USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1069 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 51 SER OG : rot 28:sc= 0.217 USER MOD Set 1.2: A 126 HIS : no HD1:sc= -0.0341 X(o=0.18,f=0.21) USER MOD Set 2.1: A 120 ASN : amide:sc= 0.124 K(o=0.84,f=-0.0056) USER MOD Set 2.2: A 124 GLN : amide:sc= 0.719 K(o=0.84,f=0.12) USER MOD Set 3.1: A 44 THR OG1 : rot -158:sc= 0.812 USER MOD Set 3.2: A 63 LYS NZ :NH3+ 144:sc= 0.916 (180deg=0) USER MOD Set 4.1: A 27 SER OG : rot 180:sc= 0.0272 USER MOD Set 4.2: A 28 ASN : amide:sc= 0.0232 X(o=0.05,f=0) USER MOD Set 5.1: A 9 SER OG : rot 180:sc= 1 USER MOD Set 5.2: A 52 LYS NZ :NH3+ -107:sc= 1.2 (180deg=0) USER MOD Single : A 0 SER OG : rot 180:sc= 0.00205 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 ASN : amide:sc= 1.34 K(o=1.3,f=-2.6!) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -4 GLY N :NH3+ 132:sc= 0.0309 (180deg=0) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.775 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 2.41 (180deg=2.41) USER MOD Single : A 18 SER OG : rot 180:sc=-0.00733 USER MOD Single : A 20 TYR OH : rot 130:sc= 0 USER MOD Single : A 31 TYR OH : rot 33:sc= 0.176 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.183 K(o=-0.18,f=-0.7) USER MOD Single : A 50 THR OG1 : rot -140:sc= -0.41 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -163:sc= 1.25 (180deg=1.21) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.261 K(o=-0.26,f=-1.2) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 30:sc= 0.397 USER MOD Single : A 97 GLN : amide:sc= 0.203 X(o=0.2,f=-0.049) USER MOD Single : A 100 THR OG1 : rot -42:sc= 0.129 USER MOD Single : A 103 SER OG : rot -117:sc= 0.596 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -83:sc= 1.06 USER MOD Single : A 128 LYS NZ :NH3+ 178:sc= 1.94 (180deg=1.9) USER MOD Single : A 131 LYS NZ :NH3+ 173:sc= 1.61 (180deg=1.56) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -1.002 37.410 16.381 1.00 0.00 N ATOM 2 CA GLY A -4 -2.265 37.334 15.613 1.00 0.00 C ATOM 3 C GLY A -4 -2.011 36.977 14.156 1.00 0.00 C ATOM 4 O GLY A -4 -0.983 37.361 13.592 1.00 0.00 O ATOM 0 H1 GLY A -4 -0.987 38.288 16.939 1.00 0.00 H new ATOM 0 H2 GLY A -4 -0.935 36.592 17.020 1.00 0.00 H new ATOM 0 H3 GLY A -4 -0.196 37.403 15.724 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -2.921 36.588 16.062 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -2.784 38.291 15.669 1.00 0.00 H new ATOM 10 N SER A -3 -2.952 36.258 13.535 1.00 0.00 N ATOM 11 CA SER A -3 -2.859 35.744 12.153 1.00 0.00 C ATOM 12 C SER A -3 -4.164 35.979 11.367 1.00 0.00 C ATOM 13 O SER A -3 -5.245 35.888 11.960 1.00 0.00 O ATOM 14 CB SER A -3 -2.546 34.240 12.166 1.00 0.00 C ATOM 15 OG SER A -3 -1.306 33.987 12.815 1.00 0.00 O ATOM 0 H SER A -3 -3.830 36.007 13.990 1.00 0.00 H new ATOM 0 HA SER A -3 -2.055 36.289 11.659 1.00 0.00 H new ATOM 0 HB2 SER A -3 -3.345 33.702 12.676 1.00 0.00 H new ATOM 0 HB3 SER A -3 -2.510 33.863 11.144 1.00 0.00 H new ATOM 0 HG SER A -3 -1.127 33.024 12.814 1.00 0.00 H new ATOM 21 N PRO A -2 -4.108 36.247 10.044 1.00 0.00 N ATOM 22 CA PRO A -2 -5.305 36.380 9.202 1.00 0.00 C ATOM 23 C PRO A -2 -6.015 35.032 8.982 1.00 0.00 C ATOM 24 O PRO A -2 -7.245 34.962 8.930 1.00 0.00 O ATOM 25 CB PRO A -2 -4.797 36.968 7.882 1.00 0.00 C ATOM 26 CG PRO A -2 -3.347 36.491 7.793 1.00 0.00 C ATOM 27 CD PRO A -2 -2.901 36.460 9.253 1.00 0.00 C ATOM 0 HA PRO A -2 -6.054 37.016 9.674 1.00 0.00 H new ATOM 0 HB2 PRO A -2 -5.385 36.614 7.036 1.00 0.00 H new ATOM 0 HB3 PRO A -2 -4.859 38.056 7.881 1.00 0.00 H new ATOM 0 HG2 PRO A -2 -3.274 35.508 7.329 1.00 0.00 H new ATOM 0 HG3 PRO A -2 -2.735 37.170 7.199 1.00 0.00 H new ATOM 0 HD2 PRO A -2 -2.179 35.661 9.422 1.00 0.00 H new ATOM 0 HD3 PRO A -2 -2.414 37.395 9.531 1.00 0.00 H new ATOM 35 N ASN A -1 -5.235 33.955 8.889 1.00 0.00 N ATOM 36 CA ASN A -1 -5.672 32.560 8.853 1.00 0.00 C ATOM 37 C ASN A -1 -6.034 32.050 10.262 1.00 0.00 C ATOM 38 O ASN A -1 -5.324 32.316 11.235 1.00 0.00 O ATOM 39 CB ASN A -1 -4.566 31.719 8.178 1.00 0.00 C ATOM 40 CG ASN A -1 -3.187 31.928 8.794 1.00 0.00 C ATOM 41 OD1 ASN A -1 -2.557 32.963 8.619 1.00 0.00 O ATOM 42 ND2 ASN A -1 -2.674 30.992 9.552 1.00 0.00 N ATOM 0 H ASN A -1 -4.220 34.039 8.833 1.00 0.00 H new ATOM 0 HA ASN A -1 -6.585 32.468 8.266 1.00 0.00 H new ATOM 0 HB2 ASN A -1 -4.830 30.664 8.245 1.00 0.00 H new ATOM 0 HB3 ASN A -1 -4.524 31.970 7.118 1.00 0.00 H new ATOM 0 HD21 ASN A -1 -1.762 31.131 9.987 1.00 0.00 H new ATOM 0 HD22 ASN A -1 -3.186 30.124 9.708 1.00 0.00 H new ATOM 49 N SER A 0 -7.127 31.289 10.367 1.00 0.00 N ATOM 50 CA SER A 0 -7.649 30.724 11.627 1.00 0.00 C ATOM 51 C SER A 0 -7.007 29.387 12.035 1.00 0.00 C ATOM 52 O SER A 0 -7.189 28.929 13.167 1.00 0.00 O ATOM 53 CB SER A 0 -9.171 30.566 11.515 1.00 0.00 C ATOM 54 OG SER A 0 -9.506 29.755 10.397 1.00 0.00 O ATOM 0 H SER A 0 -7.694 31.038 9.557 1.00 0.00 H new ATOM 0 HA SER A 0 -7.385 31.428 12.416 1.00 0.00 H new ATOM 0 HB2 SER A 0 -9.564 30.118 12.428 1.00 0.00 H new ATOM 0 HB3 SER A 0 -9.638 31.546 11.414 1.00 0.00 H new ATOM 0 HG SER A 0 -10.480 29.662 10.340 1.00 0.00 H new ATOM 60 N MET A 1 -6.247 28.762 11.129 1.00 0.00 N ATOM 61 CA MET A 1 -5.554 27.477 11.309 1.00 0.00 C ATOM 62 C MET A 1 -4.184 27.471 10.608 1.00 0.00 C ATOM 63 O MET A 1 -3.855 28.399 9.862 1.00 0.00 O ATOM 64 CB MET A 1 -6.473 26.331 10.832 1.00 0.00 C ATOM 65 CG MET A 1 -6.792 26.329 9.327 1.00 0.00 C ATOM 66 SD MET A 1 -5.496 25.657 8.244 1.00 0.00 S ATOM 67 CE MET A 1 -6.339 25.799 6.646 1.00 0.00 C ATOM 0 H MET A 1 -6.089 29.157 10.202 1.00 0.00 H new ATOM 0 HA MET A 1 -5.344 27.325 12.368 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.005 25.381 11.089 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.410 26.384 11.386 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.705 25.755 9.169 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.002 27.353 9.018 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.686 25.429 5.856 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.256 25.210 6.665 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.583 26.844 6.455 1.00 0.00 H new ATOM 77 N ALA A 2 -3.390 26.421 10.844 1.00 0.00 N ATOM 78 CA ALA A 2 -2.111 26.174 10.164 1.00 0.00 C ATOM 79 C ALA A 2 -1.916 24.690 9.782 1.00 0.00 C ATOM 80 O ALA A 2 -1.443 24.389 8.685 1.00 0.00 O ATOM 81 CB ALA A 2 -0.979 26.679 11.069 1.00 0.00 C ATOM 0 H ALA A 2 -3.623 25.702 11.529 1.00 0.00 H new ATOM 0 HA ALA A 2 -2.103 26.718 9.219 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.019 26.505 10.583 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.106 27.746 11.249 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.007 26.145 12.019 1.00 0.00 H new ATOM 87 N THR A 3 -2.323 23.766 10.664 1.00 0.00 N ATOM 88 CA THR A 3 -2.408 22.314 10.429 1.00 0.00 C ATOM 89 C THR A 3 -3.675 21.788 11.106 1.00 0.00 C ATOM 90 O THR A 3 -3.871 21.981 12.307 1.00 0.00 O ATOM 91 CB THR A 3 -1.174 21.568 10.978 1.00 0.00 C ATOM 92 OG1 THR A 3 0.016 22.042 10.379 1.00 0.00 O ATOM 93 CG2 THR A 3 -1.224 20.064 10.695 1.00 0.00 C ATOM 0 H THR A 3 -2.616 24.021 11.607 1.00 0.00 H new ATOM 0 HA THR A 3 -2.441 22.136 9.354 1.00 0.00 H new ATOM 0 HB THR A 3 -1.184 21.750 12.053 1.00 0.00 H new ATOM 0 HG1 THR A 3 0.783 21.554 10.745 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.332 19.587 11.102 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.110 19.635 11.162 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.265 19.897 9.619 1.00 0.00 H new ATOM 101 N GLU A 4 -4.543 21.131 10.336 1.00 0.00 N ATOM 102 CA GLU A 4 -5.841 20.596 10.791 1.00 0.00 C ATOM 103 C GLU A 4 -6.153 19.192 10.225 1.00 0.00 C ATOM 104 O GLU A 4 -7.307 18.852 9.955 1.00 0.00 O ATOM 105 CB GLU A 4 -6.966 21.623 10.542 1.00 0.00 C ATOM 106 CG GLU A 4 -7.114 22.057 9.074 1.00 0.00 C ATOM 107 CD GLU A 4 -8.459 22.764 8.792 1.00 0.00 C ATOM 108 OE1 GLU A 4 -8.962 22.663 7.646 1.00 0.00 O ATOM 109 OE2 GLU A 4 -9.027 23.428 9.694 1.00 0.00 O ATOM 0 H GLU A 4 -4.364 20.947 9.349 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.775 20.442 11.868 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.911 21.198 10.880 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.777 22.506 11.152 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.295 22.727 8.814 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.027 21.182 8.430 1.00 0.00 H new ATOM 116 N LEU A 5 -5.119 18.358 10.041 1.00 0.00 N ATOM 117 CA LEU A 5 -5.220 16.983 9.528 1.00 0.00 C ATOM 118 C LEU A 5 -5.712 15.988 10.604 1.00 0.00 C ATOM 119 O LEU A 5 -5.049 15.012 10.959 1.00 0.00 O ATOM 120 CB LEU A 5 -3.895 16.601 8.829 1.00 0.00 C ATOM 121 CG LEU A 5 -4.097 15.764 7.553 1.00 0.00 C ATOM 122 CD1 LEU A 5 -2.740 15.448 6.923 1.00 0.00 C ATOM 123 CD2 LEU A 5 -4.840 14.443 7.768 1.00 0.00 C ATOM 0 H LEU A 5 -4.159 18.630 10.252 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.999 16.927 8.768 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -3.351 17.511 8.576 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -3.273 16.041 9.527 1.00 0.00 H new ATOM 0 HG LEU A 5 -4.720 16.378 6.902 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.887 14.855 6.020 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -2.232 16.378 6.668 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.132 14.885 7.631 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -4.936 13.921 6.816 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -4.282 13.821 8.468 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -5.832 14.645 8.173 1.00 0.00 H new ATOM 135 N GLU A 6 -6.896 16.268 11.145 1.00 0.00 N ATOM 136 CA GLU A 6 -7.595 15.509 12.193 1.00 0.00 C ATOM 137 C GLU A 6 -8.868 14.824 11.651 1.00 0.00 C ATOM 138 O GLU A 6 -9.925 14.807 12.285 1.00 0.00 O ATOM 139 CB GLU A 6 -7.804 16.400 13.431 1.00 0.00 C ATOM 140 CG GLU A 6 -8.639 17.668 13.192 1.00 0.00 C ATOM 141 CD GLU A 6 -8.841 18.444 14.508 1.00 0.00 C ATOM 142 OE1 GLU A 6 -9.872 18.234 15.195 1.00 0.00 O ATOM 143 OE2 GLU A 6 -7.972 19.276 14.868 1.00 0.00 O ATOM 0 H GLU A 6 -7.432 17.083 10.847 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.975 14.676 12.525 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -8.287 15.807 14.208 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -6.828 16.695 13.816 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -8.141 18.305 12.461 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -9.607 17.398 12.771 1.00 0.00 H new ATOM 150 N TYR A 7 -8.766 14.276 10.436 1.00 0.00 N ATOM 151 CA TYR A 7 -9.848 13.702 9.642 1.00 0.00 C ATOM 152 C TYR A 7 -9.328 12.473 8.902 1.00 0.00 C ATOM 153 O TYR A 7 -8.156 12.425 8.521 1.00 0.00 O ATOM 154 CB TYR A 7 -10.382 14.752 8.654 1.00 0.00 C ATOM 155 CG TYR A 7 -9.362 15.302 7.665 1.00 0.00 C ATOM 156 CD1 TYR A 7 -8.853 16.606 7.826 1.00 0.00 C ATOM 157 CD2 TYR A 7 -8.935 14.522 6.570 1.00 0.00 C ATOM 158 CE1 TYR A 7 -7.943 17.134 6.890 1.00 0.00 C ATOM 159 CE2 TYR A 7 -8.023 15.042 5.636 1.00 0.00 C ATOM 160 CZ TYR A 7 -7.526 16.354 5.787 1.00 0.00 C ATOM 161 OH TYR A 7 -6.661 16.863 4.868 1.00 0.00 O ATOM 0 H TYR A 7 -7.869 14.220 9.954 1.00 0.00 H new ATOM 0 HA TYR A 7 -10.668 13.400 10.293 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -11.205 14.311 8.092 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -10.795 15.584 9.224 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -9.162 17.203 8.671 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -9.312 