 104 4.025 -9.272 -7.807 1.00 0.00 H new ATOM 0 HD11 LEU A 104 4.132 -9.778 -10.216 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.078 -10.939 -9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 104 3.485 -11.405 -9.899 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.117 -8.720 -9.265 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.392 -10.306 -8.910 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.591 -9.107 -7.610 1.00 0.00 H new ATOM 1720 N GLY A 105 1.192 -9.426 -5.076 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.204 -9.234 -4.733 1.00 0.00 C ATOM 1722 C GLY A 105 -0.683 -7.825 -5.018 1.00 0.00 C ATOM 1723 O GLY A 105 0.097 -6.970 -5.439 1.00 0.00 O ATOM 0 H GLY A 105 1.759 -8.578 -5.056 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -0.813 -9.942 -5.295 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -0.349 -9.457 -3.676 1.00 0.00 H new ATOM 1727 N LEU A 106 -1.970 -7.580 -4.788 1.00 0.00 N ATOM 1728 CA LEU A 106 -2.551 -6.263 -5.025 1.00 0.00 C ATOM 1729 C LEU A 106 -3.679 -5.982 -4.037 1.00 0.00 C ATOM 1730 O LEU A 106 -4.498 -6.854 -3.750 1.00 0.00 O ATOM 1731 CB LEU A 106 -3.075 -6.163 -6.458 1.00 0.00 C ATOM 1732 CG LEU A 106 -2.922 -4.787 -7.109 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -2.697 -4.928 -8.606 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -4.145 -3.928 -6.830 1.00 0.00 C ATOM 0 H LEU A 106 -2.629 -8.275 -4.438 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.770 -5.517 -4.880 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.554 -6.898 -7.071 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.131 -6.435 -6.462 1.00 0.00 H new ATOM 0 HG LEU A 106 -2.051 -4.295 -6.676 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.590 -3.939 -9.053 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -1.791 -5.507 -8.785 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.548 -5.439 -9.055 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.020 -2.953 -7.300 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -5.032 -4.415 -7.236 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -4.262 -3.800 -5.754 1.00 0.00 H new ATOM 1746 N GLY A 107 -3.714 -4.757 -3.522 1.00 0.00 N ATOM 1747 CA GLY A 107 -4.746 -4.381 -2.573 1.00 0.00 C ATOM 1748 C GLY A 107 -4.922 -2.879 -2.471 1.00 0.00 C ATOM 1749 O GLY A 107 -3.978 -2.120 -2.698 1.00 0.00 O ATOM 0 H GLY A 107 -3.047 -4.018 -3.745 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -5.691 -4.835 -2.870 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.495 -4.782 -1.591 1.00 0.00 H new ATOM 1753 N PHE A 108 -6.132 -2.449 -2.130 1.00 0.00 N ATOM 1754 CA PHE A 108 -6.429 -1.027 -1.999 1.00 0.00 C ATOM 1755 C PHE A 108 -6.451 -0.609 -0.533 1.00 0.00 C ATOM 1756 O PHE A 108 -6.938 -1.347 0.326 1.00 0.00 O ATOM 1757 CB PHE A 108 -7.772 -0.702 -2.655 1.00 0.00 C ATOM 1758 CG PHE A 108 -7.770 -0.882 -4.146 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -7.541 -2.129 -4.707 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -7.998 0.196 -4.987 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -7.538 -2.297 -6.079 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -7.997 0.033 -6.360 1.00 0.00 C ATOM 1763 CZ PHE A 108 -7.767 -1.215 -6.906 1.00 0.00 C ATOM 0 H PHE A 108 -6.923 -3.064 -1.939 1.00 0.00 H new ATOM 0 HA PHE A 108 -5.642 -0.469 -2.505 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -8.543 -1.339 -2.221 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.041 0.328 -2.422 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.363 -2.979 -4.065 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.178 1.174 -4.565 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -7.357 -3.273 -6.504 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -8.176 0.881 -7.005 1.00 0.00 H new ATOM 0 HZ PHE A 108 -7.766 -1.344 -7.978 1.00 0.00 H new ATOM 1773 N THR A 109 -5.922 0.578 -0.251 1.00 0.00 N ATOM 1774 CA THR A 109 -5.882 1.093 1.112 1.00 0.00 C ATOM 1775 C THR A 109 -6.473 2.497 1.181 1.00 0.00 C ATOM 1776 O THR A 109 -5.999 3.414 0.510 1.00 0.00 O ATOM 1777 CB THR A 109 -4.445 1.105 1.633 1.00 0.00 C ATOM 1778 OG1 THR A 109 -3.690 0.060 1.046 1.00 0.00 O ATOM 1779 CG2 THR A 109 -4.351 0.951 3.136 1.00 0.00 C ATOM 0 H THR A 109 -5.515 1.201 -0.949 1.00 0.00 H new ATOM 0 HA THR A 109 -6.483 0.435 1.740 1.00 0.00 H new ATOM 0 HB THR A 109 -4.047 2.082 1.359 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.994 -0.232 1.671 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.304 0.968 3.439 1.00 0.00 H new ATOM 0 HG22 THR A 109 -4.882 1.771 3.620 1.00 0.00 H new ATOM 0 HG23 THR A 109 -4.799 0.003 3.433 1.00 0.00 H new ATOM 1787 N ALA A 110 -7.509 2.659 1.997 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.164 3.951 2.154 1.00 0.00 C ATOM 1789 C ALA A 110 -7.720 4.639 3.441 1.00 0.00 C ATOM 1790 O ALA A 110 -8.002 4.163 4.540 1.00 0.00 O ATOM 1791 CB ALA A 110 -9.676 3.781 2.140 1.00 0.00 C ATOM 0 H ALA A 110 -7.913 1.911 2.560 1.00 0.00 H new ATOM 0 HA ALA A 110 -7.872 4.583 1.315 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.153 4.754 2.258 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -9.984 3.339 1.192 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -9.976 3.128 2.959 1.00 0.00 H new ATOM 1797 N GLY A 111 -7.022 5.760 3.295 1.00 0.00 N ATOM 1798 CA GLY A 111 -6.548 6.494 4.454 1.00 0.00 C ATOM 1799 C GLY A 111 -7.495 7.605 4.863 1.00 0.00 C ATOM 1800 O GLY A 111 -8.078 8.277 4.013 1.00 0.00 O ATOM 0 H GLY A 111 -6.776 6.173 2.396 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.419 5.805 5.289 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -5.568 6.918 4.236 1.00 0.00 H new ATOM 1804 N VAL A 112 -7.648 7.799 6.169 1.00 0.00 N ATOM 1805 CA VAL A 112 -8.530 8.836 6.689 1.00 0.00 C ATOM 1806 C VAL A 112 -7.817 9.690 7.732 1.00 0.00 C ATOM 1807 O VAL A 112 -7.310 9.176 8.729 1.00 0.00 O ATOM 1808 CB VAL A 112 -9.798 8.230 7.320 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -10.795 9.324 7.671 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -10.425 7.208 6.383 1.00 0.00 C ATOM 0 H VAL A 112 -7.172 7.251 6.886 1.00 0.00 H new ATOM 0 HA VAL A 112 -8.817 9.461 5.844 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.515 7.719 8.240 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -11.684 8.877 8.116 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -10.342 10.015 8.382 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -11.074 9.865 6.767 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -11.319 6.791 6.846 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -10.694 7.692 5.444 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -9.711 6.408 6.187 1.00 0.00 H new ATOM 1820 N THR A 113 -7.784 10.997 7.495 1.00 0.00 N ATOM 1821 CA THR A 113 -7.132 11.925 8.413 1.00 0.00 C ATOM 1822 C THR A 113 -8.144 12.893 9.017 1.00 0.00 C ATOM 1823 O THR A 113 -9.026 13.398 8.324 1.00 0.00 O ATOM 1824 CB THR A 113 -6.032 12.703 7.691 1.00 0.00 C ATOM 1825 OG1 THR A 113 -5.287 11.848 6.843 1.00 0.00 O ATOM 1826 CG2 THR A 113 -5.059 13.377 8.633 1.00 0.00 C ATOM 0 H THR A 113 -8.201 11.438 6.675 1.00 0.00 H new ATOM 0 HA THR A 113 -6.685 11.344 9.220 1.00 0.00 H new ATOM 0 HB THR A 113 -6.551 13.472 7.119 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.589 12.365 6.389 1.00 0.00 H new ATOM 0 HG21 THR A 113 -4.305 13.911 8.056 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.596 14.081 9.268 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.574 12.625 9.255 1.00 0.00 H new ATOM 1834 N ALA A 114 -8.008 13.147 10.315 1.00 0.00 N ATOM 1835 CA ALA A 114 -8.909 14.056 11.014 1.00 0.00 C ATOM 1836 C ALA A 114 -8.179 14.804 12.125 1.00 0.00 C ATOM 1837 O ALA A 114 -7.528 14.194 12.973 1.00 0.00 O ATOM 1838 CB ALA A 114 -10.094 13.290 11.581 