13.517 6.449 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.563 18.137 7.015 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -7.702 14.437 4.801 1.00 0.00 H new ATOM 0 HH TYR A 7 -6.482 16.190 4.179 1.00 0.00 H new ATOM 171 N GLU A 8 -10.203 11.492 8.687 1.00 0.00 N ATOM 172 CA GLU A 8 -9.975 10.321 7.850 1.00 0.00 C ATOM 173 C GLU A 8 -11.253 9.470 7.831 1.00 0.00 C ATOM 174 O GLU A 8 -11.775 9.075 8.875 1.00 0.00 O ATOM 175 CB GLU A 8 -8.768 9.497 8.358 1.00 0.00 C ATOM 176 CG GLU A 8 -8.791 9.092 9.842 1.00 0.00 C ATOM 177 CD GLU A 8 -7.515 8.351 10.265 1.00 0.00 C ATOM 178 OE1 GLU A 8 -7.640 7.289 10.920 1.00 0.00 O ATOM 179 OE2 GLU A 8 -6.391 8.820 9.967 1.00 0.00 O ATOM 0 H GLU A 8 -11.130 11.494 9.111 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.737 10.644 6.836 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.697 8.590 7.758 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -7.860 10.072 8.175 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.911 9.984 10.457 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.656 8.456 10.029 1.00 0.00 H new ATOM 186 N SER A 9 -11.763 9.178 6.639 1.00 0.00 N ATOM 187 CA SER A 9 -12.790 8.146 6.454 1.00 0.00 C ATOM 188 C SER A 9 -12.126 6.797 6.178 1.00 0.00 C ATOM 189 O SER A 9 -11.521 6.615 5.125 1.00 0.00 O ATOM 190 CB SER A 9 -13.732 8.503 5.304 1.00 0.00 C ATOM 191 OG SER A 9 -14.615 9.540 5.697 1.00 0.00 O ATOM 0 H SER A 9 -11.482 9.644 5.776 1.00 0.00 H new ATOM 0 HA SER A 9 -13.378 8.084 7.370 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.154 8.818 4.435 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.303 7.624 5.005 1.00 0.00 H new ATOM 0 HG SER A 9 -15.212 9.761 4.952 1.00 0.00 H new ATOM 197 N VAL A 10 -12.212 5.855 7.119 1.00 0.00 N ATOM 198 CA VAL A 10 -11.653 4.488 6.992 1.00 0.00 C ATOM 199 C VAL A 10 -12.328 3.700 5.855 1.00 0.00 C ATOM 200 O VAL A 10 -13.542 3.797 5.658 1.00 0.00 O ATOM 201 CB VAL A 10 -11.754 3.730 8.333 1.00 0.00 C ATOM 202 CG1 VAL A 10 -11.145 2.326 8.255 1.00 0.00 C ATOM 203 CG2 VAL A 10 -11.009 4.471 9.452 1.00 0.00 C ATOM 0 H VAL A 10 -12.679 6.014 8.012 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.598 4.585 6.734 1.00 0.00 H new ATOM 0 HB VAL A 10 -12.821 3.665 8.547 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -11.241 1.834 9.223 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -11.670 1.743 7.498 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -10.091 2.401 7.989 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -11.100 3.911 10.383 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -9.956 4.566 9.187 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.441 5.463 9.582 1.00 0.00 H new ATOM 213 N LEU A 11 -11.538 2.904 5.123 1.00 0.00 N ATOM 214 CA LEU A 11 -11.955 2.105 3.959 1.00 0.00 C ATOM 215 C LEU A 11 -11.567 0.622 4.092 1.00 0.00 C ATOM 216 O LEU A 11 -12.363 -0.250 3.741 1.00 0.00 O ATOM 217 CB LEU A 11 -11.330 2.693 2.676 1.00 0.00 C ATOM 218 CG LEU A 11 -11.764 4.121 2.297 1.00 0.00 C ATOM 219 CD1 LEU A 11 -11.037 4.544 1.020 1.00 0.00 C ATOM 220 CD2 LEU A 11 -13.267 4.233 2.039 1.00 0.00 C ATOM 0 H LEU A 11 -10.546 2.793 5.334 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.043 2.151 3.906 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.246 2.684 2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.570 2.031 1.844 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.513 4.764 3.141 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.340 5.555 0.746 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -9.961 4.522 1.190 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.291 3.858 0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.515 5.261 1.776 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.546 3.571 1.219 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.813 3.946 2.938 1.00 0.00 H new ATOM 232 N CYS A 12 -10.373 0.330 4.618 1.00 0.00 N ATOM 233 CA CYS A 12 -9.904 -1.031 4.907 1.00 0.00 C ATOM 234 C CYS A 12 -8.896 -1.026 6.059 1.00 0.00 C ATOM 235 O CYS A 12 -7.949 -0.241 6.054 1.00 0.00 O ATOM 236 CB CYS A 12 -9.254 -1.628 3.652 1.00 0.00 C ATOM 237 SG CYS A 12 -8.939 -3.402 3.873 1.00 0.00 S ATOM 0 H CYS A 12 -9.690 1.048 4.860 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.760 -1.638 5.201 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -9.905 -1.474 2.791 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.318 -1.111 3.441 1.00 0.00 H new ATOM 0 HG CYS A 12 -8.391 -3.883 2.797 1.00 0.00 H new ATOM 243 N VAL A 13 -9.073 -1.932 7.019 1.00 0.00 N ATOM 244 CA VAL A 13 -8.116 -2.189 8.105 1.00 0.00 C ATOM 245 C VAL A 13 -7.820 -3.686 8.174 1.00 0.00 C ATOM 246 O VAL A 13 -8.743 -4.502 8.243 1.00 0.00 O ATOM 247 CB VAL A 13 -8.632 -1.638 9.450 1.00 0.00 C ATOM 248 CG1 VAL A 13 -7.723 -2.002 10.633 1.00 0.00 C ATOM 249 CG2 VAL A 13 -8.724 -0.109 9.403 1.00 0.00 C ATOM 0 H VAL A 13 -9.903 -2.523 7.069 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.185 -1.662 7.895 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.611 -2.094 9.600 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.138 -1.587 11.552 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.658 -3.086 10.722 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.727 -1.591 10.466 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.090 0.263 10.360 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.737 0.309 9.204 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.411 0.190 8.611 1.00 0.00 H new ATOM 259 N LYS A 14 -6.530 -4.040 8.165 1.00 0.00 N ATOM 260 CA LYS A 14 -6.023 -5.421 8.299 1.00 0.00 C ATOM 261 C LYS A 14 -4.920 -5.484 9.369 1.00 0.00 C ATOM 262 O LYS A 14 -4.030 -4.630 9.352 1.00 0.00 O ATOM 263 CB LYS A 14 -5.515 -5.971 6.948 1.00 0.00 C ATOM 264 CG LYS A 14 -6.552 -5.954 5.810 1.00 0.00 C ATOM 265 CD LYS A 14 -7.682 -6.969 6.018 1.00 0.00 C ATOM 266 CE LYS A 14 -8.739 -6.806 4.927 1.00 0.00 C ATOM 267 NZ LYS A 14 -9.777 -7.858 5.021 1.00 0.00 N ATOM 0 H LYS A 14 -5.781 -3.355 8.061 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.851 -6.055 8.617 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.648 -5.388 6.638 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.175 -6.996 7.094 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.979 -4.954 5.729 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.051 -6.164 4.865 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.280 -7.982 5.998 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.135 -6.825 6.999 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.205 -5.824 5.013 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.263 -6.849 3.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.480 -7.720 4.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.334 -8.793 4.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.247 -7.800 5.947 1.00 0.00 H new ATOM 281 N PRO A 15 -4.934 -6.475 10.280 1.00 0.00 N ATOM 282 CA PRO A 15 -3.996 -6.547 11.406 1.00 0.00 C ATOM 283 C PRO A 15 -2.586 -7.037 11.039 1.00 0.00 C ATOM 284 O PRO A 15 -1.672 -6.923 11.856 1.00 0.00 O ATOM 285 CB PRO A 15 -4.639 -7.521 12.394 1.00 0.00 C ATOM 286 CG PRO A 15 -5.436 -8.461 11.492 1.00 0.00 C ATOM 287 CD PRO A 15 -5.932 -7.533 10.389 1.00 0.00 C ATOM 0 HA PRO A 15 -3.838 -5.545 11.804 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -3.889 -8.059 12.974 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.283 -7.005 13.106 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -4.815 -9.264 11.096 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.262 -8.931 12.027 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -6.038 -8.069 9.446 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -6.911 -7.123 10.635 1.00 0.00 H new ATOM 295 N ASP A 16 -2.407 -7.613 9.846 1.00 0.00 N ATOM 296 CA ASP A 16 -1.158 -8.236 9.408 1.00 0.00 C ATOM 297 C ASP A 16 -0.795 -7.809 7.980 1.00 0.00 C ATOM 298 O ASP A 16 -1.404 -8.249 7.001 1.00 0.00 O ATOM 299 CB ASP A 16 -1.289 -9.760 9.525 1.00 0.00 C ATOM 300 CG ASP A 16 0.010 -10.483 9.129 1.00 0.00 C ATOM 301 OD1 ASP A 16 1.083 -10.140 9.678 1.00 0.00 O ATOM 302 OD2 ASP A 16 -0.043 -11.408 8.284 1.00 0.00 O ATOM 0 H ASP A 16 -3.145 -7.659 9.143 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.344 -7.901 10.051 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.553 -10.023 10.549 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.104 -10.104 8.888 1.00 0.00 H new ATOM 307 N VAL A 17 0.216 -6.948 7.874 1.00 0.00 N ATOM 308 CA VAL A 17 0.856 -6.546 6.614 1.00 0.00 C ATOM 309 C VAL A 17 2.362 -6.350 6.824 1.00 0.00 C ATOM 310 O VAL A 17 2.805 -5.908 7.889 1.00 0.00 O ATOM 311 CB VAL A 17 0.155 -5.310 6.006 1.00 0.00 C ATOM 312 CG1 VAL A 17 0.426 -4.003 6.762 1.00 0.00 C ATOM 313 CG2 VAL A 17 0.529 -5.102 4.535 1.00 0.00 C ATOM 0 H VAL A 17 0.629 -6.493 8.688 1.00 0.00 H new ATOM 0 HA VAL A 17 0.742 -7.344 5.880 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.907 -5.538 6.096 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.101 -3.184 6.273 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.075 -4.098 7.790 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.496 -3.798 6.761 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.013 -4.223 4.149 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.606 -4.957 4.450 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.234 -5.978 3.957 1.00 0.00 H new ATOM 323 N SER A 18 3.156 -6.699 5.812 1.00 0.00 N ATOM 324 CA SER A 18 4.627 -6.653 5.856 1.00 0.00 C ATOM 325 C SER A 18 5.185 -5.681 4.819 1.00 0.00 C ATOM 326 O SER A 18 4.683 -5.654 3.700 1.00 0.00 O ATOM 327 CB SER A 18 5.211 -8.045 5.599 1.00 0.00 C ATOM 328 OG SER A 18 4.742 -8.996 6.540 1.00 0.00 O ATOM 0 H SER A 18 2.792 -7.029 4.918 1.00 0.00 H new ATOM 0 HA SER A 18 4.913 -6.309 6.850 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.947 -8.369 4.592 1.00 0.00 H new ATOM 0 HB3 SER A 18 6.299 -7.996 5.643 1.00 0.00 H new ATOM 0 HG SER A 18 5.135 -9.872 6.343 1.00 0.00 H new ATOM 334 N VAL A 19 6.232 -4.924 5.168 1.00 0.00 N ATOM 335 CA VAL A 19 6.960 -3.997 4.279 1.00 0.00 C ATOM 336 C VAL A 19 8.313 -4.551 3.874 1.00 0.00 C ATOM 337 O VAL A 19 9.085 -5.046 4.698 1.00 0.00 O ATOM 338 CB VAL A 19 7.123 -2.591 4.892 1.00 0.00 C ATOM 339 CG1 VAL A 19 8.053 -1.666 4.085 1.00 0.00 C ATOM 340 CG2 VAL A 19 5.771 -1.882 4.972 1.00 0.00 C ATOM 0 H VAL A 19 6.614 -4.937 6.114 1.00 0.00 H new ATOM 0 HA VAL A 19 6.344 -3.897 3.385 1.00 0.00 H new ATOM 0 HB VAL A 19 7.560 -2.764 5.875 1.00 0.00 H new ATOM 0 HG11 VAL A 19 8.118 -0.696 4.578 1.00 0.00 H new ATOM 0 HG12 VAL A 19 9.047 -2.110 4.026 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.654 -1.536 3.079 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.905 -0.892 5.407 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.351 -1.785 3.971 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.092 -2.463 5.595 1.00 0.00 H new ATOM 350 N TYR A 20 8.625 -4.361 2.597 1.00 0.00 N ATOM 351 CA TYR A 20 9.923 -4.617 2.000 1.00 0.00 C ATOM 352 C TYR A 20 10.411 -3.343 1.302 1.00 0.00 C ATOM 353 O TYR A 20 9.713 -2.758 0.473 1.00 0.00 O ATOM 354 CB TYR A 20 9.832 -5.799 1.023 1.00 0.00 C ATOM 355 CG TYR A 20 8.833 -6.876 1.403 1.00 0.00 C ATOM 356 CD1 TYR A 20 9.151 -7.826 2.389 1.00 0.00 C ATOM 357 CD2 TYR A 20 7.566 -6.898 0.790 1.00 0.00 C ATOM 358 CE1 TYR A 20 8.207 -8.804 2.759 1.00 0.00 C ATOM 359 CE2 TYR A 20 6.629 -7.886 1.140 1.00 0.00 C ATOM 360 