1.00 0.00 C ATOM 0 H ALA A 114 -7.283 12.736 10.903 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.275 14.790 10.297 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -10.759 13.980 12.100 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -10.636 12.806 10.769 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -9.737 12.534 12.281 1.00 0.00 H new ATOM 1844 N ARG A 115 -8.293 16.128 12.113 1.00 0.00 N ATOM 1845 CA ARG A 115 -7.643 16.960 13.119 1.00 0.00 C ATOM 1846 C ARG A 115 -8.676 17.732 13.937 1.00 0.00 C ATOM 1847 O ARG A 115 -9.644 18.261 13.392 1.00 0.00 O ATOM 1848 CB ARG A 115 -6.671 17.935 12.454 1.00 0.00 C ATOM 1849 CG ARG A 115 -7.289 18.726 11.312 1.00 0.00 C ATOM 1850 CD ARG A 115 -6.281 19.674 10.682 1.00 0.00 C ATOM 1851 NE ARG A 115 -6.442 19.759 9.233 1.00 0.00 N ATOM 1852 CZ ARG A 115 -7.393 20.470 8.633 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -8.271 21.159 9.352 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -7.469 20.494 7.308 1.00 0.00 N ATOM 0 H ARG A 115 -8.829 16.648 11.418 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.088 16.306 13.792 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -6.296 18.630 13.205 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -5.813 17.379 12.077 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -7.667 18.039 10.555 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -8.143 19.294 11.681 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -6.395 20.666 11.118 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -5.271 19.337 10.915 1.00 0.00 H new ATOM 0 HE ARG A 115 -5.787 19.243 8.646 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -8.219 21.145 10.371 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -8.998 21.702 8.886 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -6.798 19.967 6.749 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -8.198 21.039 6.849 1.00 0.00 H new ATOM 1868 N ASP A 116 -8.460 17.790 15.247 1.00 0.00 N ATOM 1869 CA ASP A 116 -9.371 18.497 16.140 1.00 0.00 C ATOM 1870 C ASP A 116 -10.772 17.897 16.076 1.00 0.00 C ATOM 1871 O ASP A 116 -11.111 17.188 15.129 1.00 0.00 O ATOM 1872 CB ASP A 116 -9.421 19.982 15.780 1.00 0.00 C ATOM 1873 CG ASP A 116 -9.557 20.870 17.001 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -10.539 20.698 17.754 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -8.681 21.736 17.206 1.00 0.00 O ATOM 0 H ASP A 116 -7.663 17.357 15.713 1.00 0.00 H new ATOM 0 HA ASP A 116 -8.997 18.390 17.158 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -8.515 20.252 15.237 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -10.260 20.162 15.108 1.00 0.00 H new ATOM 1881 N ASN A 117 -11.581 18.188 17.088 1.00 0.00 N ATOM 1882 CA ASN A 117 -12.946 17.679 17.146 1.00 0.00 C ATOM 1883 C ASN A 117 -13.955 18.785 16.850 1.00 0.00 C ATOM 1884 O ASN A 117 -15.046 18.524 16.342 1.00 0.00 O ATOM 1885 CB ASN A 117 -13.228 17.071 18.521 1.00 0.00 C ATOM 1886 CG ASN A 117 -14.531 16.296 18.555 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -15.024 15.843 17.521 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -15.098 16.141 19.746 1.00 0.00 N ATOM 0 H ASN A 117 -11.315 18.774 17.880 1.00 0.00 H new ATOM 0 HA ASN A 117 -13.050 16.905 16.385 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -12.407 16.409 18.798 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -13.262 17.866 19.266 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -15.977 15.630 19.830 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -14.655 16.533 20.577 1.00 0.00 H new ATOM 1895 N TRP A 118 -13.584 20.021 17.171 1.00 0.00 N ATOM 1896 CA TRP A 118 -14.457 21.166 16.939 1.00 0.00 C ATOM 1897 C TRP A 118 -14.843 21.269 15.467 1.00 0.00 C ATOM 1898 O TRP A 118 -16.018 21.410 15.131 1.00 0.00 O ATOM 1899 CB TRP A 118 -13.769 22.457 17.392 1.00 0.00 C ATOM 1900 CG TRP A 118 -14.666 23.363 18.179 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -16.013 23.522 18.021 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -14.281 24.237 19.246 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -16.488 24.441 18.925 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -15.444 24.894 19.689 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -13.064 24.526 19.871 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -15.426 25.823 20.726 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -13.047 25.448 20.901 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -14.222 26.086 21.320 1.00 0.00 C ATOM 0 H TRP A 118 -12.685 20.255 17.592 1.00 0.00 H new ATOM 0 HA TRP A 118 -15.366 21.022 17.523 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -12.899 22.203 17.998 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -13.403 22.992 16.516 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -16.617 23.002 17.292 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -17.460 24.738 19.013 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -12.154 24.038 19.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -16.330 26.318 21.050 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -12.113 25.680 21.391 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -14.176 26.800 22.129 1.00 0.00 H new ATOM 1919 N ASN A 119 -13.844 21.197 14.592 1.00 0.00 N ATOM 1920 CA ASN A 119 -14.079 21.281 13.156 1.00 0.00 C ATOM 1921 C ASN A 119 -14.581 19.948 12.609 1.00 0.00 C ATOM 1922 O ASN A 119 -15.631 19.886 11.968 1.00 0.00 O ATOM 1923 CB ASN A 119 -12.795 21.690 12.431 1.00 0.00 C ATOM 1924 CG ASN A 119 -13.064 22.614 11.258 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -14.089 23.292 11.210 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -12.140 22.642 10.305 1.00 0.00 N ATOM 0 H ASN A 119 -12.865 21.081 14.853 1.00 0.00 H new ATOM 0 HA ASN A 119 -14.844 22.038 12.982 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -12.126 22.185 13.134 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -12.281 20.797 12.076 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -12.265 23.243 9.491 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -11.305 22.062 10.387 1.00 0.00 H new ATOM 1933 N TYR A 120 -13.827 18.886 12.867 1.00 0.00 N ATOM 1934 CA TYR A 120 -14.196 17.553 12.402 1.00 0.00 C ATOM 1935 C TYR A 120 -14.305 17.517 10.881 1.00 0.00 C ATOM 1936 O TYR A 120 -15.394 17.659 10.324 1.00 0.00 O ATOM 1937 CB TYR A 120 -15.523 17.122 13.031 1.00 0.00 C ATOM 1938 CG TYR A 120 -15.781 15.635 12.939 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -16.191 15.055 11.745 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -15.618 14.812 14.046 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -16.431 13.697 11.657 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -15.854 13.453 13.966 1.00 0.00 C ATOM 1943 CZ TYR A 120 -16.260 12.900 12.770 1.00 0.00 C ATOM 1944 OH TYR A 120 -16.496 11.547 12.686 1.00 0.00 O ATOM 0 H TYR A 120 -12.956 18.921 13.396 1.00 0.00 H new ATOM 0 HA TYR A 120 -13.413 16.859 12.707 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -15.532 17.420 14.079 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -16.338 17.655 12.541 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -16.324 15.676 10.871 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -15.301 15.242 14.985 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -16.751 13.262 10.722 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -15.721 12.827 14.836 1.00 0.00 H new ATOM 0 HH TYR A 120 -16.328 11.131 13.557 1.00 0.00 H new ATOM 1954 N ILE A 121 -13.171 17.329 10.215 1.00 0.00 N ATOM 1955 CA ILE A 121 -13.140 17.275 8.759 1.00 0.00 C ATOM 1956 C ILE A 121 -12.408 16.027 8.268 1.00 0.00 C ATOM 1957 O ILE A 121 -11.187 16.035 8.116 1.00 0.00 O ATOM 1958 CB ILE A 121 -12.455 18.521 8.166 