CZ TYR A 20 6.945 -8.842 2.127 1.00 0.00 C ATOM 361 OH TYR A 20 6.037 -9.804 2.449 1.00 0.00 O ATOM 0 H TYR A 20 7.946 -4.008 1.922 1.00 0.00 H new ATOM 0 HA TYR A 20 10.644 -4.887 2.772 1.00 0.00 H new ATOM 0 HB2 TYR A 20 9.571 -5.415 0.037 1.00 0.00 H new ATOM 0 HB3 TYR A 20 10.818 -6.255 0.937 1.00 0.00 H new ATOM 0 HD1 TYR A 20 10.121 -7.806 2.864 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.313 -6.154 0.049 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.449 -9.525 3.526 1.00 0.00 H new ATOM 0 HE2 TYR A 20 5.666 -7.913 0.652 1.00 0.00 H new ATOM 0 HH TYR A 20 5.171 -9.386 2.640 1.00 0.00 H new ATOM 371 N ARG A 21 11.633 -2.918 1.619 1.00 0.00 N ATOM 372 CA ARG A 21 12.371 -1.917 0.826 1.00 0.00 C ATOM 373 C ARG A 21 12.924 -2.589 -0.438 1.00 0.00 C ATOM 374 O ARG A 21 13.766 -3.485 -0.356 1.00 0.00 O ATOM 375 CB ARG A 21 13.463 -1.241 1.678 1.00 0.00 C ATOM 376 CG ARG A 21 12.926 -0.534 2.939 1.00 0.00 C ATOM 377 CD ARG A 21 11.856 0.540 2.682 1.00 0.00 C ATOM 378 NE ARG A 21 12.365 1.655 1.855 1.00 0.00 N ATOM 379 CZ ARG A 21 12.999 2.736 2.277 1.00 0.00 C ATOM 380 NH1 ARG A 21 13.396 3.639 1.427 1.00 0.00 N ATOM 381 NH2 ARG A 21 13.257 2.945 3.537 1.00 0.00 N ATOM 0 H ARG A 21 12.147 -3.255 2.434 1.00 0.00 H new ATOM 0 HA ARG A 21 11.700 -1.117 0.511 1.00 0.00 H new ATOM 0 HB2 ARG A 21 14.193 -1.993 1.978 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.991 -0.513 1.062 1.00 0.00 H new ATOM 0 HG2 ARG A 21 12.509 -1.287 3.608 1.00 0.00 H new ATOM 0 HG3 ARG A 21 13.764 -0.072 3.461 1.00 0.00 H new ATOM 0 HD2 ARG A 21 10.999 0.084 2.185 1.00 0.00 H new ATOM 0 HD3 ARG A 21 11.501 0.931 3.636 1.00 0.00 H new ATOM 0 HE ARG A 21 12.210 1.582 0.849 1.00 0.00 H new ATOM 0 HH11 ARG A 21 13.218 3.514 0.430 1.00 0.00 H new ATOM 0 HH12 ARG A 21 13.885 4.471 1.758 1.00 0.00 H new ATOM 0 HH21 ARG A 21 12.967 2.262 4.237 1.00 0.00 H new ATOM 0 HH22 ARG A 21 13.749 3.792 3.823 1.00 0.00 H new ATOM 395 N ILE A 22 12.383 -2.210 -1.596 1.00 0.00 N ATOM 396 CA ILE A 22 12.523 -2.949 -2.865 1.00 0.00 C ATOM 397 C ILE A 22 13.784 -2.554 -3.666 1.00 0.00 C ATOM 398 O ILE A 22 14.259 -1.419 -3.536 1.00 0.00 O ATOM 399 CB ILE A 22 11.220 -2.839 -3.699 1.00 0.00 C ATOM 400 CG1 ILE A 22 10.904 -1.396 -4.153 1.00 0.00 C ATOM 401 CG2 ILE A 22 10.053 -3.449 -2.902 1.00 0.00 C ATOM 402 CD1 ILE A 22 9.620 -1.292 -4.986 1.00 0.00 C ATOM 0 H ILE A 22 11.822 -1.363 -1.687 1.00 0.00 H new ATOM 0 HA ILE A 22 12.674 -3.999 -2.616 1.00 0.00 H new ATOM 0 HB ILE A 22 11.368 -3.403 -4.620 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.812 -0.758 -3.274 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.741 -1.015 -4.738 1.00 0.00 H new ATOM 0 HG21 ILE A 22 9.135 -3.373 -3.485 1.00 0.00 H new ATOM 0 HG22 ILE A 22 10.264 -4.498 -2.692 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.932 -2.909 -1.963 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.455 -0.253 -5.273 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.717 -1.905 -5.882 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.774 -1.644 -4.396 1.00 0.00 H new ATOM 414 N PRO A 23 14.337 -3.457 -4.507 1.00 0.00 N ATOM 415 CA PRO A 23 15.421 -3.137 -5.448 1.00 0.00 C ATOM 416 C PRO A 23 14.980 -2.130 -6.534 1.00 0.00 C ATOM 417 O PRO A 23 13.777 -1.890 -6.693 1.00 0.00 O ATOM 418 CB PRO A 23 15.820 -4.486 -6.065 1.00 0.00 C ATOM 419 CG PRO A 23 14.521 -5.281 -6.022 1.00 0.00 C ATOM 420 CD PRO A 23 13.932 -4.848 -4.683 1.00 0.00 C ATOM 0 HA PRO A 23 16.255 -2.652 -4.940 1.00 0.00 H new ATOM 0 HB2 PRO A 23 16.189 -4.370 -7.084 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.610 -4.973 -5.494 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.864 -5.035 -6.856 1.00 0.00 H new ATOM 0 HG3 PRO A 23 14.698 -6.356 -6.062 1.00 0.00 H new ATOM 0 HD2 PRO A 23 12.846 -4.943 -4.683 1.00 0.00 H new ATOM 0 HD3 PRO A 23 14.306 -5.471 -3.871 1.00 0.00 H new ATOM 428 N PRO A 24 15.919 -1.552 -7.314 1.00 0.00 N ATOM 429 CA PRO A 24 15.610 -0.617 -8.399 1.00 0.00 C ATOM 430 C PRO A 24 14.869 -1.299 -9.565 1.00 0.00 C ATOM 431 O PRO A 24 15.462 -1.826 -10.511 1.00 0.00 O ATOM 432 CB PRO A 24 16.955 0.007 -8.798 1.00 0.00 C ATOM 433 CG PRO A 24 17.971 -1.072 -8.429 1.00 0.00 C ATOM 434 CD PRO A 24 17.366 -1.684 -7.167 1.00 0.00 C ATOM 0 HA PRO A 24 14.913 0.159 -8.081 1.00 0.00 H new ATOM 0 HB2 PRO A 24 16.988 0.243 -9.862 1.00 0.00 H new ATOM 0 HB3 PRO A 24 17.142 0.936 -8.259 1.00 0.00 H new ATOM 0 HG2 PRO A 24 18.084 -1.810 -9.223 1.00 0.00 H new ATOM 0 HG3 PRO A 24 18.959 -0.651 -8.242 1.00 0.00 H new ATOM 0 HD2 PRO A 24 17.654 -2.730 -7.063 1.00 0.00 H new ATOM 0 HD3 PRO A 24 17.717 -1.166 -6.274 1.00 0.00 H new ATOM 442 N ARG A 25 13.537 -1.258 -9.480 1.00 0.00 N ATOM 443 CA ARG A 25 12.545 -1.756 -10.446 1.00 0.00 C ATOM 444 C ARG A 25 11.400 -0.740 -10.591 1.00 0.00 C ATOM 445 O ARG A 25 11.209 0.120 -9.730 1.00 0.00 O ATOM 446 CB ARG A 25 12.023 -3.136 -9.973 1.00 0.00 C ATOM 447 CG ARG A 25 12.647 -4.348 -10.684 1.00 0.00 C ATOM 448 CD ARG A 25 12.254 -4.380 -12.170 1.00 0.00 C ATOM 449 NE ARG A 25 11.640 -5.660 -12.580 1.00 0.00 N ATOM 450 CZ ARG A 25 12.117 -6.570 -13.405 1.00 0.00 C ATOM 451 NH1 ARG A 25 11.328 -7.513 -13.824 1.00 0.00 N ATOM 452 NH2 ARG A 25 13.345 -6.561 -13.840 1.00 0.00 N ATOM 0 H ARG A 25 13.083 -0.841 -8.667 1.00 0.00 H new ATOM 0 HA ARG A 25 13.005 -1.879 -11.426 1.00 0.00 H new ATOM 0 HB2 ARG A 25 12.206 -3.229 -8.902 1.00 0.00 H new ATOM 0 HB3 ARG A 25 10.943 -3.167 -10.116 1.00 0.00 H new ATOM 0 HG2 ARG A 25 13.732 -4.308 -10.592 1.00 0.00 H new ATOM 0 HG3 ARG A 25 12.320 -5.267 -10.198 1.00 0.00 H new ATOM 0 HD2 ARG A 25 11.556 -3.568 -12.373 1.00 0.00 H new ATOM 0 HD3 ARG A 25 13.140 -4.198 -12.778 1.00 0.00 H new ATOM 0 HE ARG A 25 10.728 -5.866 -12.171 1.00 0.00 H new ATOM 0 HH11 ARG A 25 10.357 -7.540 -13.514 1.00 0.00 H new ATOM 0 HH12 ARG A 25 11.680 -8.226 -14.463 1.00 0.00 H new ATOM 0 HH21 ARG A 25 13.986 -5.826 -13.542 1.00 0.00 H new ATOM 0 HH22 ARG A 25 13.665 -7.289 -14.478 1.00 0.00 H new ATOM 466 N ALA A 26 10.636 -0.859 -11.675 1.00 0.00 N ATOM 467 CA ALA A 26 9.507 0.008 -12.013 1.00 0.00 C ATOM 468 C ALA A 26 8.368 -0.786 -12.669 1.00 0.00 C ATOM 469 O ALA A 26 8.588 -1.854 -13.236 1.00 0.00 O ATOM 470 CB ALA A 26 10.011 1.122 -12.940 1.00 0.00 C ATOM 0 H ALA A 26 10.792 -1.590 -12.369 1.00 0.00 H new ATOM 0 HA ALA A 26 9.099 0.445 -11.102 1.00 0.00 H new ATOM 0 HB1 ALA A 26 9.182 1.779 -13.203 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.783 1.698 -12.430 1.00 0.00 H new ATOM 0 HB3 ALA A 26 10.426 0.681 -13.846 1.00 0.00 H new ATOM 476 N SER A 27 7.160 -0.230 -12.661 1.00 0.00 N ATOM 477 CA SER A 27 5.921 -0.803 -13.217 1.00 0.00 C ATOM 478 C SER A 27 5.984 -1.155 -14.708 1.00 0.00 C ATOM 479 O SER A 27 5.391 -2.141 -15.144 1.00 0.00 O ATOM 480 CB SER A 27 4.796 0.214 -13.024 1.00 0.00 C ATOM 481 OG SER A 27 5.118 1.443 -13.666 1.00 0.00 O ATOM 0 H SER A 27 7.002 0.687 -12.243 1.00 0.00 H new ATOM 0 HA SER A 27 5.755 -1.739 -12.684 1.00 0.00 H new ATOM 0 HB2 SER A 27 3.866 -0.183 -13.431 1.00 0.00 H new ATOM 0 HB3 SER A 27 4.631 0.385 -11.960 1.00 0.00 H new ATOM 0 HG SER A 27 4.387 2.082 -13.534 1.00 0.00 H new ATOM 487 N ASN A 28 6.748 -0.382 -15.488 1.00 0.00 N ATOM 488 CA ASN A 28 6.956 -0.584 -16.929 1.00 0.00 C ATOM 489 C ASN A 28 7.947 -1.734 -17.235 1.00 0.00 C ATOM 490 O ASN A 28 8.145 -2.101 -18.395 1.00 0.00 O ATOM 491 CB ASN A 28 7.375 0.765 -17.548 1.00 0.00 C ATOM 492 CG ASN A 28 6.197 1.700 -17.801 1.00 0.00 C ATOM 493 OD1 ASN A 28 5.870 2.021 -18.935 1.00 0.00 O ATOM 494 ND2 ASN A 28 5.512 2.173 -16.780 1.00 0.00 N ATOM 0 H ASN A 28 7.254 0.426 -15.125 1.00 0.00 H new ATOM 0 HA ASN A 28 6.024 -0.910 -17.391 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.086 1.257 -16.884 1.00 0.00 H new ATOM 0 HB3 ASN A 28 7.893 0.581 -18.489 1.00 0.00 H new ATOM 0 HD21 ASN A 28 4.722 2.797 -16.941 1.00 0.00 H new ATOM 0 HD22 ASN A 28 5.772 1.915 -15.828 1.00 0.00 H new ATOM 501 N ARG A 29 8.542 -2.318 -16.185 1.00 0.00 N ATOM 502 CA ARG A 29 9.403 -3.515 -16.189 1.00 0.00 C ATOM 503 C ARG A 29 8.690 -4.680 -15.502 1.00 0.00 C ATOM 504 O ARG A 29 8.687 -5.806 -16.000 1.00 0.00 O ATOM 505 CB ARG A 29 10.709 -3.229 -15.449 1.00 0.00 C ATOM 506 CG ARG A 29 11.326 -1.861 -15.759 1.00 0.00 C ATOM 507 CD ARG A 29 12.613 -1.796 -14.952 1.00 0.00 C ATOM 508 NE ARG A 29 13.264 -0.475 -15.050 1.00 0.00 N ATOM 509 CZ ARG A 29 14.341 -0.069 -14.400 1.00 0.00 C ATOM 510 NH1 ARG A 29 14.774 1.150 -14.539 1.00 0.00 N ATOM 511 NH2 ARG A 29 15.006 -0.852 -13.598 1.00 0.00 N ATOM 0 H ARG A 29 8.428 -1.942 -15.244 1.00 0.00 H new ATOM 0 HA ARG A 29 9.619 -3.777 -17.225 1.00 0.00 H new ATOM 0 HB2 ARG A 29 10.527 -3.297 -14.376 1.00 0.00 H new ATOM 0 HB3 ARG A 29 11.432 -4.005 -15.700 1.00 0.00 H new ATOM 0 HG2 ARG A 29 11.527 -1.755 -16.825 1.00 0.00 H new ATOM 0 HG3 ARG A 29 10.648 -1.054 -15.480 1.00 0.00 H new ATOM 0 HD2 ARG A 29 12.396 -2.016 -13.907 1.00 0.00 H new ATOM 0 HD3 ARG A 29 13.300 -2.565 -15.304 1.00 0.00 H new ATOM 0 HE ARG A 29 12.837 0.197 -15.688 1.00 0.00 H new ATOM 0 HH11 ARG A 29 14.282 1.799 -15.153 1.00 0.00 H new ATOM 0 HH12 ARG A 29 15.606 1.456 -14.034 1.00 0.00 H new ATOM 0 HH21 ARG A 29 14.700 -1.814 -13.455 1.00 0.00 H new ATOM 0 HH22 ARG A 29 15.833 -0.503 -13.114 1.00 0.00 H new ATOM 525 N GLY A 30 8.064 -4.365 -14.366 1.00 0.00 N ATOM 526 CA GLY A 30 7.217 -5.226 -13.565 1.00 0.00 C ATOM 527 C GLY A 30 7.956 -5.874 -12.402 1.00 0.00 C ATOM 528 O GLY A 30 8.897 -6.649 -12.595 1.00 0.00 O ATOM 0 H GLY A 30 8.147 -3.433 -13.960 1.00 0.00 H new ATOM 0 HA2 GLY A 30 6.380 -4.645 -13.178 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.796 -6.005 -14.200 1.00 0.00 H new ATOM 532 N TYR A 31 7.516 -5.567 -11.184 1.00 0.00 N ATOM 533 CA TYR A 31 7.840 -6.320 -9.979 1.00 0.00 C ATOM 534 C TYR A 31 7.214 -7.717 -10.066 1.00 0.00 C ATOM 535 O TYR A 31 6.086 -7.852 -10.527 1.00 0.00 O ATOM 536 CB TYR A 31 7.258 -5.588 -8.765 1.00 0.00 C ATOM 537 CG TYR A 31 7.523 -4.098 -8.726 1.00 0.00 C ATOM 538 CD1 TYR A 31 8.815 -3.630 -8.441 1.00 0.00 C ATOM 539 CD2 TYR A 31 6.483 -3.183 -8.992 1.00 0.00 C ATOM 540 CE1 TYR A 31 9.069 -2.247 -8.401 1.00 0.00 C ATOM 541 CE2 TYR A 31 6.738 -1.799 -8.959 1.00 0.00 C ATOM 542 CZ TYR A 31 8.033 -1.325 -8.661 1.00 0.00 C ATOM 543 OH TYR A 31 8.272 0.013 -8.634 1.00 0.00 O ATOM 0 H TYR A 31 6.909 -4.767 -11.005 1.00 0.00 H new ATOM 0 HA TYR A 31 8.922 -6.409 -9.881 1.00 0.00 H new ATOM 0 HB2 TYR A 31 6.180 -5.750 -8.745 1.00 0.00 H new ATOM 0 HB3 TYR A 31 7.665 -6.038 -7.859 1.00 0.00 H new ATOM 0 HD1 TYR A 31 9.614 -4.332 -8.252 1.00 0.00 H new ATOM 0 HD2 TYR A 31 5.491 -3.544 -9.221 1.00 0.00 H new ATOM 0 HE1 TYR A 31 10.062 -1.889 -8.170 1.00 0.00 H new ATOM 0 HE2 TYR A 31 5.941 -1.099 -9.162 1.00 0.00 H new ATOM 0 HH TYR A 31 9.185 0.189 -8.944 1.00 0.00 H new ATOM 553 N ARG A 32 7.881 -8.750 -9.562 1.00 0.00 N ATOM 554 CA ARG A 32 7.373 -10.149 -9.560 1.00 0.00 C ATOM 555 C ARG A 32 7.293 -10.760 -8.170 1.00 0.00 C ATOM 556 O ARG A 32 7.346 -11.977 -8.026 1.00 0.00 O ATOM 557 CB ARG A 32 8.110 -11.055 -10.572 1.00 0.00 C ATOM 558 CG ARG A 32 9.640 -11.008 -10.495 1.00 0.00 C ATOM 559 CD ARG A 32 10.155 -9.987 -11.511 1.00 0.00 C ATOM 560 NE ARG A 32 11.561 -9.655 -11.260 1.00 0.00 N ATOM 561 CZ ARG A 32 12.659 -10.118 -11.814 1.00 0.00 C ATOM 562 NH1 ARG A 32 13.794 -9.698 -11.345 1.00 0.00 N ATOM 563 NH2 ARG A 32 12.660 -10.970 -12.799 1.00 0.00 N ATOM 0 H ARG A 32 8.802 -8.655 -9.134 1.00 0.00 H new ATOM 0 HA ARG A 32 6.342 -10.084 -9.907 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.786 -12.084 -10.418 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.804 -10.772 -11.579 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.959 -10.733 -9.490 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.059 -11.992 -10.704 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.047 -10.387 -12.519 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.550 -9.082 -11.460 1.00 0.00 H new ATOM 0 HE ARG A 32 11.711 -8.950 -10.538 1.00 0.00 H new ATOM 0 HH11 ARG A 32 13.812 -9.032 -10.573 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.668 -10.034 -11.749 1.00 0.00 H new ATOM 0 HH21 ARG A 32 11.777 -11.312 -13.179 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.544 -11.296 -13.191 1.00 0.00 H new ATOM 577 N ALA A 33 7.167 -9.903 -7.158 1.00 0.00 N ATOM 578 CA ALA A 33 7.224 -10.199 -5.725 1.00 0.00 C ATOM 579 C ALA A 33 8.559 -10.813 -5.238 1.00 0.00 C ATOM 580 O ALA A 33 9.130 -10.343 -4.257 1.00 0.00 O ATOM 581 CB ALA A 33 5.986 -11.036 -5.400 1.00 0.00 C ATOM 0 H ALA A 33 7.011 -8.910 -7.330 1.00 0.00 H new ATOM 0 HA ALA A 33 7.206 -9.268 -5.158 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.983 -11.283 -4.338 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.088 -10.467 -5.643 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.004 -11.955 -5.987 1.00 0.00 H new ATOM 587 N SER A 34 9.113 -11.794 -5.959 1.00 0.00 N ATOM 588 CA SER A 34 10.399 -12.461 -5.697 1.00 0.00 C ATOM 589 C SER A 34 11.623 -11.536 -5.800 1.00 0.00 C ATOM 590 O SER A 34 12.708 -11.894 -5.340 1.00 0.00 O ATOM 591 CB SER A 34 10.580 -13.639 -6.663 1.00 0.00 C ATOM 592 OG SER A 34 9.514 -14.567 -6.524 1.00 0.00 O ATOM 0 H SER A 34 8.652 -12.167 -6.789 1.00 0.00 H new ATOM 0 HA SER A 34 10.351 -12.800 -4.662 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.619 -13.273 -7.689 1.00 0.00 H new ATOM 0 HB3 SER A 34 11.530 -14.136 -6.466 1.00 0.00 H new ATOM 0 HG SER A 34 9.644 -15.311 -7.149 1.00 0.00 H new ATOM 598 N ASP A 35 11.460 -10.332 -6.362 1.00 0.00 N ATOM 599 CA ASP A 35 12.434 -9.235 -6.246 1.00 0.00 C ATOM 600 C ASP A 35 12.699 -8.821 -4.782 1.00 0.00 C ATOM 601 O ASP A 35 13.784 -8.331 -4.461 1.00 0.00 O ATOM 602 CB ASP A 35 11.877 -7.999 -6.968 1.00 0.00 C ATOM 603 CG ASP A 35 11.787 -8.146 -8.477 1.00 0.00 C ATOM 604 OD1 ASP A 35 12.835 -8.266 -9.151 1.00 0.00 O ATOM 605 OD2 ASP A 35 10.647 -8.143 -8.994 1.00 0.00 O ATOM 0 H ASP A 35 10.640 -10.087 -6.917 1.00 0.00 H new ATOM 0 HA ASP A 35 13.367 -9.593 -6.682 1.00 0.00 H new ATOM 0 HB2 ASP A 35 10.884 -7.780 -6.576 1.00 0.00 H new ATOM 0 HB3 ASP A 35 12.508 -7.141 -6.735 1.00 0.00 H new ATOM 610 N TRP A 36 11.701 -8.961 -3.903 1.00 0.00 N ATOM 611 CA TRP A 36 11.653 -8.338 -2.582 1.00 0.00 C ATOM 612 C TRP A 36 12.073 -9.302 -1.458 1.00 0.00 C ATOM 613 O TRP A 36 12.220 -10.514 -1.645 1.00 0.00 O ATOM 614 CB TRP A 36 10.238 -7.777 -2.335 1.00 0.00 C ATOM 615 CG TRP A 36 9.542 -7.020 -3.436 1.00 0.00 C ATOM 616 CD1 TRP A 36 10.101 -6.450 -4.531 1.00 0.00 C ATOM 617 CD2 TRP A 36 8.116 -6.721 -3.539 1.00 0.00 C ATOM 618 NE1 TRP A 36 9.113 -5.947 -5.357 1.00 0.00 N ATOM 619 CE2 TRP A 36 7.883 -6.034 -4.765 1.00 0.00 C ATOM 620 CE3 TRP A 36 6.995 -6.948 -2.715 1.00 0.00 C ATOM 621 CZ2 TRP A 36 6.619 -5.603 -5.167 1.00 0.00 C ATOM 622 CZ3 TRP A 36 5.726 -6.453 -3.070 1.00 0.00 C ATOM 623 CH2 TRP A 36 5.534 -5.793 -4.297 1.00 0.00 C ATOM 0 H TRP A 36 10.878 -9.531 -4.101 1.00 0.00 H new ATOM 0 HA TRP A 36 12.377 -7.523 -2.566 1.00 0.00 H new ATOM 0 HB2 TRP A 36 9.598 -8.614 -2.058 1.00 0.00 H new ATOM 0 HB3 TRP A 36 10.294 -7.118 -1.469 1.00 0.00 H new ATOM 0 HD1 TRP A 36 11.161 -6.397 -4.729 1.00 0.00 H new ATOM 0 HE1 TRP A 36 9.280 -5.561 -6.286 1.00 0.00 H new ATOM 0 HE3 TRP A 36 7.111 -7.509 -1.799 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 6.478 -5.132 -6.129 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 4.893 -6.581 -2.395 1.00 0.00 H new ATOM 0 HH2 TRP A 36 4.553 -5.433 -4.569 1.00 0.00 H new ATOM 634 N LYS A 37 12.228 -8.752 -0.252 1.00 0.00 N ATOM 635 CA LYS A 37 12.653 -9.448 0.981 1.00 0.00 C ATOM 636 C LYS A 37 11.530 -10.255 1.660 1.00 0.00 C ATOM 637 O LYS A 37 11.301 -10.132 2.861 1.00 0.00 O ATOM 638 CB LYS A 37 13.320 -8.451 1.930 1.00 0.00 C ATOM 639 CG LYS A 37 14.688 -8.014 1.400 1.00 0.00 C ATOM 640 CD LYS A 37 15.425 -7.212 2.469 1.00 0.00 C ATOM 641 CE LYS A 37 15.992 -8.079 3.604 1.00 0.00 C ATOM 642 NZ LYS A 37 16.749 -7.261 4.588 1.00 0.00 N ATOM 0 H LYS A 37 12.054 -7.760 -0.093 1.00 0.00 H new ATOM 0 HA LYS A 37 13.385 -10.203 0.695 1.00 0.00 H new ATOM 0 HB2 LYS A 37 12.679 -7.578 2.054 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.436 -8.904 2.915 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.275 -8.888 1.119 1.00 0.00 H new ATOM 0 HG3 LYS A 37 14.564 -7.411 0.501 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.241 -6.661 2.001 1.00 0.00 H new ATOM 0 HD3 LYS A 37 14.744 -6.474 2.892 1.00 0.00 H new ATOM 0 HE2 LYS A 37 15.177 -8.597 4.110 1.00 0.00 H new ATOM 0 HE3 LYS A 37 16.646 -8.845 3.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 17.118 -7.877 5.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.541 -6.787 4.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.118 -6.546 5.004 1.00 0.00 H new ATOM 656 N LEU A 38 10.820 -11.077 0.891 1.00 0.00 N ATOM 657 CA LEU A 38 9.547 -11.707 1.292 1.00 0.00 C ATOM 658 C LEU A 38 9.601 -12.511 2.606 1.00 0.00 C ATOM 659 O LEU A 38 8.633 -12.500 3.367 1.00 0.00 O ATOM 660 CB LEU A 38 9.032 -12.604 0.155 1.00 0.00 C ATOM 661 CG LEU A 38 8.731 -11.879 -1.169 1.00 0.00 C ATOM 662 CD1 LEU A 38 8.132 -12.895 -2.146 1.00 0.00 C ATOM 663 CD2 LEU A 38 7.750 -10.718 -1.005 1.00 0.00 C ATOM 0 H LEU A 38 11.113 -11.335 -0.051 1.00 0.00 H new ATOM 0 HA LEU A 38 8.862 -10.881 1.485 1.00 0.00 H new ATOM 0 HB2 LEU A 38 9.772 -13.382 -0.036 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.124 -13.104 0.491 1.00 0.00 H new ATOM 0 HG LEU A 38 9.667 -11.460 -1.537 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.910 -12.402 -3.093 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.845 -13.702 -2.315 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.213 -13.305 -1.727 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.578 -10.247 -1.973 1.00 0.00 H new ATOM 0 HD22 LEU A 38 6.805 -11.093 -0.611 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.166 -9.985 -0.314 1.00 0.00 H new ATOM 675 N ASP A 39 10.722 -13.179 2.895 1.00 0.00 N ATOM 676 CA ASP A 39 10.918 -13.980 4.118 1.00 0.00 C ATOM 677 C ASP A 39 11.618 -13.205 5.263 1.00 0.00 C ATOM 678 O ASP A 39 11.794 -13.733 6.362 1.00 0.00 O ATOM 679 CB ASP A 39 11.640 -15.284 3.738 1.00 0.00 C ATOM 680 CG ASP A 39 11.597 -16.349 4.853 1.00 0.00 C ATOM 681 OD1 ASP A 39 10.483 -16.698 5.316 1.00 0.00 O ATOM 682 OD2 ASP A 39 12.665 -16.893 5.222 1.00 0.00 O ATOM 0 H ASP A 39 11.535 -13.182 2.279 1.00 0.00 H new ATOM 0 HA ASP A 39 9.941 -14.222 4.536 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.186 -15.693 2.836 1.00 0.00 H new ATOM 0 HB3 ASP A 39 12.679 -15.060 3.498 1.00 0.00 H new ATOM 687 N GLN A 40 11.998 -11.941 5.023 1.00 0.00 N ATOM 688 CA GLN A 40 12.667 -11.050 5.986 1.00 0.00 C ATOM 689 C GLN A 40 12.233 -9.572 5.809 1.00 0.00 C ATOM 690 O GLN A 40 13.017 -8.761 5.303 1.00 0.00 O ATOM 691 CB GLN A 40 14.206 -11.234 5.936 1.00 0.00 C ATOM 692 CG GLN A 40 14.846 -11.384 4.539 1.00 0.00 C ATOM 693 CD GLN A 40 14.796 -12.797 3.953 1.00 0.00 C ATOM 694 OE1 GLN A 40 14.869 -13.808 4.638 1.00 0.00 O ATOM 695 NE2 GLN A 40 14.702 -12.928 2.645 1.00 0.00 N ATOM 0 H GLN A 40 11.843 -11.494 4.120 1.00 0.00 H new ATOM 0 HA GLN A 40 12.344 -11.337 6.987 1.00 0.00 H new ATOM 0 HB2 GLN A 40 14.666 -10.378 6.430 1.00 0.00 H new ATOM 0 HB3 GLN A 40 14.462 -12.116 6.523 1.00 0.00 H new ATOM 0 HG2 GLN A 40 14.344 -10.704 3.851 1.00 0.00 H new ATOM 0 HG3 GLN A 40 15.887 -11.068 4.597 1.00 0.00 H new ATOM 0 HE21 GLN A 40 14.640 -12.100 2.053 1.00 0.00 H new ATOM 0 HE22 GLN A 40 14.691 -13.857 2.225 1.00 0.00 H new ATOM 704 N PRO A 41 11.003 -9.192 6.222 1.00 0.00 N ATOM 705 CA PRO A 41 10.504 -7.817 6.121 1.00 0.00 C ATOM 706 C PRO A 41 11.428 -6.775 6.768 1.00 0.00 C ATOM 707 O PRO A 41 12.065 -7.032 7.794 1.00 0.00 O ATOM 708 CB PRO A 41 9.128 -7.805 6.800 1.00 0.00 C ATOM 709 CG PRO A 41 8.671 -9.260 6.705 1.00 0.00 C ATOM 710 CD PRO A 41 9.975 -10.048 6.801 1.00 0.00 C ATOM 0 HA PRO A 41 10.453 -7.534 5.070 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.194 -7.472 7.836 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.436 -7.133 6.293 1.00 0.00 H new ATOM 0 HG2 PRO A 41 7.985 -9.519 7.511 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.150 -9.457 5.768 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.208 -10.292 7.837 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.902 -10.991 6.260 1.00 0.00 H new ATOM 718 N ASP A 42 11.445 -5.565 6.208 1.00 0.00 N ATOM 719 CA ASP A 42 12.070 -4.395 6.838 1.00 0.00 C ATOM 720 C ASP A 42 11.244 -3.899 8.041 1.00 0.00 C ATOM 721 O ASP A 42 11.799 -3.413 9.029 1.00 0.00 O ATOM 722 CB ASP A 42 12.232 -3.291 5.785 1.00 0.00 C ATOM 723 CG ASP A 42 12.987 -2.075 6.349 1.00 0.00 C ATOM 724 OD1 ASP A 42 12.368 -0.999 6.509 1.00 0.00 O ATOM 725 OD2 ASP A 42 14.211 -2.191 6.600 1.00 0.00 O ATOM 0 H ASP A 42 11.024 -5.365 5.300 1.00 0.00 H new ATOM 0 HA ASP A 42 13.051 -4.675 7.222 1.00 0.00 H new ATOM 0 HB2 ASP A 42 12.770 -3.686 4.923 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.250 -2.978 5.432 1.00 0.00 H new ATOM 730 N TRP A 43 9.919 -4.072 7.972 1.00 0.00 N ATOM 731 CA TRP A 43 8.956 -3.776 9.041 1.00 0.00 C ATOM 732 C TRP A 43 7.692 -4.641 8.895 1.00 0.00 C ATOM 733 O TRP A 43 7.341 -5.051 7.786 1.00 0.00 O ATOM 734 CB TRP A 43 8.619 -2.276 8.989 1.00 0.00 C ATOM 735 CG TRP A 43 7.488 -1.796 9.848 1.00 0.00 C ATOM 736 CD1 TRP A 43 7.592 -1.276 11.092 1.00 0.00 C ATOM 737 CD2 TRP A 43 6.071 -1.724 9.505 1.00 0.00 C ATOM 738 NE1 TRP A 43 6.345 -0.865 11.529 1.00 0.00 N ATOM 739 CE2 TRP A 43 5.377 -1.076 10.568 1.00 0.00 C ATOM 740 CE3 TRP A 43 5.307 -2.130 8.390 1.00 0.00 C ATOM 741 CZ2 TRP A 43 4.007 -0.785 10.497 1.00 0.00 C ATOM 742 CZ3 TRP A 43 3.934 -1.825 8.305 1.00 0.00 C ATOM 743 CH2 TRP A 43 3.283 -1.153 9.352 1.00 0.00 C ATOM 0 H TRP A 43 9.468 -4.438 7.133 1.00 0.00 H new ATOM 0 HA TRP A 43 9.392 -4.015 10.011 1.00 0.00 H new ATOM 0 HB2 TRP A 43 9.514 -1.719 9.267 1.00 0.00 H new ATOM 0 HB3 TRP A 43 8.391 -2.017 7.955 1.00 0.00 H new ATOM 0 HD1 TRP A 43 8.508 -1.194 11.658 1.00 0.00 H new ATOM 0 HE1 TRP A 43 6.164 -0.457 12.446 1.00 0.00 H new ATOM 0 HE3 TRP A 43 5.781 -2.682 7.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 3.513 -0.282 11.