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -13.033 19.793 8.789 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -12.618 18.545 6.653 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -14.494 20.016 8.466 1.00 0.00 C ATOM 0 H ILE A 121 -12.261 17.211 10.661 1.00 0.00 H new ATOM 0 HA ILE A 121 -14.176 17.242 8.423 1.00 0.00 H new ATOM 0 HB ILE A 121 -11.391 18.477 8.397 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -12.912 19.745 9.871 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -12.458 20.651 8.442 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -12.129 19.431 6.248 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -12.164 17.652 6.224 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -13.678 18.569 6.402 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.835 20.936 8.941 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -14.620 20.097 7.386 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.081 19.176 8.838 1.00 0.00 H new ATOM 1973 N PRO A 122 -13.149 14.933 8.014 1.00 0.00 N ATOM 1974 CA PRO A 122 -12.561 13.676 7.538 1.00 0.00 C ATOM 1975 C PRO A 122 -11.783 13.858 6.240 1.00 0.00 C ATOM 1976 O PRO A 122 -12.120 14.709 5.416 1.00 0.00 O ATOM 1977 CB PRO A 122 -13.776 12.771 7.309 1.00 0.00 C ATOM 1978 CG PRO A 122 -14.856 13.354 8.153 1.00 0.00 C ATOM 1979 CD PRO A 122 -14.611 14.836 8.169 1.00 0.00 C ATOM 0 HA PRO A 122 -11.842 13.270 8.250 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -14.063 12.754 6.258 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -13.562 11.742 7.598 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -15.839 13.125 7.742 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -14.828 12.943 9.162 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -15.137 15.341 7.359 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -14.949 15.291 9.100 1.00 0.00 H new ATOM 1987 N LEU A 123 -10.740 13.054 6.061 1.00 0.00 N ATOM 1988 CA LEU A 123 -9.915 13.128 4.861 1.00 0.00 C ATOM 1989 C LEU A 123 -9.768 11.752 4.215 1.00 0.00 C ATOM 1990 O LEU A 123 -8.722 11.111 4.329 1.00 0.00 O ATOM 1991 CB LEU A 123 -8.535 13.697 5.200 1.00 0.00 C ATOM 1992 CG LEU A 123 -8.426 15.220 5.123 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -7.128 15.696 5.757 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -8.518 15.687 3.678 1.00 0.00 C ATOM 0 H LEU A 123 -10.446 12.344 6.732 1.00 0.00 H new ATOM 0 HA LEU A 123 -10.409 13.791 4.151 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.265 13.379 6.207 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.802 13.261 4.521 1.00 0.00 H new ATOM 0 HG LEU A 123 -9.257 15.653 5.679 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -7.069 16.782 5.692 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -7.102 15.393 6.804 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.282 15.254 5.230 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -8.439 16.773 3.641 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -7.707 15.244 3.100 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -9.475 15.378 3.256 1.00 0.00 H new ATOM 2006 N PRO A 124 -10.819 11.279 3.524 1.00 0.00 N ATOM 2007 CA PRO A 124 -10.806 9.975 2.858 1.00 0.00 C ATOM 2008 C PRO A 124 -10.047 10.007 1.536 1.00 0.00 C ATOM 2009 O PRO A 124 -10.225 10.921 0.731 1.00 0.00 O ATOM 2010 CB PRO A 124 -12.288 9.698 2.619 1.00 0.00 C ATOM 2011 CG PRO A 124 -12.898 11.047 2.456 1.00 0.00 C ATOM 2012 CD PRO A 124 -12.107 11.978 3.340 1.00 0.00 C ATOM 0 HA PRO A 124 -10.303 9.212 3.452 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.439 9.084 1.731 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -12.732 9.160 3.457 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -12.856 11.370 1.416 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -13.949 11.036 2.745 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -11.970 12.953 2.873 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -12.609 12.149 4.292 1.00 0.00 H new ATOM 2020 N VAL A 125 -9.202 9.006 1.317 1.00 0.00 N ATOM 2021 CA VAL A 125 -8.419 8.921 0.091 1.00 0.00 C ATOM 2022 C VAL A 125 -8.048 7.477 -0.227 1.00 0.00 C ATOM 2023 O VAL A 125 -7.511 6.762 0.619 1.00 0.00 O ATOM 2024 CB VAL A 125 -7.131 9.760 0.187 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -7.458 11.245 0.192 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -6.336 9.378 1.428 1.00 0.00 C ATOM 0 H VAL A 125 -9.042 8.242 1.973 1.00 0.00 H new ATOM 0 HA VAL A 125 -9.044 9.317 -0.710 1.00 0.00 H new ATOM 0 HB VAL A 125 -6.518 9.550 -0.689 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -6.535 11.821 0.260 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -7.981 11.506 -0.728 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -8.093 11.475 1.048 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -5.429 9.981 1.479 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -6.941 9.556 2.317 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.068 8.323 1.378 1.00 0.00 H new ATOM 2036 N LEU A 126 -8.338 7.054 -1.453 1.00 0.00 N ATOM 2037 CA LEU A 126 -8.034 5.695 -1.884 1.00 0.00 C ATOM 2038 C LEU A 126 -6.673 5.637 -2.570 1.00 0.00 C ATOM 2039 O LEU A 126 -6.413 6.376 -3.520 1.00 0.00 O ATOM 2040 CB LEU A 126 -9.123 5.183 -2.831 1.00 0.00 C ATOM 2041 CG LEU A 126 -9.805 3.886 -2.392 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -8.772 2.801 -2.130 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -10.655 4.125 -1.153 1.00 0.00 C ATOM 0 H LEU A 126 -8.783 7.633 -2.165 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.003 5.056 -1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -9.883 5.957 -2.938 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -8.683 5.029 -3.816 1.00 0.00 H new ATOM 0 HG LEU A 126 -10.457 3.550 -3.198 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -9.276 1.886 -1.819 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -8.205 2.611 -3.041 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -8.093 3.127 -1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -11.133 3.192 -0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -10.022 4.485 -0.342 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -11.420 4.870 -1.374 1.00 0.00 H new ATOM 2055 N LEU A 127 -5.806 4.755 -2.083 1.00 0.00 N ATOM 2056 CA LEU A 127 -4.471 4.604 -2.650 1.00 0.00 C ATOM 2057 C LEU A 127 -4.172 3.137 -2.960 1.00 0.00 C ATOM 2058 O LEU A 127 -3.820 2.366 -2.068 1.00 0.00 O ATOM 2059 CB LEU A 127 -3.421 5.159 -1.685 1.00 0.00 C ATOM 2060 CG LEU A 127 -2.437 6.154 -2.303 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -1.733 5.534 -3.500 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -3.156 7.432 -2.708 1.00 0.00 C ATOM 0 H LEU A 127 -6.004 4.135 -1.298 1.00 0.00 H new ATOM 0 HA LEU A 127 -4.432 5.167 -3.582 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.933 5.646 -0.855 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -2.857 4.325 -1.267 1.00 0.00 H new ATOM 0 HG LEU A 127 -1.685 6.405 -1.555 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -1.037 6.256 -3.927 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.186 4.647 -3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -2.471 5.254 -4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -2.441 8.129 -3.146 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -3.929 7.198 -3.440 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.614 7.886 -1.829 1.00 0.00 H new ATOM 2074 N PRO A 128 -4.309 2.729 -4.235 1.00 0.00 N ATOM 2075 CA PRO A 128 -4.048 1.349 -4.653 1.00 0.00 C ATOM 2076 C PRO A 128 -2.558 1.028 -4.695 1.00 0.00 C ATOM 2077 O PRO A 128 -1.760 1.808 -5.213 1.00 0.00 O ATOM 2078 CB PRO A 128 -4.648 1.288 -6.057 1.00 0.00 C ATOM 2079 CG PRO A 128 -4.549 2.685 -6.566 1.00 0.00 C ATOM 2080 CD PRO A 128 -4.725 3.579 -5.369 1.00 