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.377 -2.111 7.425 1.00 0.00 H new ATOM 0 HH2 TRP A 43 2.231 -0.921 9.277 1.00 0.00 H new ATOM 754 N THR A 44 6.980 -4.894 9.997 1.00 0.00 N ATOM 755 CA THR A 44 5.636 -5.501 9.992 1.00 0.00 C ATOM 756 C THR A 44 4.672 -4.745 10.905 1.00 0.00 C ATOM 757 O THR A 44 5.063 -4.207 11.944 1.00 0.00 O ATOM 758 CB THR A 44 5.638 -6.984 10.390 1.00 0.00 C ATOM 759 OG1 THR A 44 6.199 -7.195 11.671 1.00 0.00 O ATOM 760 CG2 THR A 44 6.404 -7.857 9.408 1.00 0.00 C ATOM 0 H THR A 44 7.322 -4.681 10.934 1.00 0.00 H new ATOM 0 HA THR A 44 5.297 -5.430 8.958 1.00 0.00 H new ATOM 0 HB THR A 44 4.586 -7.268 10.389 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.502 -8.124 11.747 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.371 -8.894 9.741 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.950 -7.778 8.420 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.441 -7.525 9.358 1.00 0.00 H new ATOM 768 N GLY A 45 3.393 -4.734 10.535 1.00 0.00 N ATOM 769 CA GLY A 45 2.350 -4.034 11.286 1.00 0.00 C ATOM 770 C GLY A 45 0.962 -4.176 10.672 1.00 0.00 C ATOM 771 O GLY A 45 0.594 -5.248 10.188 1.00 0.00 O ATOM 0 H GLY A 45 3.048 -5.212 9.702 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.329 -4.417 12.306 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.605 -2.976 11.348 1.00 0.00 H new ATOM 775 N ARG A 46 0.186 -3.089 10.722 1.00 0.00 N ATOM 776 CA ARG A 46 -1.230 -3.016 10.335 1.00 0.00 C ATOM 777 C ARG A 46 -1.443 -2.118 9.116 1.00 0.00 C ATOM 778 O ARG A 46 -0.795 -1.078 8.973 1.00 0.00 O ATOM 779 CB ARG A 46 -2.068 -2.503 11.520 1.00 0.00 C ATOM 780 CG ARG A 46 -1.901 -3.344 12.799 1.00 0.00 C ATOM 781 CD ARG A 46 -2.836 -2.882 13.924 1.00 0.00 C ATOM 782 NE ARG A 46 -2.416 -1.580 14.474 1.00 0.00 N ATOM 783 CZ ARG A 46 -2.882 -0.382 14.185 1.00 0.00 C ATOM 784 NH1 ARG A 46 -2.309 0.659 14.694 1.00 0.00 N ATOM 785 NH2 ARG A 46 -3.871 -0.145 13.377 1.00 0.00 N ATOM 0 H ARG A 46 0.544 -2.191 11.049 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.553 -4.021 10.063 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.788 -1.472 11.734 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.120 -2.495 11.235 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.100 -4.391 12.571 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.867 -3.282 13.140 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -3.855 -2.806 13.544 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -2.847 -3.628 14.719 1.00 0.00 H new ATOM 0 HE ARG A 46 -1.669 -1.611 15.167 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -1.505 0.548 15.312 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -2.661 1.592 14.478 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -4.347 -0.919 12.913 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -4.172 0.815 13.206 1.00 0.00 H new ATOM 799 N LEU A 47 -2.402 -2.500 8.277 1.00 0.00 N ATOM 800 CA LEU A 47 -2.945 -1.687 7.188 1.00 0.00 C ATOM 801 C LEU A 47 -4.059 -0.778 7.723 1.00 0.00 C ATOM 802 O LEU A 47 -4.912 -1.241 8.484 1.00 0.00 O ATOM 803 CB LEU A 47 -3.509 -2.632 6.111 1.00 0.00 C ATOM 804 CG LEU A 47 -4.108 -1.925 4.880 1.00 0.00 C ATOM 805 CD1 LEU A 47 -3.015 -1.410 3.948 1.00 0.00 C ATOM 806 CD2 LEU A 47 -5.023 -2.887 4.130 1.00 0.00 C ATOM 0 H LEU A 47 -2.840 -3.419 8.338 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.162 -1.061 6.761 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.712 -3.297 5.778 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.279 -3.257 6.563 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.684 -1.067 5.226 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.471 -0.917 3.090 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.386 -0.699 4.483 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.406 -2.246 3.604 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.445 -2.384 3.260 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.450 -3.755 3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.829 -3.210 4.789 1.00 0.00 H new ATOM 818 N ARG A 48 -4.111 0.472 7.253 1.00 0.00 N ATOM 819 CA ARG A 48 -5.236 1.397 7.457 1.00 0.00 C ATOM 820 C ARG A 48 -5.430 2.296 6.236 1.00 0.00 C ATOM 821 O ARG A 48 -4.920 3.413 6.158 1.00 0.00 O ATOM 822 CB ARG A 48 -5.003 2.176 8.765 1.00 0.00 C ATOM 823 CG ARG A 48 -6.173 3.098 9.141 1.00 0.00 C ATOM 824 CD ARG A 48 -5.903 3.739 10.504 1.00 0.00 C ATOM 825 NE ARG A 48 -7.032 4.561 10.966 1.00 0.00 N ATOM 826 CZ ARG A 48 -8.056 4.200 11.711 1.00 0.00 C ATOM 827 NH1 ARG A 48 -8.883 5.122 12.097 1.00 0.00 N ATOM 828 NH2 ARG A 48 -8.278 2.968 12.077 1.00 0.00 N ATOM 0 H ARG A 48 -3.354 0.881 6.706 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.171 0.846 7.561 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.833 1.468 9.576 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.096 2.773 8.667 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.299 3.871 8.383 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.102 2.529 9.173 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.701 2.958 11.237 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.007 4.357 10.442 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.020 5.537 10.671 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -8.729 6.092 11.822 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -9.687 4.877 12.675 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.641 2.227 11.785 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.088 2.746 12.655 1.00 0.00 H new ATOM 842 N ILE A 49 -6.196 1.802 5.268 1.00 0.00 N ATOM 843 CA ILE A 49 -6.645 2.603 4.128 1.00 0.00 C ATOM 844 C ILE A 49 -7.741 3.550 4.606 1.00 0.00 C ATOM 845 O ILE A 49 -8.727 3.128 5.216 1.00 0.00 O ATOM 846 CB ILE A 49 -7.124 1.751 2.938 1.00 0.00 C ATOM 847 CG1 ILE A 49 -6.092 0.658 2.605 1.00 0.00 C ATOM 848 CG2 ILE A 49 -7.384 2.668 1.727 1.00 0.00 C ATOM 849 CD1 ILE A 49 -6.485 -0.187 1.397 1.00 0.00 C ATOM 0 H ILE A 49 -6.524 0.836 5.249 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.793 3.168 3.751 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.055 1.249 3.201 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.125 1.125 2.416 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -5.968 0.008 3.471 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.723 2.068 0.883 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.150 3.400 1.983 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.463 3.185 1.458 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -5.717 -0.939 1.214 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.437 -0.680 1.592 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.582 0.454 0.521 1.00 0.00 H new ATOM 861 N THR A 50 -7.556 4.827 4.308 1.00 0.00 N ATOM 862 CA THR A 50 -8.429 5.948 4.665 1.00 0.00 C ATOM 863 C THR A 50 -8.600 6.890 3.464 1.00 0.00 C ATOM 864 O THR A 50 -7.951 6.706 2.436 1.00 0.00 O ATOM 865 CB THR A 50 -7.862 6.688 5.893 1.00 0.00 C ATOM 866 OG1 THR A 50 -6.462 6.817 5.864 1.00 0.00 O ATOM 867 CG2 THR A 50 -8.216 5.995 7.206 1.00 0.00 C ATOM 0 H THR A 50 -6.741 5.133 3.776 1.00 0.00 H new ATOM 0 HA THR A 50 -9.416 5.568 4.930 1.00 0.00 H new ATOM 0 HB THR A 50 -8.325 7.673 5.843 1.00 0.00 H new ATOM 0 HG1 THR A 50 -6.102 6.673 6.764 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.793 6.556 8.039 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.300 5.949 7.312 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.808 4.984 7.205 1.00 0.00 H new ATOM 875 N SER A 51 -9.492 7.880 3.537 1.00 0.00 N ATOM 876 CA SER A 51 -9.710 8.868 2.471 1.00 0.00 C ATOM 877 C SER A 51 -10.322 10.151 3.011 1.00 0.00 C ATOM 878 O SER A 51 -11.080 10.126 3.985 1.00 0.00 O ATOM 879 CB SER A 51 -10.608 8.264 1.386 1.00 0.00 C ATOM 880 OG SER A 51 -10.768 9.152 0.296 1.00 0.00 O ATOM 0 H SER A 51 -10.093 8.023 4.349 1.00 0.00 H new ATOM 0 HA SER A 51 -8.742 9.125 2.042 1.00 0.00 H new ATOM 0 HB2 SER A 51 -10.176 7.327 1.034 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.584 8.026 1.810 1.00 0.00 H new ATOM 0 HG SER A 51 -9.977 9.726 0.223 1.00 0.00 H new ATOM 886 N LYS A 52 -9.996 11.280 2.376 1.00 0.00 N ATOM 887 CA LYS A 52 -10.759 12.520 2.484 1.00 0.00 C ATOM 888 C LYS A 52 -10.599 13.408 1.245 1.00 0.00 C ATOM 889 O LYS A 52 -9.488 13.732 0.834 1.00 0.00 O ATOM 890 CB LYS A 52 -10.352 13.259 3.763 1.00 0.00 C ATOM 891 CG LYS A 52 -11.370 14.316 4.212 1.00 0.00 C ATOM 892 CD LYS A 52 -12.791 13.804 4.492 1.00 0.00 C ATOM 893 CE LYS A 52 -12.833 12.674 5.527 1.00 0.00 C ATOM 894 NZ LYS A 52 -14.232 12.341 5.895 1.00 0.00 N ATOM 0 H LYS A 52 -9.183 11.356 1.765 1.00 0.00 H new ATOM 0 HA LYS A 52 -11.818 12.268 2.540 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -10.217 12.533 4.565 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -9.387 13.741 3.603 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -10.993 14.795 5.116 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -11.427 15.087 3.443 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -13.406 14.633 4.843 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -13.233 13.451 3.560 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -12.339 11.790 5.125 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.280 12.971 6.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -14.432 12.694 6.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -14.884 12.786 5.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -14.361 11.309 5.872 1.00 0.00 H new ATOM 908 N GLY A 53 -11.727 13.833 0.675 1.00 0.00 N ATOM 909 CA GLY A 53 -11.796 14.908 -0.328 1.00 0.00 C ATOM 910 C GLY A 53 -11.164 14.550 -1.679 1.00 0.00 C ATOM 911 O GLY A 53 -10.272 15.255 -2.155 1.00 0.00 O ATOM 0 H GLY A 53 -12.639 13.435 0.899 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -12.841 15.174 -0.488 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.299 15.793 0.070 1.00 0.00 H new ATOM 915 N LYS A 54 -11.604 13.429 -2.273 1.00 0.00 N ATOM 916 CA LYS A 54 -11.087 12.844 -3.531 1.00 0.00 C ATOM 917 C LYS A 54 -9.596 12.473 -3.462 1.00 0.00 C ATOM 918 O LYS A 54 -8.909 12.414 -4.481 1.00 0.00 O ATOM 919 CB LYS A 54 -11.442 13.716 -4.757 1.00 0.00 C ATOM 920 CG LYS A 54 -12.943 14.007 -4.904 1.00 0.00 C ATOM 921 CD LYS A 54 -13.198 14.880 -6.140 1.00 0.00 C ATOM 922 CE LYS A 54 -14.695 15.166 -6.287 1.00 0.00 C ATOM 923 NZ LYS A 54 -14.972 16.070 -7.435 1.00 0.00 N ATOM 0 H LYS A 54 -12.364 12.877 -1.875 1.00 0.00 H new ATOM 0 HA LYS A 54 -11.604 11.894 -3.665 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.905 14.662 -4.685 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -11.089 13.217 -5.659 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -13.495 13.071 -4.991 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.312 14.512 -4.011 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.648 15.817 -6.052 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -12.827 14.376 -7.033 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -15.233 14.228 -6.424 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -15.071 15.618 -5.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -15.996 16.241 -7.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -14.479 16.974 -7.