0.00 C ATOM 0 HA PRO A 128 -4.474 0.624 -3.960 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -4.099 0.594 -6.693 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -5.683 0.947 -6.032 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -3.585 2.858 -7.043 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -5.316 2.882 -7.315 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -4.110 4.476 -5.445 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -5.758 3.909 -5.264 1.00 0.00 H new ATOM 2088 N LEU A 129 -2.190 -0.124 -4.145 1.00 0.00 N ATOM 2089 CA LEU A 129 -0.794 -0.547 -4.120 1.00 0.00 C ATOM 2090 C LEU A 129 -0.675 -2.050 -4.351 1.00 0.00 C ATOM 2091 O LEU A 129 -1.647 -2.790 -4.197 1.00 0.00 O ATOM 2092 CB LEU A 129 -0.151 -0.172 -2.783 1.00 0.00 C ATOM 2093 CG LEU A 129 -1.023 -0.421 -1.552 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -0.967 -1.886 -1.147 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -0.585 0.470 -0.399 1.00 0.00 C ATOM 0 H LEU A 129 -2.838 -0.781 -3.711 1.00 0.00 H new ATOM 0 HA LEU A 129 -0.270 -0.033 -4.926 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.776 -0.735 -2.673 1.00 0.00 H new ATOM 0 HB3 LEU A 129 0.119 0.884 -2.811 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.054 -0.174 -1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -1.593 -2.045 -0.269 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.329 -2.505 -1.968 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.062 -2.160 -0.913 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.217 0.279 0.469 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.453 0.254 -0.146 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.677 1.516 -0.692 1.00 0.00 H new ATOM 2107 N ALA A 130 0.522 -2.494 -4.721 1.00 0.00 N ATOM 2108 CA ALA A 130 0.769 -3.909 -4.972 1.00 0.00 C ATOM 2109 C ALA A 130 1.987 -4.399 -4.198 1.00 0.00 C ATOM 2110 O ALA A 130 3.063 -3.807 -4.275 1.00 0.00 O ATOM 2111 CB ALA A 130 0.953 -4.154 -6.462 1.00 0.00 C ATOM 0 H ALA A 130 1.336 -1.894 -4.854 1.00 0.00 H new ATOM 0 HA ALA A 130 -0.098 -4.472 -4.626 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.137 -5.214 -6.636 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.052 -3.849 -6.995 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.802 -3.574 -6.824 1.00 0.00 H new ATOM 2117 N SER A 131 1.809 -5.483 -3.450 1.00 0.00 N ATOM 2118 CA SER A 131 2.894 -6.054 -2.660 1.00 0.00 C ATOM 2119 C SER A 131 3.793 -6.934 -3.522 1.00 0.00 C ATOM 2120 O SER A 131 3.348 -7.942 -4.072 1.00 0.00 O ATOM 2121 CB SER A 131 2.330 -6.867 -1.495 1.00 0.00 C ATOM 2122 OG SER A 131 3.127 -6.714 -0.333 1.00 0.00 O ATOM 0 H SER A 131 0.924 -5.984 -3.374 1.00 0.00 H new ATOM 0 HA SER A 131 3.493 -5.233 -2.266 1.00 0.00 H new ATOM 0 HB2 SER A 131 1.310 -6.547 -1.285 1.00 0.00 H new ATOM 0 HB3 SER A 131 2.283 -7.920 -1.772 1.00 0.00 H new ATOM 0 HG SER A 131 3.339 -7.596 0.037 1.00 0.00 H new ATOM 2128 N VAL A 132 5.059 -6.547 -3.637 1.00 0.00 N ATOM 2129 CA VAL A 132 6.020 -7.301 -4.431 1.00 0.00 C ATOM 2130 C VAL A 132 7.403 -7.279 -3.787 1.00 0.00 C ATOM 2131 O VAL A 132 7.946 -6.213 -3.497 1.00 0.00 O ATOM 2132 CB VAL A 132 6.125 -6.746 -5.863 1.00 0.00 C ATOM 2133 CG1 VAL A 132 4.868 -7.069 -6.656 1.00 0.00 C ATOM 2134 CG2 VAL A 132 6.377 -5.246 -5.837 1.00 0.00 C ATOM 0 H VAL A 132 5.443 -5.715 -3.190 1.00 0.00 H new ATOM 0 HA VAL A 132 5.657 -8.328 -4.473 1.00 0.00 H new ATOM 0 HB VAL A 132 6.970 -7.225 -6.357 1.00 0.00 H new ATOM 0 HG11 VAL A 132 4.962 -6.668 -7.665 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.737 -8.150 -6.705 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.004 -6.620 -6.166 1.00 0.00 H new ATOM 0 HG21 VAL A 132 6.448 -4.871 -6.858 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.554 -4.748 -5.324 1.00 0.00 H new ATOM 0 HG23 VAL A 132 7.309 -5.043 -5.310 1.00 0.00 H new ATOM 2144 N GLY A 133 7.966 -8.462 -3.566 1.00 0.00 N ATOM 2145 CA GLY A 133 9.280 -8.554 -2.958 1.00 0.00 C ATOM 2146 C GLY A 133 9.699 -9.987 -2.695 1.00 0.00 C ATOM 2147 O GLY A 133 9.132 -10.921 -3.263 1.00 0.00 O ATOM 0 H GLY A 133 7.536 -9.358 -3.797 1.00 0.00 H new ATOM 0 HA2 GLY A 133 10.013 -8.079 -3.610 1.00 0.00 H new ATOM 0 HA3 GLY A 133 9.282 -8.000 -2.019 1.00 0.00 H new ATOM 2151 N TYR A 134 10.694 -10.163 -1.832 1.00 0.00 N ATOM 2152 CA TYR A 134 11.188 -11.493 -1.496 1.00 0.00 C ATOM 2153 C TYR A 134 11.640 -11.555 -0.039 1.00 0.00 C ATOM 2154 O TYR A 134 12.153 -10.577 0.506 1.00 0.00 O ATOM 2155 CB TYR A 134 12.346 -11.877 -2.417 1.00 0.00 C ATOM 2156 CG TYR A 134 12.887 -13.267 -2.164 1.00 0.00 C ATOM 2157 CD1 TYR A 134 12.048 -14.373 -2.182 1.00 0.00 C ATOM 2158 CD2 TYR A 134 14.237 -13.471 -1.908 1.00 0.00 C ATOM 2159 CE1 TYR A 134 12.538 -15.645 -1.950 1.00 0.00 C ATOM 2160 CE2 TYR A 134 14.735 -14.739 -1.676 1.00 0.00 C ATOM 2161 CZ TYR A 134 13.882 -15.822 -1.699 1.00 0.00 C ATOM 2162 OH TYR A 134 14.374 -17.085 -1.467 1.00 0.00 O ATOM 0 H TYR A 134 11.174 -9.401 -1.353 1.00 0.00 H new ATOM 0 HA TYR A 134 10.371 -12.202 -1.635 1.00 0.00 H new ATOM 0 HB2 TYR A 134 12.013 -11.809 -3.453 1.00 0.00 H new ATOM 0 HB3 TYR A 134 13.153 -11.154 -2.293 1.00 0.00 H new ATOM 0 HD1 TYR A 134 10.995 -14.238 -2.381 1.00 0.00 H new ATOM 0 HD2 TYR A 134 14.908 -12.625 -1.890 1.00 0.00 H new ATOM 0 HE1 TYR A 134 11.872 -16.495 -1.965 1.00 0.00 H new ATOM 0 HE2 TYR A 134 15.787 -14.881 -1.478 1.00 0.00 H new ATOM 0 HH TYR A 134 15.340 -17.036 -1.308 1.00 0.00 H new ATOM 2172 N GLY A 135 11.447 -12.713 0.584 1.00 0.00 N ATOM 2173 CA GLY A 135 11.840 -12.884 1.971 1.00 0.00 C ATOM 2174 C GLY A 135 11.186 -11.871 2.892 1.00 0.00 C ATOM 2175 O GLY A 135 10.076 -11.413 2.624 1.00 0.00 O ATOM 0 H GLY A 135 11.026 -13.536 0.153 1.00 0.00 H new ATOM 0 HA2 GLY A 135 11.577 -13.890 2.298 1.00 0.00 H new ATOM 0 HA3 GLY A 135 12.923 -12.796 2.051 1.00 0.00 H new ATOM 2179 N PRO A 136 11.857 -11.496 3.994 1.00 0.00 N ATOM 2180 CA PRO A 136 11.322 -10.524 4.953 1.00 0.00 C ATOM 2181 C PRO A 136 11.291 -9.104 4.392 1.00 0.00 C ATOM 2182 O PRO A 136 10.690 -8.208 4.983 1.00 0.00 O ATOM 2183 CB PRO A 136 12.296 -10.612 6.129 1.00 0.00 C ATOM 2184 CG PRO A 136 13.575 -11.081 5.527 1.00 0.00 C ATOM 2185 CD PRO A 136 13.189 -11.991 4.393 1.00 0.00 C ATOM 0 HA PRO A 136 10.288 -10.745 5.219 1.00 0.00 H new ATOM 0 HB2 PRO A 136 12.419 -9.644 6.615 1.00 0.00 H new ATOM 0 HB3 PRO A 136 11.938 -11.307 6.889 1.00 0.00 H new ATOM 0 HG2 PRO A 136 14.169 -10.240 5.168 1.00 0.00 H new ATOM 0 HG3 PRO A 136 14.182 -11.609 6.262 1.00 0.00 H new ATOM 0 HD2 PRO A 136 13.902 -11.933 3.571 1.00 0.00 H new ATOM 0 HD3 PRO A 136 13.152 -13.033 4.709 1.00 0.00 H new ATOM 2193 N VAL A 137 11.943 -8.903 3.249 1.00 0.00 N ATOM 2194 CA VAL A 137 11.984 -7.590 2.616 1.00 0.00 C ATOM 2195 C VAL A 137 11.005 -7.510 1.451 1.00 0.00 C ATOM 2196 O VAL A 137 11.088 -8.287 0.501 1.00 0.00 O ATOM 2197 CB VAL A 137 13.401 -7.249 2.113 1.00 0.00 C ATOM 2198 CG1 VAL A 137 14.382 -7.194 3.274 1.00 0.00 C ATOM 2199 CG2 VAL A 137 13.859 -8.255 1.066 1.00 0.00 C ATOM 0 H VAL A 137 12.448 -9.631 2.745 1.00 0.00 H new ATOM 0 HA VAL A 137 11.696 -6.864 3.377 1.00 0.00 H new ATOM 0 HB VAL A 137 13.370 -6.265 1.645 1.00 0.00 H new ATOM 0 HG11 VAL A 137 15.376 -6.952 2.899 1.00 0.00 H new ATOM 0 HG12 VAL A 137 14.065 -6.428 3.982 1.00 0.00 H new ATOM 0 HG13 VAL A 137 14.409 -8.162 3.774 1.00 0.00 H new ATOM 0 HG21 VAL A 137 14.861 -7.995 0.725 1.00 0.00 H new ATOM 0 HG22 VAL A 137 13.872 -9.254 1.502 1.00 0.00 H new ATOM 0 HG23 VAL A 137 13.172 -8.238 0.220 1.00 0.00 H new ATOM 2209 N THR A 138 10.074 -6.564 1.532 1.00 0.00 N ATOM 2210 CA THR A 138 9.077 -6.381 0.483 1.00 0.00 C ATOM 2211 C THR A 138 8.860 -4.901 0.191 1.00 0.00 C ATOM 2212 O THR A 138 8.972 -4.058 1.081 1.00 0.00 O ATOM 2213 CB THR A 138 7.754 -7.032 0.891 1.00 0.00 C ATOM 2214 OG1 THR A 138 7.982 -8.153 1.726 1.00 0.00 O ATOM 2215 CG2 THR A 138 6.930 -7.499 -0.290 1.00 0.00 C ATOM 0 H THR A 138 9.989 -5.913 2.313 1.00 0.00 H new ATOM 0 HA THR A 138 9.446 -6.861 -0.423 1.00 0.00 H new ATOM 0 HB THR A 138 7.200 -6.255 1.418 1.00 0.00 H new ATOM 0 HG1 THR A 138 7.420 -8.085 2.526 1.00 0.00 H new ATOM 0 HG21 THR A 138 6.005 -7.951 0.068 1.00 0.00 H new ATOM 0 HG22 THR A 138 6.694 -6.648 -0.929 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.496 -8.235 -0.861 1.00 0.00 H new ATOM 2223 N PHE A 139 8.547 -4.590 -1.064 1.00 0.00 N ATOM 2224 CA PHE A 139 8.314 -3.211 -1.474 1.00 0.00 C ATOM 2225 C PHE A 139 6.998 -3.086 -2.236 1.00 0.00 C ATOM 2226 O PHE A 139 6.732 -3.853 -3.163 1.00 0.00 O ATOM 2227 CB PHE A 139 9.470 -2.711 -2.342 1.00 0.00 C ATOM 2228 CG PHE A 139 9.799 -3.625 -3.489 1.00 0.00 C ATOM 2229 CD1 PHE A 139 10.457 -4.824 -3.269 1.00 0.00 C ATOM 2230 CD2 PHE A 139 9.451 -3.283 -4.786 1.00 0.00 C ATOM 2231 CE1 PHE A 139 10.762 -5.666 -4.321 1.00 0.00 C ATOM 2232 CE2 PHE A 139 9.753 -4.121 -5.842 1.00 0.00 C ATOM 2233 CZ PHE A 139 10.409 -5.315 -5.610 1.00 0.00 C ATOM 0 H PHE A 139 8.449 -5.275 -1.813 1.00 0.00 H new ATOM 0 HA PHE A 139 8.253 -2.597 -0.576 1.00 0.00 H new ATOM 0 HB2 PHE A 139 9.219 -1.725 -2.734 1.00 0.00 H new ATOM 0 HB3 PHE A 139 10.356 -2.590 -1.719 1.00 0.00 H new ATOM 0 HD1 PHE A 139 10.735 -5.104 -2.264 1.00 0.00 H new ATOM 0 HD2 PHE A 139 8.938 -2.351 -4.973 1.00 0.00 H new ATOM 0 HE1 PHE A 139 11.276 -6.598 -4.136 1.00 0.00 H new ATOM 0 HE2 PHE A 139 9.477 -3.843 -6.848 1.00 0.00 H new ATOM 0 HZ PHE A 139 10.645 -5.972 -6.434 1.00 0.00 H new ATOM 2243 N GLN A 140 6.180 -2.118 -1.840 1.00 0.00 N ATOM 2244 CA GLN A 140 4.892 -1.894 -2.487 1.00 0.00 C ATOM 2245 C GLN A 140 4.941 -0.662 -3.387 1.00 0.00 C ATOM 2246 O GLN A 140 5.592 0.330 -3.063 1.00 0.00 O ATOM 2247 CB GLN A 140 3.792 -1.728 -1.436 1.00 0.00 C ATOM 2248 CG GLN A 140 4.028 -0.564 -0.486 1.00 0.00 C ATOM 2249 CD GLN A 140 4.635 -1.003 0.832 1.00 0.00 C ATOM 2250 OE1 GLN A 140 5.830 -0.825 1.069 1.00 0.00 O ATOM 2251 NE2 GLN A 140 3.811 -1.580 1.700 1.00 0.00 N ATOM 0 H GLN A 140 6.385 -1.476 -1.075 1.00 0.00 H new ATOM 0 HA GLN A 140 4.668 -2.764 -3.104 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.837 -1.586 -1.941 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.712 -2.648 -0.857 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.688 0.161 -0.962 1.00 0.00 H new ATOM 0 HG3 GLN A 140 3.082 -0.057 -0.296 1.00 0.00 H new ATOM 0 HE21 GLN A 140 2.827 -1.708 1.462 1.00 0.00 H new ATOM 0 HE22 GLN A 140 4.162 -1.895 2.604 1.00 0.00 H new ATOM 2260 N MET A 141 4.248 -0.737 -4.519 1.00 0.00 N ATOM 2261 CA MET A 141 4.213 0.371 -5.467 1.00 0.00 C ATOM 2262 C MET A 141 2.822 0.995 -5.523 1.00 0.00 C ATOM 2263 O MET A 141 1.839 0.319 -5.829 1.00 0.00 O ATOM 2264 CB MET A 141 4.625 -0.109 -6.860 1.00 0.00 C ATOM 2265 CG MET A 141 5.997 -0.762 -6.898 1.00 0.00 C ATOM 2266 SD MET A 141 6.074 -2.155 -8.039 1.00 0.00 S ATOM 2267 CE MET A 141 5.744 -1.335 -9.597 1.00 0.00 C ATOM 0 H MET A 141 3.704 -1.552 -4.802 1.00 0.00 H new ATOM 0 HA MET A 141 4.919 1.129 -5.128 1.00 0.00 H new ATOM 0 HB2 MET A 141 3.883 -0.820 -7.224 1.00 0.00 H new ATOM 0 HB3 MET A 141 4.617 0.739 -7.545 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.740 -0.019 -7.188 1.00 0.00 H new ATOM 0 HG3 MET A 141 6.260 -1.103 -5.897 1.00 0.00 H new ATOM 0 HE1 MET A 141 5.863 -2.046 -10.415 1.00 0.00 H new ATOM 0 HE2 MET A 141 4.724 -0.950 -9.597 1.00 0.00 H new ATOM 0 HE3 MET A 141 6.444 -0.510 -9.729 1.00 0.00 H new ATOM 2277 N THR A 142 2.746 2.288 -5.225 1.00 0.00 N ATOM 2278 CA THR A 142 1.475 3.003 -5.242 1.00 0.00 C ATOM 2279 C THR A 142 1.313 3.795 -6.534 1.00 0.00 C ATOM 2280 O THR A 142 2.279 4.346 -7.062 1.00 0.00 O ATOM 2281 CB THR A 142 1.380 3.944 -4.039 1.00 0.00 C ATOM 2282 OG1 THR A 142 2.581 4.677 -3.880 1.00 0.00 O ATOM 2283 CG2 THR A 142 1.106 3.223 -2.736 1.00 0.00 C ATOM 0 H THR A 142 3.549 2.862 -4.969 1.00 0.00 H new ATOM 0 HA THR A 142 0.672 2.268 -5.185 1.00 0.00 H new ATOM 0 HB THR A 142 0.540 4.604 -4.254 1.00 0.00 H new ATOM 0 HG1 THR A 142 2.382 5.549 -3.479 1.00 0.00 H new ATOM 0 HG21 THR A 142 1.051 3.948 -1.924 1.00 0.00 H new ATOM 0 HG22 THR A 142 0.160 2.687 -2.809 1.00 0.00 H new ATOM 0 HG23 THR A 142 1.910 2.515 -2.536 1.00 0.00 H new ATOM 2291 N TYR A 143 0.085 3.847 -7.040 1.00 0.00 N ATOM 2292 CA TYR A 143 -0.205 4.571 -8.273 1.00 0.00 C ATOM 2293 C TYR A 143 -1.160 5.731 -8.012 1.00 0.00 C ATOM 2294 O TYR A 143 -2.274 5.534 -7.526 1.00 0.00 O ATOM 2295 CB TYR A 143 -0.805 3.625 -9.314 1.00 0.00 C ATOM 2296 CG TYR A 143 -0.712 4.144 -10.732 1.00 0.00 C ATOM 2297 CD1 TYR A 143 0.503 4.566 -11.258 1.00 0.00 C ATOM 2298 CD2 TYR A 143 -1.837 4.211 -11.544 1.00 0.00 C ATOM 2299 CE1 TYR A 143 0.593 5.042 -12.552 1.00 0.00 C ATOM 2300 CE2 TYR A 143 -1.755 4.684 -12.840 1.00 0.00 C ATOM 2301 CZ TYR A 143 -0.538 5.098 -13.338 1.00 0.00 C ATOM 2302 OH TYR A 143 -0.452 5.571 -14.628 1.00 0.00 O ATOM 0 H TYR A 143 -0.726 3.396 -6.615 1.00 0.00 H new ATOM 0 HA TYR A 143 0.732 4.976 -8.656 1.00 0.00 H new ATOM 0 HB2 TYR A 143 -0.296 2.663 -9.254 1.00 0.00 H new ATOM 0 HB3 TYR A 143 -1.852 3.447 -9.070 1.00 0.00 H new ATOM 0 HD1 TYR A 143 1.391 4.521 -10.645 1.00 0.00 H new ATOM 0 HD2 TYR A 143 -2.792 3.888 -11.156 1.00 0.00 H new ATOM 0 HE1 TYR A 143 1.544 5.368 -12.945 1.00 0.00 H new ATOM 0 HE2 TYR A 143 -2.639 4.729 -13.459 1.00 0.00 H new ATOM 0 HH TYR A 143 -1.338 5.544 -15.046 1.00 0.00 H new ATOM 2312 N ILE A 144 -0.716 6.940 -8.338 1.00 0.00 N ATOM 2313 CA ILE A 144 -1.532 8.133 -8.139 1.00 0.00 C ATOM 2314 C ILE A 144 -1.369 9.112 -9.301 1.00 0.00 C ATOM 2315 O ILE A 144 -0.392 9.858 -9.359 1.00 0.00 O ATOM 2316 CB ILE A 144 -1.164 8.852 -6.826 1.00 0.00 C ATOM 2317 CG1 ILE A 144 0.352 9.012 -6.711 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -1.714 8.086 -5.632 1.00 0.00 C ATOM 2319 CD1 ILE A 144 0.777 10.339 -6.122 1.00 0.00 C ATOM 0 H ILE A 144 0.204 7.120 -8.741 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.569 7.801 -8.087 1.00 0.00 H new ATOM 0 HB ILE A 144 -1.613 9.845 -6.835 1.00 0.00 H new ATOM 0 HG12 ILE A 144 0.748 8.206 -6.093 1.00 0.00 H new ATOM 0 HG13 ILE A 144 0.797 8.904 -7.700 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -1.446 8.605 -4.712 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -2.799 8.021 -5.710 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -1.291 7.082 -5.618 1.00 0.00 H new ATOM 0 HD11 ILE A 144 1.865 10.382 -6.070 1.00 0.00 H new ATOM 0 HD12 ILE A 144 0.411 11.150 -6.751 1.00 0.00 H new ATOM 0 HD13 ILE A 144 0.362 10.442 -5.119 1.00 0.00 H new ATOM 2331 N PRO A 145 -2.327 9.123 -10.246 1.00 0.00 N ATOM 2332 CA PRO A 145 -2.278 10.020 -11.406 1.00 0.00 C ATOM 2333 C PRO A 145 -2.517 11.475 -11.023 1.00 0.00 C ATOM 2334 O PRO A 145 -3.006 11.769 -9.931 1.00 0.00 O ATOM 2335 CB PRO A 145 -3.411 9.509 -12.298 1.00 0.00 C ATOM 2336 CG PRO A 145 -4.367 8.860 -11.358 1.00 0.00 C ATOM 2337 CD PRO A 145 -3.529 8.268 -10.259 1.00 0.00 C ATOM 0 HA PRO A 145 -1.300 10.010 -11.888 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -3.884 10.325 -12.844 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -3.042 8.801 -13.040 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -5.076 9.586 -10.960 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -4.949 8.089 -11.863 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -4.049 8.291 -9.301 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -3.279 7.227 -10.461 1.00 0.00 H new ATOM 2345 N GLY A 146 -2.168 12.385 -11.926 1.00 0.00 N ATOM 2346 CA GLY A 146 -2.351 13.800 -11.663 1.00 0.00 C ATOM 2347 C GLY A 146 -2.670 14.589 -12.919 1.00 0.00 C ATOM 2348 O GLY A 146 -3.121 14.024 -13.915 1.00 0.00 O ATOM 0 H GLY A 146 -1.761 12.168 -12.836 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -3.157 13.931 -10.941 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -1.446 14.201 -11.206 1.00 0.00 H new ATOM 2352 N THR A 147 -2.435 15.895 -12.871 1.00 0.00 N ATOM 2353 CA THR A 147 -2.700 16.762 -14.012 1.00 0.00 C ATOM 2354 C THR A 147 -1.461 16.897 -14.892 1.00 0.00 C ATOM 2355 O THR A 147 -0.739 17.891 -14.817 1.00 0.00 O ATOM 2356 CB THR A 147 -3.154 18.143 -13.537 1.00 0.00 C ATOM 2357 OG1 THR A 147 -4.020 18.029 -12.421 1.00 0.00 O ATOM 2358 CG2 THR A 147 -3.882 18.934 -14.602 1.00 0.00 C ATOM 0 H THR A 147 -2.061 16.377 -12.053 1.00 0.00 H new ATOM 0 HA THR A 147 -3.496 16.309 -14.602 1.00 0.00 H new ATOM 0 HB THR A 147 -2.238 18.673 -13.276 1.00 0.00 H new ATOM 0 HG1 THR A 147 -4.298 18.923 -12.130 1.00 0.00 H new ATOM 0 HG21 THR A 147 -4.176 19.903 -14.198 1.00 0.00 H new ATOM 0 HG22 THR A 147 -3.224 19.082 -15.459 1.00 0.00 H new ATOM 0 HG23 THR A 147 -4.771 18.388 -14.917 1.00 0.00 H new ATOM 2366 N TYR A 148 -1.222 15.890 -15.726 1.00 0.00 N ATOM 2367 CA TYR A 148 -0.070 15.896 -16.620 1.00 0.00 C ATOM 2368 C TYR A 148 -0.372 15.123 -17.900 1.00 0.00 C ATOM 2369 O TYR A 148 -1.451 14.550 -18.051 1.00 0.00 O ATOM 2370 CB TYR A 148 1.148 15.291 -15.920 1.00 0.00 C ATOM 2371 CG TYR A 148 2.464 15.881 -16.377 1.00 0.00 C ATOM 2372 CD1 TYR A 148 2.800 17.195 -16.077 1.00 0.00 C ATOM 2373 CD2 TYR A 148 3.371 15.122 -17.107 1.00 0.00 C ATOM 2374 CE1 TYR A 148 4.002 17.737 -16.492 1.00 0.00 C ATOM 2375 CE2 TYR A 148 4.575 15.657 -17.526 1.00 0.00 C ATOM 2376 CZ TYR A 148 4.885 16.964 -17.215 1.00 0.00 C ATOM 2377 OH TYR A 148 6.082 17.500 -17.630 1.00 0.00 O ATOM 0 H TYR A 148 -1.810 15.060 -15.801 1.00 0.00 H new ATOM 0 HA TYR A 148 0.149 16.931 -16.884 1.00 0.00 H new ATOM 0 HB2 TYR A 148 1.048 15.437 -14.844 1.00 0.00 H new ATOM 0 HB3 TYR A 148 1.161 14.215 -16.096 1.00 0.00 H new ATOM 0 HD1 TYR A 148 2.111 17.803 -15.510 1.00 0.00 H new ATOM 0 HD2 TYR A 148 3.131 14.098 -17.351 1.00 0.00 H new ATOM 0 HE1 TYR A 148 4.248 18.761 -16.251 1.00 0.00 H new ATOM 0 HE2 TYR A 148 5.269 15.055 -18.094 1.00 0.00 H new ATOM 0 HH TYR A 148 6.589 16.824 -18.127 1.00 0.00 H new ATOM 2387 N ASN A 149 0.588 15.113 -18.819 1.00 0.00 N ATOM 2388 CA ASN A 149 0.424 14.410 -20.087 1.00 0.00 C ATOM 2389 C ASN A 149 0.420 12.900 -19.876 1.00 0.00 C ATOM 2390 O ASN A 149 -0.469 12.199 -20.359 1.00 0.00 O ATOM 2391 CB ASN A 149 1.542 14.798 -21.057 1.00 0.00 C ATOM 2392 CG ASN A 149 1.742 16.299 -21.138 1.00 0.00 C ATOM 2393 OD1 ASN A 149 2.868 16.792 -21.069 1.00 0.00 O ATOM 2394 ND2 ASN A 149 0.646 17.034 -21.286 1.00 0.00 N ATOM 0 H ASN A 149 1.487 15.583 -18.710 1.00 0.00 H new ATOM 0 HA ASN A 149 -0.536 14.701 -20.514 1.00 0.00 H new ATOM 0 HB2 ASN A 149 2.473 14.327 -20.742 1.00 0.00 H new ATOM 0 HB3 ASN A 149 1.309 14.411 -22.049 1.00 0.00 H new ATOM 0 HD21 ASN A 149 0.717 18.050 -21.347 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -0.267 16.583 -21.339 1.00 0.00 H new ATOM 2401 N ASN A 150 1.418 12.405 -19.152 1.00 0.00 N ATOM 2402 CA ASN A 150 1.529 10.977 -18.876 1.00 0.00 C ATOM 2403 C ASN A 150 0.798 10.613 -17.589 1.00 0.00 C ATOM 2404 O ASN A 150 -0.223 9.927 -17.615 1.00 0.00 O ATOM 2405 CB ASN A 150 3.000 10.568 -18.776 1.00 0.00 C ATOM 2406 CG ASN A 150 3.264 9.204 -19.384 1.00 0.00 C ATOM 2407 OD1 ASN A 150 2.426 8.306 -19.310 1.00 0.00 O ATOM 2408 ND2 ASN A 150 4.434 9.043 -19.991 1.00 0.00 N ATOM 0 H ASN A 150 2.162 12.972 -18.745 1.00 0.00 H new ATOM 0 HA ASN A 150 1.065 10.436 -19.700 1.00 0.00 H new ATOM 0 HB2 ASN A 150 3.616 11.313 -19.280 1.00 0.00 H new ATOM 0 HB3 ASN A 150 3.302 10.560 -17.729 1.00 0.00 H new ATOM 0 HD21 ASN A 150 4.667 8.147 -20.420 1.00 0.00 H new ATOM 0 HD22 ASN A 150 5.099 9.815 -20.029 1.00 0.00 H new ATOM 2415 N GLY A 151 1.330 11.076 -16.462 1.00 0.00 N ATOM 2416 CA GLY A 151 0.715 10.788 -15.179 1.00 0.00 C ATOM 2417 C GLY A 151 0.872 9.337 -14.773 1.00 0.00 C ATOM 2418 O GLY A 151 -0.034 8.750 -14.181 1.00 0.00 O ATOM 0 H GLY A 151 2.175 11.645 -16.414 1.00 0.00 H new ATOM 0 HA2 GLY A 151 1.160 11.426 -14.415 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -0.345 11.037 -15.224 1.00 0.00 H new ATOM 2422 N ASN A 152 2.023 8.755 -15.093 1.00 0.00 N ATOM 2423 CA ASN A 152 2.296 7.361 -14.758 1.00 0.00 C ATOM 2424 C ASN A 152 3.377 7.260 -13.688 1.00 0.00 C ATOM 2425 O ASN A 152 4.198 6.343 -13.705 1.00 0.00 O ATOM 2426 CB ASN A 152 2.724 6.589 -16.007 1.00 0.00 C ATOM 2427 CG ASN A 152 3.979 7.161 -16.638 1.00 0.00 C ATOM 2428 OD1 ASN A 152 4.240 8.361 -16.552 1.00 0.00 O ATOM 2429 ND2 ASN A 152 4.764 6.301 -17.276 1.00 0.00 N ATOM 0 H ASN A 152 2.782 9.227 -15.584 1.00 0.00 H new ATOM 0 HA ASN A 152 1.379 6.922 -14.364 1.00 0.00 H new ATOM 0 HB2 ASN A 152 2.896 5.545 -15.745 1.00 0.00 H new ATOM 0 HB3 ASN A 152 1.914 6.605 -16.736 1.00 0.00 H new ATOM 0 HD21 ASN A 152 5.623 6.627 -17.720 1.00 0.00 H new ATOM 0 HD22 ASN A 152 4.508 5.315 -17.322 1.00 0.00 H new ATOM 2436 N VAL A 153 3.371 8.209 -12.756 1.00 0.00 N ATOM 2437 CA VAL A 153 4.351 8.226 -11.678 1.00 0.00 C ATOM 2438 C VAL A 153 3.995 7.213 -10.596 1.00 0.00 C ATOM 2439 O VAL A 153 2.856 7.162 -10.129 1.00 0.00 O ATOM 2440 CB VAL A 153 4.461 9.626 -11.039 1.00 0.00 C ATOM 2441 CG1 VAL A 153 5.595 9.665 -10.027 1.00 0.00 C ATOM 2442 CG2 VAL A 153 4.657 10.689 -12.110 1.00 0.00 C ATOM 0 H VAL A 153 2.698 8.975 -12.727 1.00 0.00 H new ATOM 0 HA VAL A 153 5.311 7.960 -12.120 1.00 0.00 H new ATOM 0 HB VAL A 153 3.529 9.838 -10.514 1.00 0.00 H new ATOM 0 HG11 VAL A 153 5.656 10.661 -9.587 1.00 0.00 H new ATOM 0 HG12 VAL A 153 5.407 8.933 -9.242 1.00 0.00 H new ATOM 0 HG13 VAL A 153 6.536 9.430 -10.525 1.00 0.00 H new ATOM 0 HG21 VAL A 153 4.732 11.670 -11.640 1.00 0.00 H new ATOM 0 HG22 VAL A 153 5.572 10.482 -12.665 1.00 0.00 H new ATOM 0 HG23 VAL A 153 3.808 10.678 -12.793 1.00 0.00 H new ATOM 2452 N TYR A 154 4.975 6.407 -10.201 1.00 0.00 N ATOM 2453 CA TYR A 154 4.764 5.394 -9.173 1.00 0.00 C ATOM 2454 C TYR A 154 5.830 5.492 -8.087 1.00 0.00 C ATOM 2455 O TYR A 154 7.013 5.665 -8.379 1.00 0.00 O ATOM 2456 CB TYR A 154 4.779 3.996 -9.795 1.00 0.00 C ATOM 2457 CG TYR A 154 6.106 3.624 -10.419 1.00 0.00 C ATOM 2458 CD1 TYR A 154 6.540 4.236 -11.588 1.00 0.00 C ATOM 2459 CD2 TYR A 154 6.923 2.663 -9.838 1.00 0.00 C ATOM 2460 CE1 TYR A 154 7.752 3.897 -12.161 1.00 0.00 C ATOM 2461 CE2 TYR A 154 8.135 2.321 -10.403 1.00 0.00 C ATOM 2462 CZ TYR A 154 8.545 2.940 -11.565 1.00 0.00 C ATOM 2463 OH TYR A 154 9.753 2.603 -12.133 1.00 0.00 O ATOM 0 H TYR A 154 5.923 6.435 -10.577 1.00 0.00 H new ATOM 0 HA TYR A 154 3.790 5.571 -8.717 1.00 0.00 H new ATOM 0 HB2 TYR A 154 4.530 3.263 -9.027 1.00 0.00 H new ATOM 0 HB3 TYR A 154 4.000 3.938 -10.556 1.00 0.00 H new ATOM 0 HD1 TYR A 154 5.922 4.988 -12.056 1.00 0.00 H new ATOM 0 HD2 TYR A 154 6.605 2.175 -8.929 1.00 0.00 H new ATOM 0 HE1 TYR A 154 8.076 4.380 -13.071 1.00 0.00 H new ATOM 0 HE2 TYR A 154 8.759 1.572 -9.937 1.00 0.00 H new ATOM 0 HH TYR A 154 10.189 1.914 -11.589 1.00 0.00 H new ATOM 2473 N PHE A 155 5.403 5.377 -6.834 1.00 0.00 N ATOM 2474 CA PHE A 155 6.320 5.452 -5.703 1.00 0.00 C ATOM 2475 C PHE A 155 6.413 4.108 -4.987 1.00 0.00 C ATOM 2476 O PHE A 155 5.448 3.345 -4.952 1.00 0.00 O ATOM 2477 CB PHE A 155 5.867 6.535 -4.723 1.00 0.00 C ATOM 2478 CG PHE A 155 5.776 7.903 -5.337 1.00 0.00 C ATOM 2479 CD1 PHE A 155 6.920 8.650 -5.569 1.00 0.00 C ATOM 2480 CD2 PHE A 155 4.548 8.441 -5.684 1.00 0.00 C ATOM 2481 CE1 PHE A 155 6.841 9.908 -6.134 1.00 0.00 C ATOM 2482 CE2 PHE A 155 4.461 9.699 -6.250 1.00 0.00 C ATOM 2483 CZ PHE A 155 5.609 10.434 -6.475 1.00 0.00 C ATOM 0 H PHE A 155 4.427 5.231 -6.576 1.00 0.00 H new ATOM 0 HA PHE A 155 7.308 5.708 -6.085 1.00 0.00 H