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -14.636 15.628 -8.314 1.00 0.00 H new ATOM 937 N THR A 55 -9.108 12.207 -2.250 1.00 0.00 N ATOM 938 CA THR A 55 -7.733 11.792 -1.965 1.00 0.00 C ATOM 939 C THR A 55 -7.747 10.648 -0.954 1.00 0.00 C ATOM 940 O THR A 55 -8.145 10.840 0.196 1.00 0.00 O ATOM 941 CB THR A 55 -6.893 12.958 -1.419 1.00 0.00 C ATOM 942 OG1 THR A 55 -6.984 14.101 -2.250 1.00 0.00 O ATOM 943 CG2 THR A 55 -5.417 12.579 -1.357 1.00 0.00 C ATOM 0 H THR A 55 -9.680 12.277 -1.408 1.00 0.00 H new ATOM 0 HA THR A 55 -7.277 11.460 -2.898 1.00 0.00 H new ATOM 0 HB THR A 55 -7.286 13.178 -0.426 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.440 14.824 -1.873 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.842 13.419 -0.968 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.290 11.717 -0.702 1.00 0.00 H new ATOM 0 HG23 THR A 55 -5.063 12.329 -2.357 1.00 0.00 H new ATOM 951 N ALA A 56 -7.310 9.464 -1.376 1.00 0.00 N ATOM 952 CA ALA A 56 -7.139 8.307 -0.500 1.00 0.00 C ATOM 953 C ALA A 56 -5.752 8.323 0.159 1.00 0.00 C ATOM 954 O ALA A 56 -4.825 8.964 -0.331 1.00 0.00 O ATOM 955 CB ALA A 56 -7.409 7.016 -1.276 1.00 0.00 C ATOM 0 H ALA A 56 -7.062 9.278 -2.348 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.867 8.356 0.309 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.279 6.160 -0.614 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.430 7.028 -1.658 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.711 6.940 -2.110 1.00 0.00 H new ATOM 961 N TYR A 57 -5.616 7.595 1.261 1.00 0.00 N ATOM 962 CA TYR A 57 -4.428 7.525 2.103 1.00 0.00 C ATOM 963 C TYR A 57 -4.225 6.068 2.550 1.00 0.00 C ATOM 964 O TYR A 57 -4.944 5.575 3.419 1.00 0.00 O ATOM 965 CB TYR A 57 -4.621 8.464 3.313 1.00 0.00 C ATOM 966 CG TYR A 57 -4.933 9.920 2.997 1.00 0.00 C ATOM 967 CD1 TYR A 57 -3.924 10.746 2.466 1.00 0.00 C ATOM 968 CD2 TYR A 57 -6.215 10.458 3.254 1.00 0.00 C ATOM 969 CE1 TYR A 57 -4.192 12.099 2.175 1.00 0.00 C ATOM 970 CE2 TYR A 57 -6.487 11.810 2.964 1.00 0.00 C ATOM 971 CZ TYR A 57 -5.478 12.632 2.420 1.00 0.00 C ATOM 972 OH TYR A 57 -5.744 13.940 2.150 1.00 0.00 O ATOM 0 H TYR A 57 -6.372 7.006 1.610 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.541 7.845 1.557 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.429 8.067 3.928 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.715 8.432 3.918 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -2.940 10.341 2.281 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.988 9.831 3.674 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -3.415 12.728 1.765 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.468 12.217 3.158 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.677 14.138 2.377 1.00 0.00 H new ATOM 982 N ILE A 58 -3.251 5.353 1.980 1.00 0.00 N ATOM 983 CA ILE A 58 -2.821 4.053 2.523 1.00 0.00 C ATOM 984 C ILE A 58 -1.891 4.354 3.698 1.00 0.00 C ATOM 985 O ILE A 58 -0.692 4.551 3.498 1.00 0.00 O ATOM 986 CB ILE A 58 -2.162 3.129 1.466 1.00 0.00 C ATOM 987 CG1 ILE A 58 -3.097 2.717 0.306 1.00 0.00 C ATOM 988 CG2 ILE A 58 -1.687 1.824 2.136 1.00 0.00 C ATOM 989 CD1 ILE A 58 -3.236 3.764 -0.799 1.00 0.00 C ATOM 0 H ILE A 58 -2.744 5.648 1.145 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.691 3.485 2.853 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.343 3.716 1.051 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.724 1.791 -0.133 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.086 2.502 0.712 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.225 1.179 1.389 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.960 2.058 2.913 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.540 1.312 2.580 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.910 3.391 -1.571 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.640 4.685 -0.379 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.258 3.963 -1.237 1.00 0.00 H new ATOM 1001 N LYS A 59 -2.441 4.435 4.915 1.00 0.00 N ATOM 1002 CA LYS A 59 -1.652 4.573 6.148 1.00 0.00 C ATOM 1003 C LYS A 59 -1.221 3.194 6.665 1.00 0.00 C ATOM 1004 O LYS A 59 -2.006 2.246 6.659 1.00 0.00 O ATOM 1005 CB LYS A 59 -2.421 5.388 7.205 1.00 0.00 C ATOM 1006 CG LYS A 59 -2.970 6.712 6.644 1.00 0.00 C ATOM 1007 CD LYS A 59 -3.463 7.661 7.743 1.00 0.00 C ATOM 1008 CE LYS A 59 -4.147 8.881 7.110 1.00 0.00 C ATOM 1009 NZ LYS A 59 -4.604 9.843 8.143 1.00 0.00 N ATOM 0 H LYS A 59 -3.448 4.407 5.075 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.743 5.131 5.926 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.247 4.790 7.590 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.761 5.599 8.047 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.191 7.207 6.065 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.790 6.499 5.959 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -4.161 7.141 8.399 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -2.625 7.983 8.361 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -3.454 9.377 6.431 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.999 8.554 6.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.299 10.495 7.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -5.044 9.324 8.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -3.790 10.385 8.497 1.00 0.00 H new ATOM 1023 N LEU A 60 0.023 3.084 7.118 1.00 0.00 N ATOM 1024 CA LEU A 60 0.599 1.914 7.783 1.00 0.00 C ATOM 1025 C LEU A 60 0.888 2.246 9.251 1.00 0.00 C ATOM 1026 O LEU A 60 1.472 3.287 9.547 1.00 0.00 O ATOM 1027 CB LEU A 60 1.874 1.481 7.036 1.00 0.00 C ATOM 1028 CG LEU A 60 1.674 0.287 6.093 1.00 0.00 C ATOM 1029 CD1 LEU A 60 0.593 0.493 5.031 1.00 0.00 C ATOM 1030 CD2 LEU A 60 2.985 0.013 5.360 1.00 0.00 C ATOM 0 H LEU A 60 0.694 3.847 7.028 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.106 1.083 7.762 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.249 2.327 6.459 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.642 1.228 7.767 1.00 0.00 H new ATOM 0 HG LEU A 60 1.355 -0.541 6.726 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.519 -0.399 4.409 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.365 0.677 5.518 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.853 1.349 4.408 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.855 -0.834 4.686 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.271 0.894 4.785 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.766 -0.216 6.085 1.00 0.00 H new ATOM 1042 N GLU A 61 0.500 1.363 10.170 1.00 0.00 N ATOM 1043 CA GLU A 61 0.559 1.614 11.618 1.00 0.00 C ATOM 1044 C GLU A 61 1.127 0.432 12.411 1.00 0.00 C ATOM 1045 O GLU A 61 1.012 -0.725 12.009 1.00 0.00 O ATOM 1046 CB GLU A 61 -0.827 1.944 12.175 1.00 0.00 C ATOM 1047 CG GLU A 61 -1.532 3.168 11.580 1.00 0.00 C ATOM 1048 CD GLU A 61 -2.801 3.517 12.389 1.00 0.00 C ATOM 1049 OE1 GLU A 61 -3.155 4.716 12.465 1.00 0.00 O ATOM 1050 OE2 GLU A 61 -3.446 2.596 12.956 1.00 0.00 O ATOM 0 H GLU A 61 0.131 0.442 9.933 1.00 0.00 H new ATOM 0 HA GLU A 61 1.232 2.463 11.738 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.469 1.076 12.027 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.735 2.093 13.251 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.852 4.020 11.577 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.800 2.970 10.542 1.00 0.00 H new ATOM 1057 N ASP A 62 1.718 0.711 13.572 1.00 0.00 N ATOM 1058 CA ASP A 62 2.299 -0.298 14.445 1.00 0.00 C ATOM 1059 C ASP A 62 1.221 -1.113 15.178 1.00 0.00 C ATOM 1060 O ASP A 62 0.169 -0.597 15.579 1.00 0.00 O ATOM 1061 CB ASP A 62 3.244 0.403 15.420 1.00 0.00 C ATOM 1062 CG ASP A 62 4.197 -0.591 16.081 1.00 0.00 C ATOM 1063 OD1 ASP A 62 3.775 -1.190 17.092 1.00 0.00 O ATOM 1064 OD2 ASP A 62 5.323 -0.795 15.572 1.00 0.00 O ATOM 0 H ASP A 62 1.806 1.660 13.935 1.00 0.00 H new ATOM 0 HA ASP A 62 2.858 -1.019 13.848 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.818 1.163 14.890 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.664 0.918 16.186 1.00 0.00 H new ATOM 1069 N LYS A 63 1.507 -2.400 15.374 1.00 0.00 N ATOM 1070 CA LYS A 63 0.639 -3.399 16.021 1.00 0.00 C ATOM 1071 C LYS A 63 0.734 -3.451 17.549 1.00 0.00 C ATOM 1072 O LYS A 63 -0.059 -4.147 18.184 1.00 0.00 O ATOM 1073 CB LYS A 63 0.870 -4.781 15.371 1.00 0.00 C ATOM 1074 CG LYS A 63 2.364 -5.131 15.243 1.00 0.00 C ATOM 1075 CD LYS A 63 2.593 -6.554 14.729 1.00 0.00 C ATOM 1076 CE LYS A 63 4.048 -6.674 14.259 1.00 0.00 C ATOM 1077 NZ LYS A 63 4.346 -8.019 13.705 1.00 0.00 N ATOM 0 H LYS A 63 2.395 -2.800 15.072 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.388 -3.078 15.845 1.00 0.00 H new ATOM 0 HB2 LYS A 63 0.371 -5.546 15.965 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.411 -4.795 14.382 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.843 -4.423 14.567 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.844 -5.018 16.215 1.00 0.00 H new ATOM 0 HD2 LYS A 63 2.389 -7.279 15.517 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.910 -6.775 13.908 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.247 -5.917 13.500 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.717 -6.470 15.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.009 -7.927 12.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.773 -8.612 14.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.465 -8.461 13.373 1.00 0.00 H new ATOM 1091 N VAL A 64 1.663 -2.698 18.137 1.00 0.00 N ATOM 1092 CA VAL A 64 1.881 -2.599 19.586 1.00 0.00 C ATOM 1093 C VAL A 64 1.760 -1.154 20.072 1.00 0.00 C ATOM 1094 O VAL A 64 1.092 -0.906 21.078 1.00 0.00 O ATOM 1095 CB VAL A 64 3.257 -3.192 19.947 1.00 0.00 C ATOM 1096 CG1 VAL A 64 3.606 -3.027 21.433 1.00 0.00 C ATOM 1097 CG2 VAL A 64 3.325 -4.690 19.619 1.00 0.00 C ATOM 0 H VAL A 64 2.309 -2.118 17.601 1.00 0.00 H new ATOM 0 HA VAL A 64 1.105 -3.173 20.093 1.00 0.00 H new ATOM 0 HB VAL A 64 3.975 -2.633 19.346 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.586 -3.463 21.627 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.624 -1.967 21.687 1.00 0.00 H new ATOM 0 HG13 VAL A 64 2.856 -3.533 22.041 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.309 -5.077 19.886 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.560 -5.222 20.185 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.154 -4.837 18.553 1.00 0.00 H new ATOM 1107 N SER A 65 2.360 -0.194 19.359 1.00 0.00 N ATOM 1108 CA SER A 65 2.394 1.213 19.787 1.00 0.00 C ATOM 1109 C SER A 65 1.234 2.040 19.224 1.00 0.00 C ATOM 1110 O SER A 65 0.884 3.078 19.790 1.00 0.00 O ATOM 1111 CB SER A 65 3.730 1.853 19.395 1.00 0.00 C ATOM 1112 OG SER A 65 4.806 1.214 20.064 1.00 0.00 O ATOM 0 H SER A 65 2.834 -0.367 18.473 1.00 0.00 H new ATOM 0 HA SER A 65 2.285 1.212 20.872 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.871 1.781 18.317 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.718 2.914 19.645 1.00 0.00 H new ATOM 0 HG SER A 65 5.651 1.634 19.800 1.00 0.00 H new ATOM 1118 N GLY A 66 0.637 1.603 18.107 1.00 0.00 N ATOM 1119 CA GLY A 66 -0.449 2.317 17.424 1.00 0.00 C ATOM 1120 C GLY A 66 0.027 3.522 16.600 1.00 0.00 C ATOM 1121 O GLY A 66 -0.789 4.294 16.097 1.00 0.00 O ATOM 0 H GLY A 66 0.899 0.731 17.646 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.972 1.622 16.767 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.171 2.658 18.166 1.00 0.00 H new ATOM 1125 N GLU A 67 1.344 3.694 16.475 1.00 0.00 N ATOM 1126 CA GLU A 67 1.990 4.833 15.819 1.00 0.00 C ATOM 1127 C GLU A 67 2.061 4.669 14.293 1.00 0.00 C ATOM 1128 O GLU A 67 2.077 3.547 13.783 1.00 0.00 O ATOM 1129 CB GLU A 67 3.369 5.068 16.461 1.00 0.00 C ATOM 1130 CG GLU A 67 4.431 4.013 16.115 1.00 0.00 C ATOM 1131 CD GLU A 67 5.767 4.336 16.815 1.00 0.00 C ATOM 1132 OE1 GLU A 67 6.602 5.069 16.232 1.00 0.00 O ATOM 1133 OE2 GLU A 67 5.989 3.861 17.954 1.00 0.00 O ATOM 0 H GLU A 67 2.015 3.019 16.841 1.00 0.00 H new ATOM 0 HA GLU A 67 1.381 5.723 15.975 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.736 6.047 16.152 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.249 5.100 17.544 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.084 3.026 16.421 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.579 3.979 15.036 1.00 0.00 H new ATOM 1140 N LEU A 68 2.127 5.781 13.557 1.00 0.00 N ATOM 1141 CA LEU A 68 2.256 5.775 12.096 1.00 0.00 C ATOM 1142 C LEU A 68 3.680 5.361 11.673 1.00 0.00 C ATOM 1143 O LEU A 68 4.663 5.974 