new ATOM 0 HB2 PHE A 155 4.892 6.262 -4.318 1.00 0.00 H new ATOM 0 HB3 PHE A 155 6.562 6.568 -3.884 1.00 0.00 H new ATOM 0 HD1 PHE A 155 7.885 8.244 -5.305 1.00 0.00 H new ATOM 0 HD2 PHE A 155 3.647 7.871 -5.510 1.00 0.00 H new ATOM 0 HE1 PHE A 155 7.740 10.480 -6.309 1.00 0.00 H new ATOM 0 HE2 PHE A 155 3.497 10.107 -6.516 1.00 0.00 H new ATOM 0 HZ PHE A 155 5.544 11.418 -6.916 1.00 0.00 H new ATOM 2493 N ALA A 156 7.580 3.827 -4.418 1.00 0.00 N ATOM 2494 CA ALA A 156 7.799 2.576 -3.702 1.00 0.00 C ATOM 2495 C ALA A 156 7.937 2.818 -2.202 1.00 0.00 C ATOM 2496 O ALA A 156 8.418 3.867 -1.775 1.00 0.00 O ATOM 2497 CB ALA A 156 9.035 1.870 -4.240 1.00 0.00 C ATOM 0 H ALA A 156 8.389 4.448 -4.439 1.00 0.00 H new ATOM 0 HA ALA A 156 6.930 1.938 -3.862 1.00 0.00 H new ATOM 0 HB1 ALA A 156 9.187 0.937 -3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 156 8.899 1.654 -5.300 1.00 0.00 H new ATOM 0 HB3 ALA A 156 9.906 2.512 -4.110 1.00 0.00 H new ATOM 2503 N TRP A 157 7.510 1.841 -1.409 1.00 0.00 N ATOM 2504 CA TRP A 157 7.585 1.948 0.043 1.00 0.00 C ATOM 2505 C TRP A 157 8.213 0.696 0.649 1.00 0.00 C ATOM 2506 O TRP A 157 8.268 -0.354 0.010 1.00 0.00 O ATOM 2507 CB TRP A 157 6.190 2.168 0.632 1.00 0.00 C ATOM 2508 CG TRP A 157 5.500 3.380 0.085 1.00 0.00 C ATOM 2509 CD1 TRP A 157 4.676 3.433 -1.002 1.00 0.00 C ATOM 2510 CD2 TRP A 157 5.575 4.715 0.598 1.00 0.00 C ATOM 2511 NE1 TRP A 157 4.233 4.720 -1.196 1.00 0.00 N ATOM 2512 CE2 TRP A 157 4.772 5.524 -0.227 1.00 0.00 C ATOM 2513 CE3 TRP A 157 6.242 5.305 1.675 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 4.617 6.892 -0.008 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 6.089 6.661 1.892 1.00 0.00 C ATOM 2516 CH2 TRP A 157 5.282 7.441 1.054 1.00 0.00 C ATOM 0 H TRP A 157 7.109 0.967 -1.747 1.00 0.00 H new ATOM 0 HA TRP A 157 8.214 2.804 0.287 1.00 0.00 H new ATOM 0 HB2 TRP A 157 5.577 1.289 0.434 1.00 0.00 H new ATOM 0 HB3 TRP A 157 6.271 2.262 1.715 1.00 0.00 H new ATOM 0 HD1 TRP A 157 4.411 2.587 -1.619 1.00 0.00 H new ATOM 0 HE1 TRP A 157 3.606 5.026 -1.940 1.00 0.00 H new ATOM 0 HE3 TRP A 157 6.866 4.711 2.326 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 3.995 7.496 -0.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 6.600 7.127 2.721 1.00 0.00 H new ATOM 0 HH2 TRP A 157 5.183 8.498 1.250 1.00 0.00 H new ATOM 2527 N MET A 158 8.685 0.817 1.885 1.00 0.00 N ATOM 2528 CA MET A 158 9.310 -0.304 2.577 1.00 0.00 C ATOM 2529 C MET A 158 8.299 -1.028 3.462 1.00 0.00 C ATOM 2530 O MET A 158 7.603 -0.406 4.263 1.00 0.00 O ATOM 2531 CB MET A 158 10.488 0.183 3.423 1.00 0.00 C ATOM 2532 CG MET A 158 11.815 0.174 2.680 1.00 0.00 C ATOM 2533 SD MET A 158 11.765 1.139 1.158 1.00 0.00 S ATOM 2534 CE MET A 158 13.257 0.570 0.346 1.00 0.00 C ATOM 0 H MET A 158 8.647 1.680 2.428 1.00 0.00 H new ATOM 0 HA MET A 158 9.676 -1.003 1.826 1.00 0.00 H new ATOM 0 HB2 MET A 158 10.282 1.196 3.769 1.00 0.00 H new ATOM 0 HB3 MET A 158 10.573 -0.446 4.309 1.00 0.00 H new ATOM 0 HG2 MET A 158 12.594 0.570 3.331 1.00 0.00 H new ATOM 0 HG3 MET A 158 12.088 -0.855 2.445 1.00 0.00 H new ATOM 0 HE1 MET A 158 13.366 1.078 -0.612 1.00 0.00 H new ATOM 0 HE2 MET A 158 14.120 0.791 0.974 1.00 0.00 H new ATOM 0 HE3 MET A 158 13.194 -0.506 0.182 1.00 0.00 H new ATOM 2544 N ARG A 159 8.225 -2.347 3.310 1.00 0.00 N ATOM 2545 CA ARG A 159 7.300 -3.155 4.095 1.00 0.00 C ATOM 2546 C ARG A 159 8.014 -4.354 4.713 1.00 0.00 C ATOM 2547 O ARG A 159 8.559 -5.198 4.001 1.00 0.00 O ATOM 2548 CB ARG A 159 6.139 -3.633 3.221 1.00 0.00 C ATOM 2549 CG ARG A 159 4.837 -3.816 3.985 1.00 0.00 C ATOM 2550 CD ARG A 159 4.792 -5.159 4.695 1.00 0.00 C ATOM 2551 NE ARG A 159 4.449 -6.249 3.784 1.00 0.00 N ATOM 2552 CZ ARG A 159 3.210 -6.515 3.381 1.00 0.00 C ATOM 2553 NH1 ARG A 159 2.192 -5.775 3.803 1.00 0.00 N ATOM 2554 NH2 ARG A 159 2.985 -7.525 2.551 1.00 0.00 N ATOM 0 H ARG A 159 8.794 -2.878 2.651 1.00 0.00 H new ATOM 0 HA ARG A 159 6.908 -2.534 4.900 1.00 0.00 H new ATOM 0 HB2 ARG A 159 5.981 -2.914 2.417 1.00 0.00 H new ATOM 0 HB3 ARG A 159 6.412 -4.579 2.754 1.00 0.00 H new ATOM 0 HG2 ARG A 159 4.726 -3.014 4.714 1.00 0.00 H new ATOM 0 HG3 ARG A 159 3.996 -3.739 3.296 1.00 0.00 H new ATOM 0 HD2 ARG A 159 5.761 -5.360 5.152 1.00 0.00 H new ATOM 0 HD3 ARG A 159 4.061 -5.118 5.502 1.00 0.00 H new ATOM 0 HE ARG A 159 5.204 -6.840 3.437 1.00 0.00 H new ATOM 0 HH11 ARG A 159 2.357 -4.996 4.441 1.00 0.00 H new ATOM 0 HH12 ARG A 159 1.244 -5.985 3.490 1.00 0.00 H new ATOM 0 HH21 ARG A 159 3.762 -8.098 2.222 1.00 0.00 H new ATOM 0 HH22 ARG A 159 2.035 -7.729 2.242 1.00 0.00 H new ATOM 2568 N PHE A 160 8.006 -4.421 6.040 1.00 0.00 N ATOM 2569 CA PHE A 160 8.652 -5.517 6.754 1.00 0.00 C ATOM 2570 C PHE A 160 7.622 -6.369 7.489 1.00 0.00 C ATOM 2571 O PHE A 160 6.886 -5.873 8.341 1.00 0.00 O ATOM 2572 CB PHE A 160 9.684 -4.970 7.743 1.00 0.00 C ATOM 2573 CG PHE A 160 11.013 -5.664 7.668 1.00 0.00 C ATOM 2574 CD1 PHE A 160 11.218 -6.870 8.320 1.00 0.00 C ATOM 2575 CD2 PHE A 160 12.059 -5.111 6.945 1.00 0.00 C ATOM 2576 CE1 PHE A 160 12.441 -7.512 8.252 1.00 0.00 C ATOM 2577 CE2 PHE A 160 13.283 -5.748 6.874 1.00 0.00 C ATOM 2578 CZ PHE A 160 13.474 -6.950 7.528 1.00 0.00 C ATOM 0 H PHE A 160 7.560 -3.730 6.643 1.00 0.00 H new ATOM 0 HA PHE A 160 9.160 -6.147 6.023 1.00 0.00 H new ATOM 0 HB2 PHE A 160 9.828 -3.906 7.554 1.00 0.00 H new ATOM 0 HB3 PHE A 160 9.291 -5.064 8.755 1.00 0.00 H new ATOM 0 HD1 PHE A 160 10.413 -7.313 8.888 1.00 0.00 H new ATOM 0 HD2 PHE A 160 11.915 -4.172 6.432 1.00 0.00 H new ATOM 0 HE1 PHE A 160 12.588 -8.451 8.764 1.00 0.00 H new ATOM 0 HE2 PHE A 160 14.090 -5.307 6.308 1.00 0.00 H new ATOM 0 HZ PHE A 160 14.430 -7.449 7.473 1.00 0.00 H new ATOM 2588 N GLN A 161 7.576 -7.654 7.153 1.00 0.00 N ATOM 2589 CA GLN A 161 6.637 -8.576 7.782 1.00 0.00 C ATOM 2590 C GLN A 161 7.354 -9.501 8.760 1.00 0.00 C ATOM 2591 O GLN A 161 8.270 -10.231 8.381 1.00 0.00 O ATOM 2592 CB GLN A 161 5.911 -9.401 6.718 1.00 0.00 C ATOM 2593 CG GLN A 161 6.836 -10.288 5.900 1.00 0.00 C ATOM 2594 CD GLN A 161 6.523 -10.247 4.418 1.00 0.00 C ATOM 2595 OE1 GLN A 161 5.376 -10.050 4.018 1.00 0.00 O ATOM 2596 NE2 GLN A 161 7.546 -10.431 3.591 1.00 0.00 N ATOM 0 H GLN A 161 8.178 -8.081 6.449 1.00 0.00 H new ATOM 0 HA GLN A 161 5.906 -7.988 8.337 1.00 0.00 H new ATOM 0 HB2 GLN A 161 5.159 -10.024 7.203 1.00 0.00 H new ATOM 0 HB3 GLN A 161 5.380 -8.726 6.046 1.00 0.00 H new ATOM 0 HG2 GLN A 161 7.868 -9.974 6.058 1.00 0.00 H new ATOM 0 HG3 GLN A 161 6.757 -11.315 6.256 1.00 0.00 H new ATOM 0 HE21 GLN A 161 8.481 -10.591 3.965 1.00 0.00 H new ATOM 0 HE22 GLN A 161 7.396 -10.412 2.582 1.00 0.00 H new ATOM 2605 N PHE A 162 6.930 -9.465 10.019 1.00 0.00 N ATOM 2606 CA PHE A 162 7.531 -10.301 11.051 1.00 0.00 C ATOM 2607 C PHE A 162 6.458 -10.984 11.892 1.00 0.00 C ATOM 2608 O PHE A 162 5.331 -10.498 11.992 1.00 0.00 O ATOM 2609 CB PHE A 162 8.442 -9.463 11.951 1.00 0.00 C ATOM 2610 CG PHE A 162 7.760 -8.262 12.543 1.00 0.00 C ATOM 2611 CD1 PHE A 162 7.100 -8.352 13.758 1.00 0.00 C ATOM 2612 CD2 PHE A 162 7.779 -7.042 11.883 1.00 0.00 C ATOM 2613 CE1 PHE A 162 6.472 -7.249 14.304 1.00 0.00 C ATOM 2614 CE2 PHE A 162 7.153 -5.936 12.424 1.00 0.00 C ATOM 2615 CZ PHE A 162 6.499 -6.039 13.637 1.00 0.00 C ATOM 0 H PHE A 162 6.173 -8.866 10.349 1.00 0.00 H new ATOM 0 HA PHE A 162 8.126 -11.070 10.558 1.00 0.00 H new ATOM 0 HB2 PHE A 162 8.819 -10.091 12.758 1.00 0.00 H new ATOM 0 HB3 PHE A 162 9.306 -9.133 11.374 1.00 0.00 H new ATOM 0 HD1 PHE A 162 7.076 -9.295 14.284 1.00 0.00 H new ATOM 0 HD2 PHE A 162 8.289 -6.956 10.935 1.00 0.00 H new ATOM 0 HE1 PHE A 162 5.960 -7.332 15.251 1.00 0.00 H new ATOM 0 HE2 PHE A 162 7.175 -4.992 11.900 1.00 0.00 H new ATOM 0 HZ PHE A 162 6.010 -5.175 14.063 1.00 0.00 H new ATOM 2625 N LEU A 163 6.814 -12.114 12.494 1.00 0.00 N ATOM 2626 CA LEU A 163 5.880 -12.863 13.326 1.00 0.00 C ATOM 2627 C LEU A 163 5.948 -12.395 14.778 1.00 0.00 C ATOM 2628 O LEU A 163 6.934 -11.792 15.200 1.00 0.00 O ATOM 2629 CB LEU A 163 6.180 -14.363 13.243 1.00 0.00 C ATOM 2630 CG LEU A 163 4.989 -15.241 12.855 1.00 0.00 C ATOM 2631 CD1 LEU A 163 4.936 -15.434 11.348 1.00 0.00 C ATOM 2632 CD2 LEU A 163 5.064 -16.585 13.565 1.00 0.00 C ATOM 0 H LEU A 163 7.742 -12.531 12.421 1.00 0.00 H new ATOM 0 HA LEU A 163 4.872 -12.681 12.953 1.00 0.00 H new ATOM 0 HB2 LEU A 163 6.978 -14.519 12.517 1.00 0.00 H new ATOM 0 HB3 LEU A 163 6.558 -14.696 14.209 1.00 0.00 H new ATOM 0 HG LEU A 163 4.074 -14.738 13.168 1.00 0.00 H new ATOM 0 HD11 LEU A 163 4.082 -16.061 11.091 1.00 0.00 H new ATOM 0 HD12 LEU A 163 4.834 -14.465 10.860 1.00 0.00 H new ATOM 0 HD13 LEU A 163 5.854 -15.915 11.010 1.00 0.00 H new ATOM 0 HD21 LEU A 163 4.209 -17.197 13.277 1.00 0.00 H new ATOM 0 HD22 LEU A 163 5.986 -17.094 13.283 1.00 0.00 H new ATOM 0 HD23 LEU A 163 5.051 -16.428 14.644 1.00 0.00 H new ATOM 2644 N GLU A 164 4.893 -12.677 15.535 1.00 0.00 N ATOM 2645 CA GLU A 164 4.833 -12.284 16.938 1.00 0.00 C ATOM 2646 C GLU A 164 5.335 -13.408 17.840 1.00 0.00 C ATOM 2647 O GLU A 164 4.549 -14.208 18.349 1.00 0.00 O ATOM 2648 CB GLU A 164 3.401 -11.907 17.323 1.00 0.00 C ATOM 2649 CG GLU A 164 2.399 -13.032 17.116 1.00 0.00 C ATOM 2650 CD GLU A 164 1.875 -13.595 18.422 1.00 0.00 C ATOM 2651 OE1 GLU A 164 2.139 -14.783 18.705 1.00 0.00 O ATOM 2652 OE2 GLU A 164 1.201 -12.848 19.164 1.00 0.00 O ATOM 0 H GLU A 164 4.068 -13.176 15.201 1.00 0.00 H new ATOM 0 HA GLU A 164 5.479 -11.417 17.074 1.00 0.00 H new ATOM 0 HB2 GLU A 164 3.383 -11.604 18.370 1.00 0.00 H new ATOM 0 HB3 GLU A 164 3.091 -11.043 16.735 1.00 0.00 H new ATOM 0 HG2 GLU A 164 1.563 -12.664 16.522 1.00 0.00 H new ATOM 0 HG3 GLU A 164 2.869 -13.831 16.543 1.00 0.00 H new ATOM 2660 N HIS A 165 6.648 -13.463 18.034 1.00 0.00 N ATOM 2661 CA HIS A 165 7.255 -14.488 18.874 1.00 0.00 C ATOM 2662 C HIS A 165 7.658 -13.914 20.228 1.00 0.00 C ATOM 2663 O HIS A 165 7.634 -14.612 21.242 1.00 0.00 O ATOM 2664 CB HIS A 165 8.475 -15.094 18.174 1.00 0.00 C ATOM 2665 CG HIS A 165 8.329 -16.553 17.871 1.00 0.00 C ATOM 2666 ND1 HIS A 165 8.888 -17.543 18.651 1.00 0.00 N ATOM 2667 CD2 HIS A 165 7.679 -17.189 16.868 1.00 0.00 C ATOM 2668 CE1 HIS A 165 8.591 -18.725 18.139 1.00 0.00 C ATOM 2669 NE2 HIS A 165 7.858 -18.537 17.058 1.00 0.00 N ATOM 0 H HIS A 165 7.313 -12.809 17.620 1.00 0.00 H new ATOM 0 HA HIS A 165 6.516 -15.272 19.041 1.00 0.00 H new ATOM 0 HB2 HIS A 165 8.655 -14.555 17.244 1.00 0.00 H new ATOM 0 HB3 HIS A 165 9.354 -14.948 18.802 1.00 0.00 H new ATOM 0 HD2 HIS A 165 7.123 -16.723 16.068 1.00 0.00 H new ATOM 0 HE1 HIS A 165 8.896 -19.681 18.537 1.00 0.00 H new ATOM 0 HE2 HIS A 165 7.485 -19.274 16.460 1.00 0.00 H new ATOM 2678 N HIS A 166 8.029 -12.638 20.237 1.00 0.00 N ATOM 2679 CA HIS A 166 8.438 -11.968 21.466 1.00 0.00 C ATOM 2680 C HIS A 166 9.672 -12.635 22.065 1.00 0.00 C ATOM 2681 O HIS A 166 10.169 -13.631 21.539 1.00 0.00 O ATOM 2682 CB HIS A 166 7.293 -11.977 22.482 1.00 0.00 C ATOM 2683 CG HIS A 166 7.056 -10.648 23.130 1.00 0.00 C ATOM 2684 ND1 HIS A 166 5.886 -10.326 23.785 1.00 0.00 N ATOM 2685 CD2 HIS A 166 7.851 -9.555 23.223 1.00 0.00 C ATOM 2686 CE1 HIS A 166 5.970 -9.093 24.251 1.00 0.00 C ATOM 2687 NE2 HIS A 166 7.152 -8.603 23.924 1.00 0.00 N ATOM 0 H HIS A 166 8.055 -12.047 19.406 1.00 0.00 H new ATOM 0 HA HIS A 166 8.689 -10.936 21.222 1.00 0.00 H new ATOM 0 HB2 HIS A 166 6.378 -12.297 21.983 1.00 0.00 H new ATOM 0 HB3 HIS A 166 7.510 -12.715 23.254 1.00 0.00 H new ATOM 0 HD2 HIS A 166 8.848 -9.452 22.821 1.00 0.00 H new ATOM 0 HE1 HIS A 166 5.202 -8.574 24.805 1.00 0.00 H new ATOM 0 HE2 HIS A 166 7.491 -7.669 24.155 1.00 0.00 H new ATOM 2696 N HIS A 167 10.163 -12.079 23.168 1.00 0.00 N ATOM 2697 CA HIS A 167 11.339 -12.619 23.839 1.00 0.00 C ATOM 2698 C HIS A 167 10.976 -13.843 24.675 1.00 0.00 C ATOM 2699 O HIS A 167 9.944 -13.864 25.347 1.00 0.00 O ATOM 2700 CB HIS A 167 11.981 -11.550 24.727 1.00 0.00 C ATOM 2701 CG HIS A 167 13.472 -11.482 24.600 1.00 0.00 C ATOM 2702 ND1 HIS A 167 14.182 -10.304 24.698 1.00 0.00 N ATOM 2703 CD2 HIS A 167 14.388 -12.455 24.379 1.00 0.00 C ATOM 2704 CE1 HIS A 167 15.471 -10.556 24.544 1.00 0.00 C ATOM 2705 NE2 HIS A 167 15.621 -11.853 24.350 1.00 0.00 N ATOM 0 H HIS A 167 9.764 -11.254 23.616 1.00 0.00 H new ATOM 0 HA HIS A 167 12.054 -12.924 23.075 1.00 0.00 H new ATOM 0 HB2 HIS A 167 11.558 -10.578 24.474 1.00 0.00 H new ATOM 0 HB3 HIS A 167 11.722 -11.750 25.767 1.00 0.00 H new ATOM 0 HD2 HIS A 167 14.186 -13.508 24.250 1.00 0.00 H new ATOM 0 HE1 HIS A 167 16.266 -9.825 24.572 1.00 0.00 H new ATOM 0 HE2 HIS A 167 16.510 -12.331 24.202 1.00 0.00 H new ATOM 2714 N HIS A 168 11.831 -14.858 24.631 1.00 0.00 N ATOM 2715 CA HIS A 168 11.600 -16.085 25.386 1.00 0.00 C ATOM 2716 C HIS A 168 12.518 -16.156 26.602 1.00 0.00 C ATOM 2717 O HIS A 168 13.467 -16.940 26.633 1.00 0.00 O ATOM 2718 CB HIS A 168 11.819 -17.308 24.491 1.00 0.00 C ATOM 2719 CG HIS A 168 10.905 -18.451 24.804 1.00 0.00 C ATOM 2720 ND1 HIS A 168 9.982 -18.943 23.906 1.00 0.00 N ATOM 2721 CD2 HIS A 168 10.774 -19.200 25.925 1.00 0.00 C ATOM 2722 CE1 HIS A 168 9.322 -19.946 24.460 1.00 0.00 C ATOM 2723 NE2 HIS A 168 9.784 -20.121 25.684 1.00 0.00 N ATOM 0 H HIS A 168 12.690 -14.856 24.081 1.00 0.00 H new ATOM 0 HA HIS A 168 10.567 -16.080 25.734 1.00 0.00 H new ATOM 0 HB2 HIS A 168 11.679 -17.016 23.450 1.00 0.00 H new ATOM 0 HB3 HIS A 168 12.852 -17.641 24.592 1.00 0.00 H new ATOM 0 HD2 HIS A 168 11.342 -19.093 26.837 1.00 0.00 H new ATOM 0 HE1 HIS A 168 8.539 -20.523 23.991 1.00 0.00 H new ATOM 0 HE2 HIS A 168 9.458 -20.827 26.345 1.00 0.00 H new ATOM 2732 N HIS A 169 12.229 -15.331 27.604 1.00 0.00 N ATOM 2733 CA HIS A 169 13.029 -15.300 28.823 1.00 0.00 C ATOM 2734 C HIS A 169 12.138 -15.360 30.059 1.00 0.00 C ATOM 2735 O HIS A 169 12.467 -14.796 31.102 1.00 0.00 O ATOM 2736 CB HIS A 169 13.888 -14.035 28.860 1.00 0.00 C ATOM 2737 CG HIS A 169 15.255 -14.258 29.429 1.00 0.00 C ATOM 2738 ND1 HIS A 169 16.414 -14.022 28.718 1.00 0.00 N ATOM 2739 CD2 HIS A 169 15.649 -14.696 30.649 1.00 0.00 C ATOM 2740 CE1 HIS A 169 17.459 -14.307 29.475 1.00 0.00 C ATOM 2741 NE2 HIS A 169 17.021 -14.718 30.650 1.00 0.00 N ATOM 0 H HIS A 169 11.447 -14.676 27.595 1.00 0.00 H new ATOM 0 HA HIS A 169 13.680 -16.174 28.824 1.00 0.00 H new ATOM 0 HB2 HIS A 169 13.984 -13.641 27.848 1.00 0.00 H new ATOM 0 HB3 HIS A 169 13.377 -13.275 29.451 1.00 0.00 H new ATOM 0 HD2 HIS A 169 15.003 -14.976 31.468 1.00 0.00 H new ATOM 0 HE1 HIS A 169 18.495 -14.219 29.182 1.00 0.00 H new ATOM 0 HE2 HIS A 169 17.608 -15.006 31.433 1.00 0.00 H new ATOM 2750 N HIS A 170 11.007 -16.047 29.934 1.00 0.00 N ATOM 2751 CA HIS A 170 10.068 -16.181 31.042 1.00 0.00 C ATOM 2752 C HIS A 170 10.632 -17.094 32.126 1.00 0.00 C ATOM 2753 O HIS A 170 10.992 -18.246 31.801 1.00 0.00 O ATOM 2754 CB HIS A 170 8.732 -16.732 30.541 1.00 0.00 C ATOM 2755 CG HIS A 170 7.887 -15.710 29.844 1.00 0.00 C ATOM 2756 ND1 HIS A 170 8.235 -14.379 29.755 1.00 0.00 N ATOM 2757 CD2 HIS A 170 6.701 -15.830 29.199 1.00 0.00 C ATOM 2758 CE1 HIS A 170 7.302 -13.724 29.088 1.00 0.00 C ATOM 2759 NE2 HIS A 170 6.362 -14.582 28.739 1.00 0.00 N ATOM 2760 OXT HIS A 170 10.710 -16.650 33.291 1.00 0.00 O ATOM 0 H HIS A 170 10.719 -16.519 29.077 1.00 0.00 H new ATOM 0 HA HIS A 170 9.908 -15.192 31.472 1.00 0.00 H new ATOM 0 HB2 HIS A 170 8.923 -17.560 29.859 1.00 0.00 H new ATOM 0 HB3 HIS A 170 8.175 -17.137 31.386 1.00 0.00 H new ATOM 0 HD2 HIS A 170 6.130 -16.738 29.071 1.00 0.00 H new ATOM 0 HE1 HIS A 170 7.307 -12.667 28.866 1.00 0.00 H new ATOM 0 HE2 HIS A 170 5.519 -14.354 28.212 1.00 0.00 H new TER 2769 HIS A 170