12.096 1.00 0.00 O ATOM 1144 CB LEU A 68 1.879 7.168 11.550 1.00 0.00 C ATOM 1145 CG LEU A 68 1.758 7.226 10.014 1.00 0.00 C ATOM 1146 CD1 LEU A 68 0.454 6.597 9.526 1.00 0.00 C ATOM 1147 CD2 LEU A 68 1.776 8.675 9.527 1.00 0.00 C ATOM 0 H LEU A 68 2.092 6.717 13.960 1.00 0.00 H new ATOM 0 HA LEU A 68 1.574 5.038 11.671 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.931 7.476 11.991 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.630 7.889 11.873 1.00 0.00 H new ATOM 0 HG LEU A 68 2.607 6.671 9.615 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.406 6.657 8.439 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.417 5.552 9.834 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.392 7.133 9.957 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.690 8.695 8.441 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.939 9.217 9.968 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.712 9.147 9.825 1.00 0.00 H new ATOM 1159 N PHE A 69 3.786 4.361 10.796 1.00 0.00 N ATOM 1160 CA PHE A 69 5.033 3.973 10.127 1.00 0.00 C ATOM 1161 C PHE A 69 5.276 4.834 8.876 1.00 0.00 C ATOM 1162 O PHE A 69 6.320 5.480 8.753 1.00 0.00 O ATOM 1163 CB PHE A 69 4.982 2.474 9.790 1.00 0.00 C ATOM 1164 CG PHE A 69 6.089 2.002 8.862 1.00 0.00 C ATOM 1165 CD1 PHE A 69 5.824 1.762 7.499 1.00 0.00 C ATOM 1166 CD2 PHE A 69 7.398 1.839 9.354 1.00 0.00 C ATOM 1167 CE1 PHE A 69 6.864 1.382 6.634 1.00 0.00 C ATOM 1168 CE2 PHE A 69 8.435 1.438 8.491 1.00 0.00 C ATOM 1169 CZ PHE A 69 8.168 1.212 7.130 1.00 0.00 C ATOM 0 H PHE A 69 2.990 3.784 10.524 1.00 0.00 H new ATOM 0 HA PHE A 69 5.875 4.148 10.797 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.034 1.903 10.717 1.00 0.00 H new ATOM 0 HB3 PHE A 69 4.019 2.250 9.331 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.819 1.870 7.118 1.00 0.00 H new ATOM 0 HD2 PHE A 69 7.607 2.022 10.398 1.00 0.00 H new ATOM 0 HE1 PHE A 69 6.661 1.220 5.586 1.00 0.00 H new ATOM 0 HE2 PHE A 69 9.436 1.304 8.875 1.00 0.00 H new ATOM 0 HZ PHE A 69 8.964 0.908 6.466 1.00 0.00 H new ATOM 1179 N ALA A 70 4.297 4.862 7.968 1.00 0.00 N ATOM 1180 CA ALA A 70 4.317 5.616 6.714 1.00 0.00 C ATOM 1181 C ALA A 70 2.885 5.826 6.186 1.00 0.00 C ATOM 1182 O ALA A 70 1.956 5.142 6.622 1.00 0.00 O ATOM 1183 CB ALA A 70 5.156 4.831 5.695 1.00 0.00 C ATOM 0 H ALA A 70 3.432 4.337 8.093 1.00 0.00 H new ATOM 0 HA ALA A 70 4.756 6.600 6.879 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.185 5.375 4.751 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.170 4.710 6.075 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.709 3.850 5.535 1.00 0.00 H new ATOM 1189 N GLN A 71 2.697 6.730 5.218 1.00 0.00 N ATOM 1190 CA GLN A 71 1.434 6.843 4.475 1.00 0.00 C ATOM 1191 C GLN A 71 1.634 7.230 3.005 1.00 0.00 C ATOM 1192 O GLN A 71 2.508 8.039 2.694 1.00 0.00 O ATOM 1193 CB GLN A 71 0.450 7.777 5.202 1.00 0.00 C ATOM 1194 CG GLN A 71 0.883 9.250 5.327 1.00 0.00 C ATOM 1195 CD GLN A 71 0.598 10.111 4.093 1.00 0.00 C ATOM 1196 OE1 GLN A 71 -0.231 9.810 3.245 1.00 0.00 O ATOM 1197 NE2 GLN A 71 1.254 11.244 3.973 1.00 0.00 N ATOM 0 H GLN A 71 3.409 7.400 4.928 1.00 0.00 H new ATOM 0 HA GLN A 71 0.988 5.849 4.451 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.506 7.743 4.679 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.279 7.383 6.204 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.376 9.691 6.185 1.00 0.00 H new ATOM 0 HG3 GLN A 71 1.952 9.283 5.536 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.948 11.508 4.672 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.069 11.859 3.181 1.00 0.00 H new ATOM 1206 N ALA A 72 0.824 6.662 2.110 1.00 0.00 N ATOM 1207 CA ALA A 72 0.831 6.941 0.672 1.00 0.00 C ATOM 1208 C ALA A 72 -0.477 7.633 0.226 1.00 0.00 C ATOM 1209 O ALA A 72 -1.532 6.987 0.244 1.00 0.00 O ATOM 1210 CB ALA A 72 1.088 5.627 -0.078 1.00 0.00 C ATOM 0 H ALA A 72 0.121 5.972 2.375 1.00 0.00 H new ATOM 0 HA ALA A 72 1.631 7.642 0.433 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.096 5.816 -1.151 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.051 5.217 0.226 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.299 4.913 0.158 1.00 0.00 H new ATOM 1216 N PRO A 73 -0.437 8.920 -0.179 1.00 0.00 N ATOM 1217 CA PRO A 73 -1.602 9.646 -0.680 1.00 0.00 C ATOM 1218 C PRO A 73 -1.849 9.356 -2.170 1.00 0.00 C ATOM 1219 O PRO A 73 -0.909 9.289 -2.964 1.00 0.00 O ATOM 1220 CB PRO A 73 -1.294 11.121 -0.416 1.00 0.00 C ATOM 1221 CG PRO A 73 0.222 11.188 -0.593 1.00 0.00 C ATOM 1222 CD PRO A 73 0.710 9.821 -0.106 1.00 0.00 C ATOM 0 HA PRO A 73 -2.522 9.340 -0.182 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.812 11.774 -1.118 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.598 11.425 0.586 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.495 11.362 -1.634 1.00 0.00 H new ATOM 0 HG3 PRO A 73 0.657 11.999 -0.009 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.529 9.458 -0.727 1.00 0.00 H new ATOM 0 HD3 PRO A 73 1.088 9.885 0.914 1.00 0.00 H new ATOM 1230 N VAL A 74 -3.115 9.211 -2.566 1.00 0.00 N ATOM 1231 CA VAL A 74 -3.547 8.817 -3.921 1.00 0.00 C ATOM 1232 C VAL A 74 -4.667 9.741 -4.398 1.00 0.00 C ATOM 1233 O VAL A 74 -5.661 9.900 -3.693 1.00 0.00 O ATOM 1234 CB VAL A 74 -4.059 7.354 -3.961 1.00 0.00 C ATOM 1235 CG1 VAL A 74 -3.936 6.784 -5.375 1.00 0.00 C ATOM 1236 CG2 VAL A 74 -3.356 6.392 -2.996 1.00 0.00 C ATOM 0 H VAL A 74 -3.900 9.369 -1.934 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.679 8.898 -4.575 1.00 0.00 H new ATOM 0 HB VAL A 74 -5.098 7.422 -3.639 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.300 5.756 -5.386 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.529 7.386 -6.063 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.891 6.803 -5.685 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.785 5.395 -3.099 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.292 6.355 -3.230 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.491 6.741 -1.972 1.00 0.00 H new ATOM 1246 N GLU A 75 -4.553 10.329 -5.591 1.00 0.00 N ATOM 1247 CA GLU A 75 -5.605 11.209 -6.149 1.00 0.00 C ATOM 1248 C GLU A 75 -6.641 10.450 -7.002 1.00 0.00 C ATOM 1249 O GLU A 75 -7.770 10.909 -7.172 1.00 0.00 O ATOM 1250 CB GLU A 75 -4.961 12.342 -6.965 1.00 0.00 C ATOM 1251 CG GLU A 75 -4.118 13.287 -6.097 1.00 0.00 C ATOM 1252 CD GLU A 75 -3.572 14.459 -6.934 1.00 0.00 C ATOM 1253 OE1 GLU A 75 -2.502 14.309 -7.572 1.00 0.00 O ATOM 1254 OE2 GLU A 75 -4.205 15.544 -6.958 1.00 0.00 O ATOM 0 H GLU A 75 -3.742 10.216 -6.199 1.00 0.00 H new ATOM 0 HA GLU A 75 -6.152 11.627 -5.304 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.332 11.912 -7.744 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.742 12.914 -7.466 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.724 13.672 -5.277 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.290 12.736 -5.651 1.00 0.00 H new ATOM 1261 N GLN A 76 -6.254 9.293 -7.552 1.00 0.00 N ATOM 1262 CA GLN A 76 -7.121 8.331 -8.249 1.00 0.00 C ATOM 1263 C GLN A 76 -6.410 6.973 -8.392 1.00 0.00 C ATOM 1264 O GLN A 76 -5.182 6.919 -8.490 1.00 0.00 O ATOM 1265 CB GLN A 76 -7.615 8.859 -9.618 1.00 0.00 C ATOM 1266 CG GLN A 76 -6.699 9.812 -10.411 1.00 0.00 C ATOM 1267 CD GLN A 76 -5.345 9.222 -10.797 1.00 0.00 C ATOM 1268 OE1 GLN A 76 -5.225 8.422 -11.714 1.00 0.00 O ATOM 1269 NE2 GLN A 76 -4.269 9.613 -10.142 1.00 0.00 N ATOM 0 H GLN A 76 -5.282 8.986 -7.523 1.00 0.00 H new ATOM 0 HA GLN A 76 -8.012 8.193 -7.637 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.824 7.996 -10.251 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.563 9.371 -9.454 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -7.218 10.121 -11.319 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.532 10.711 -9.818 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.353 10.280 -9.375 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.353 9.249 -10.403 1.00 0.00 H new ATOM 1278 N TYR A 77 -7.173 5.877 -8.400 1.00 0.00 N ATOM 1279 CA TYR A 77 -6.665 4.504 -8.476 1.00 0.00 C ATOM 1280 C TYR A 77 -7.309 3.724 -9.648 1.00 0.00 C ATOM 1281 O TYR A 77 -8.542 3.723 -9.752 1.00 0.00 O ATOM 1282 CB TYR A 77 -6.902 3.809 -7.127 1.00 0.00 C ATOM 1283 CG TYR A 77 -6.354 2.401 -7.088 1.00 0.00 C ATOM 1284 CD1 TYR A 77 -7.231 1.303 -7.106 1.00 0.00 C ATOM 1285 CD2 TYR A 77 -4.966 2.194 -7.124 1.00 0.00 C ATOM 1286 CE1 TYR A 77 -6.726 -0.008 -7.194 1.00 0.00 C ATOM 1287 CE2 TYR A 77 -4.458 0.890 -7.264 1.00 0.00 C ATOM 1288 CZ TYR A 77 -5.332 -0.215 -7.304 1.00 0.00 C ATOM 1289 OH TYR A 77 -4.821 -1.463 -7.483 1.00 0.00 O ATOM 0 H TYR A 77 -8.191 5.921 -8.352 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.594 4.527 -8.678 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.438 4.396 -6.335 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -7.972 3.783 -6.920 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -8.297 1.466 -7.052 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.291 3.033 -7.044 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -7.400 -0.852 -7.178 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -3.392 0.734 -7.341 1.00 0.00 H new ATOM 0 HH TYR A 77 -3.844 -1.412 -7.538 1.00 0.00 H new ATOM 1299 N PRO A 78 -6.534 3.043 -10.520 1.00 0.00 N ATOM 1300 CA PRO A 78 -5.067 2.960 -10.544 1.00 0.00 C ATOM 1301 C PRO A 78 -4.385 4.301 -10.873 1.00 0.00 C ATOM 1302 O PRO A 78 -4.886 5.089 -11.676 1.00 0.00 O ATOM 1303 CB PRO A 78 -4.733 1.881 -11.579 1.00 0.00 C ATOM 1304 CG PRO A 78 -5.912 1.946 -12.548 1.00 0.00 C ATOM 1305 CD PRO A 78 -7.085 2.266 -11.624 1.00 0.00 C ATOM 0 HA PRO A 78 -4.685 2.707 -9.555 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -3.788 2.085 -12.082 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.644 0.897 -11.119 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -5.771 2.716 -13.306 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -6.056 1.003 -13.075 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -7.853 2.831 -12.152 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -7.555 1.352 -11.260 1.00 0.00 H new ATOM 1313 N GLY A 79 -3.234 4.550 -10.238 1.00 0.00 N ATOM 1314 CA GLY A 79 -2.458 5.794 -10.350 1.00 0.00 C ATOM 1315 C GLY A 79 -1.039 5.689 -9.771 1.00 0.00 C ATOM 1316 O GLY A 79 -0.560 4.596 -9.464 1.00 0.00 O ATOM 0 H GLY A 79 -2.802 3.871 -9.612 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.393 6.078 -11.400 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.993 6.593 -9.836 1.00 0.00 H new ATOM 1320 N ILE A 80 -0.354 6.828 -9.614 1.00 0.00 N ATOM 1321 CA ILE A 80 1.085 6.904 -9.282 1.00 0.00 C ATOM 1322 C ILE A 80 1.468 6.219 -7.960 1.00 0.00 C ATOM 1323 O ILE A 80 2.511 5.572 -7.869 1.00 0.00 O ATOM 1324 CB ILE A 80 1.551 8.385 -9.300 1.00 0.00 C ATOM 1325 CG1 ILE A 80 3.037 8.587 -8.926 1.00 0.00 C ATOM 1326 CG2 ILE A 80 0.720 9.302 -8.377 1.00 0.00 C ATOM 1327 CD1 ILE A 80 4.031 7.881 -9.852 1.00 0.00 C ATOM 0 H ILE A 80 -0.788 7.745 -9.715 1.00 0.00 H new ATOM 0 HA ILE A 80 1.609 6.339 -10.053 1.00 0.00 H new ATOM 0 HB ILE A 80 1.400 8.666 -10.342 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.256 9.655 -8.927 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.193 8.230 -7.908 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.100 10.322 -8.439 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.324 9.284 -8.691 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.796 8.948 -7.349 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.048 8.079 -9.513 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.845 6.807 -9.834 1.00 0.00 H new ATOM 0 HD13 ILE A 80 3.909 8.254 -10.869 1.00 0.00 H new ATOM 1339 N ALA A 81 0.637 6.352 -6.927 1.00 0.00 N ATOM 1340 CA ALA A 81 0.993 5.989 -5.556 1.00 0.00 C ATOM 1341 C ALA A 81 0.686 4.532 -5.179 1.00 0.00 C ATOM 1342 O ALA A 81 0.901 4.168 -4.025 1.00 0.00 O ATOM 1343 CB ALA A 81 0.344 7.010 -4.618 1.00 0.00 C ATOM 0 H ALA A 81 -0.311 6.718 -7.019 1.00 0.00 H new ATOM 0 HA ALA A 81 2.078 6.031 -5.457 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.592 6.765 -3.585 1.00 0.00 H new ATOM 0 HB2 ALA A 81 0.715 8.008 -4.853 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.738 6.986 -4.746 1.00 0.00 H new ATOM 1349 N VAL A 82 0.208 3.706 -6.117 1.00 0.00 N ATOM 1350 CA VAL A 82 -0.189 2.305 -5.871 1.00 0.00 C ATOM 1351 C VAL A 82 -0.013 1.456 -7.141 1.00 0.00 C ATOM 1352 O VAL A 82 -0.591 1.752 -8.186 1.00 0.00 O ATOM 1353 CB VAL A 82 -1.656 2.197 -5.402 1.00 0.00 C ATOM 1354 CG1 VAL A 82 -1.985 0.768 -4.940 1.00 0.00 C ATOM 1355 CG2 VAL A 82 -2.074 3.145 -4.270 1.00 0.00 C ATOM 0 H VAL A 82 0.082 3.993 -7.088 1.00 0.00 H new ATOM 0 HA VAL A 82 0.461 1.930 -5.081 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.217 2.489 -6.290 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -3.024 0.721 -4.615 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.831 0.074 -5.766 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.333 0.495 -4.110 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.123 2.979 -4.025 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.461 2.953 -3.389 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.935 4.178 -4.590 1.00 0.00 H new ATOM 1365 N GLU A 83 0.755 0.373 -7.041 1.00 0.00 N ATOM 1366 CA GLU A 83 1.128 -0.540 -8.129 1.00 0.00 C ATOM 1367 C GLU A 83 1.151 -2.013 -7.691 1.00 0.00 C ATOM 1368 O GLU A 83 1.111 -2.326 -6.504 1.00 0.00 O ATOM 1369 CB GLU A 83 2.505 -0.136 -8.691 1.00 0.00 C ATOM 1370 CG GLU A 83 2.360 0.825 -9.875 1.00 0.00 C ATOM 1371 CD GLU A 83 1.733 0.184 -11.134 1.00 0.00 C ATOM 1372 OE1 GLU A 83 1.539 -1.055 -11.178 1.00 0.00 O ATOM 1373 OE2 GLU A 83 1.440 0.929 -12.100 1.00 0.00 O ATOM 0 H GLU A 83 1.159 0.089 -6.148 1.00 0.00 H new ATOM 0 HA GLU A 83 0.364 -0.453 -8.901 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.097 0.336 -7.907 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.047 -1.027 -9.007 1.00 0.00 H new ATOM 0 HG2 GLU A 83 1.747 1.673 -9.568 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.343 1.219 -10.132 1.00 0.00 H new ATOM 1380 N THR A 84 1.216 -2.923 -8.661 1.00 0.00 N ATOM 1381 CA THR A 84 1.036 -4.380 -8.485 1.00 0.00 C ATOM 1382 C THR A 84 2.267 -5.172 -8.943 1.00 0.00 C ATOM 1383 O THR A 84 3.081 -4.697 -9.742 1.00 0.00 O ATOM 1384 CB THR A 84 -0.210 -4.860 -9.254 1.00 0.00 C ATOM 1385 OG1 THR A 84 -0.060 -4.669 -10.646 1.00 0.00 O ATOM 1386 CG2 THR A 84 -1.474 -4.103 -8.834 1.00 0.00 C ATOM 0 H THR A 84 1.402 -2.666 -9.630 1.00 0.00 H new ATOM 0 HA THR A 84 0.901 -4.563 -7.419 1.00 0.00 H new ATOM 0 HB THR A 84 -0.311 -5.919 -9.016 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.865 -4.984 -11.108 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.327 -4.475 -9.402 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.653 -4.256 -7.770 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.343 -3.039 -9.031 1.00 0.00 H new ATOM 1394 N VAL A 85 2.408 -6.403 -8.444 1.00 0.00 N ATOM 1395 CA VAL A 85 3.351 -7.400 -8.976 1.00 0.00 C ATOM 1396 C VAL A 85 2.728 -8.159 -10.162 1.00 0.00 C ATOM 1397 O VAL A 85 1.513 -8.114 -10.378 1.00 0.00 O ATOM 1398 CB VAL A 85 3.802 -8.389 -7.891 1.00 0.00 C ATOM 1399 CG1 VAL A 85 4.421 -7.650 -6.705 1.00 0.00 C ATOM 1400 CG2 VAL A 85 2.660 -9.267 -7.390 1.00 0.00 C ATOM 0 H VAL A 85 1.866 -6.743 -7.650 1.00 0.00 H new ATOM 0 HA VAL A 85 4.232 -6.861 -9.325 1.00 0.00 H new ATOM 0 HB VAL A 85 4.547 -9.034 -8.356 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.733 -8.371 -5.949 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.287 -7.081 -7.043 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.685 -6.970 -6.276 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.033 -9.948 -6.625 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.877 -8.638 -6.966 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.253 -9.843 -8.221 1.00 0.00 H new ATOM 1410 N THR A 86 3.536 -8.918 -10.900 1.00 0.00 N ATOM 1411 CA THR A 86 3.113 -9.720 -12.063 1.00 0.00 C ATOM 1412 C THR A 86 2.840 -11.190 -11.729 1.00 0.00 C ATOM 1413 O THR A 86 2.072 -11.848 -12.434 1.00 0.00 O ATOM 1414 CB THR A 86 4.179 -9.652 -13.167 1.00 0.00 C ATOM 1415 OG1 THR A 86 5.385 -10.233 -12.721 1.00 0.00 O ATOM 1416 CG2 THR A 86 4.492 -8.208 -13.558 1.00 0.00 C ATOM 0 H THR A 86 4.534 -8.999 -10.705 1.00 0.00 H new ATOM 0 HA THR A 86 2.172 -9.285 -12.401 1.00 0.00 H new ATOM 0 HB THR A 86 3.776 -10.190 -14.025 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.055 -10.184 -13.435 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.250 -8.199 -14.341 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.586 -7.726 -13.925 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.864 -7.668 -12.687 1.00 0.00 H new ATOM 1424 N ASP A 87 3.457 -11.715 -10.664 1.00 0.00 N ATOM 1425 CA ASP A 87 3.525 -13.159 -10.395 1.00 0.00 C ATOM 1426 C ASP A 87 2.485 -13.664 -9.380 1.00 0.00 C ATOM 1427 O ASP A 87 1.933 -14.751 -9.570 1.00 0.00 O ATOM 1428 CB ASP A 87 4.945 -13.506 -9.935 1.00 0.00 C ATOM 1429 CG ASP A 87 5.147 -15.026 -9.807 1.00 0.00 C ATOM 1430 OD1 ASP A 87 5.120 -15.551 -8.668 1.00 0.00 O ATOM 1431 OD2 ASP A 87 5.341 -15.699 -10.848 1.00 0.00 O ATOM 0 H ASP A 87 3.927 -11.147 -9.959 1.00 0.00 H new ATOM 0 HA ASP A 87 3.280 -13.671 -11.326 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.666 -13.102 -10.645 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.143 -13.031 -8.974 1.00 0.00 H new ATOM 1436 N SER A 88 2.206 -12.895 -8.317 1.00 0.00 N ATOM 1437 CA SER A 88 1.323 -13.346 -7.219 1.00 0.00 C ATOM 1438 C SER A 88 0.364 -12.265 -6.708 1.00 0.00 C ATOM 1439 O SER A 88 0.781 -11.198 -6.268 1.00 0.00 O ATOM 1440 CB SER A 88 2.165 -13.919 -6.075 1.00 0.00 C ATOM 1441 OG SER A 88 1.317 -14.447 -5.070 1.00 0.00 O ATOM 0 H SER A 88 2.578 -11.954 -8.190 1.00 0.00 H new ATOM 0 HA SER A 88 0.684 -14.126 -7.634 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.825 -14.700 -6.453 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.801 -13.140 -5.654 1.00 0.00 H new ATOM 0 HG SER A 88 1.861 -14.813 -4.342 1.00 0.00 H new ATOM 1447 N SER A 89 -0.942 -12.548 -6.719 1.00 0.00 N ATOM 1448 CA SER A 89 -2.030 -11.573 -6.506 1.00 0.00 C ATOM 1449 C SER A 89 -2.232 -11.102 -5.049 1.00 0.00 C ATOM 1450 O SER A 89 -3.342 -10.717 -4.672 1.00 0.00 O ATOM 1451 CB SER A 89 -3.340 -12.120 -7.097 1.00 0.00 C ATOM 1452 OG SER A 89 -3.147 -12.561 -8.434 1.00 0.00 O ATOM 0 H SER A 89 -1.289 -13.493 -6.882 1.00 0.00 H new ATOM 0 HA SER A 89 -1.718 -10.671 -7.032 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.702 -12.947 -6.486 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.106 -11.345 -7.072 1.00 0.00 H new ATOM 0 HG SER A 89 -3.992 -12.906 -8.790 1.00 0.00 H new ATOM 1458 N ARG A 90 -1.183 -11.138 -4.213 1.00 0.00 N ATOM 1459 CA ARG A 90 -1.198 -10.724 -2.795 1.00 0.00 C ATOM 1460 C ARG A 90 -0.140 -9.668 -2.415 1.00 0.00 C ATOM 1461 O ARG A 90 0.158 -9.505 -1.231 1.00 0.00 O ATOM 1462 CB ARG A 90 -1.283 -11.957 -1.873 1.00 0.00 C ATOM 1463 CG ARG A 90 0.036 -12.718 -1.736 1.00 0.00 C ATOM 1464 CD ARG A 90 -0.093 -13.976 -0.867 1.00 0.00 C ATOM 1465 NE ARG A 90 1.241 -14.525 -0.564 1.00 0.00 N ATOM 1466 CZ ARG A 90 1.540 -15.656 0.045 1.00 0.00 C ATOM 1467 NH1 ARG A 90 2.787 -16.014 0.134 1.00 0.00 N ATOM 1468 NH2 ARG A 90 0.645 -16.438 0.575 1.00 0.00 N ATOM 0 H ARG A 90 -0.266 -11.468 -4.514 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.115 -10.159 -2.630 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.612 -11.637 -0.884 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.044 -12.635 -2.258 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.392 -13.001 -2.727 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.788 -12.058 -1.303 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.614 -13.735 0.060 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.693 -14.724 -1.385 1.00 0.00 H new ATOM 0 HE ARG A 90 2.034 -13.958 -0.864 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.517 -15.423 -0.264 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.035 -16.886 0.602 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.343 -16.187 0.531 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.931 -17.302 1.035 1.00 0.00 H new ATOM 1482 N TYR A 91 0.423 -8.944 -3.393 1.00 0.00 N ATOM 1483 CA TYR A 91 1.559 -8.032 -3.202 1.00 0.00 C ATOM 1484 C TYR A 91 1.408 -6.736 -4.021 1.00 0.00 C ATOM 1485 O TYR A 91 0.947 -6.767 -5.166 1.00 0.00 O ATOM 1486 CB TYR A 91 2.851 -8.757 -3.604 1.00 0.00 C ATOM 1487 CG TYR A 91 3.193 -10.003 -2.809 1.00 0.00 C ATOM 1488 CD1 TYR A 91 3.854 -9.883 -1.573 1.00 0.00 C ATOM 1489 CD2 TYR A 91 2.874 -11.279 -3.314 1.00 0.00 C ATOM 1490 CE1 TYR A 91 4.158 -11.031 -0.817 1.00 0.00 C ATOM 1491 CE2 TYR A 91 3.219 -12.432 -2.584 1.00 0.00 C ATOM 1492 CZ TYR A 91 3.846 -12.311 -1.326 1.00 0.00 C ATOM 1493 OH TYR A 91 4.127 -13.431 -0.605 1.00 0.00 O ATOM 0 H TYR A 91 0.095 -8.977 -4.358 1.00 0.00 H new ATOM 0 HA TYR A 91 1.593 -7.745 -2.151 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.777 -9.031 -4.656 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.680 -8.055 -3.515 1.00 0.00 H new ATOM 0 HD1 TYR A 91 4.129 -8.907 -1.203 1.00 0.00 H new ATOM 0 HD2 TYR A 91 2.365 -11.373 -4.262 1.00 0.00 H new ATOM 0 HE1 TYR A 91 4.629 -10.933 0.150 1.00 0.00 H new ATOM 0 HE2 TYR A 91 3.003 -13.410 -2.987 1.00 0.00 H new ATOM 0 HH TYR A 91 4.082 -13.224 0.352 1.00 0.00 H new ATOM 1503 N PHE A 92 1.833 -5.603 -3.451 1.00 0.00 N ATOM 1504 CA PHE A 92 1.717 -4.260 -4.043 1.00 0.00 C ATOM 1505 C PHE A 92 2.952 -3.402 -3.760 1.00 0.00 C ATOM 1506 O PHE A 92 3.651 -3.634 -2.779 1.00 0.00 O ATOM 1507 CB PHE A 92 0.486 -3.535 -3.473 1.00 0.00 C ATOM 1508 CG PHE A 92 -0.822 -4.241 -3.738 1.00 0.00 C ATOM 1509 CD1 PHE A 92 -1.488 -4.065 -4.963 1.00 0.00 C ATOM 1510 CD2 PHE A 92 -1.358 -5.102 -2.766 1.00 0.00 C ATOM 1511 CE1 PHE A 92 -2.670 -4.777 -5.231 1.00 0.00 C ATOM 1512 CE2 PHE A 92 -2.552 -5.791 -3.024 1.00 0.00 C ATOM 1513 CZ PHE A 92 -3.197 -5.647 -4.264 1.00 0.00 C ATOM 0 H PHE A 92 2.282 -5.592 -2.535 1.00 0.00 H new ATOM 0 HA PHE A 92 1.621 -4.395 -5.120 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.612 -3.419 -2.397 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.438 -2.533 -3.899 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.091 -3.382 -5.699 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -0.851 -5.233 -1.821 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.172 -4.655 -6.179 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -2.977 -6.434 -2.267 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.098 -6.205 -4.473 1.00 0.00 H new ATOM 1523 N VAL A 93 3.194 -2.371 -4.566 1.00 0.00 N ATOM 1524 CA VAL A 93 4.111 -1.269 -4.237 1.00 0.00 C ATOM 1525 C VAL A 93 3.293 0.002 -4.011 1.00 0.00 C ATOM 1526 O VAL A 93 2.373 0.264 -4.782 1.00 0.00 O ATOM 1527 CB VAL A 93 5.174 -1.081 -5.336 1.00 0.00 C ATOM 1528 CG1 VAL A 93 6.166 0.039 -5.010 1.00 0.00 C ATOM 1529 CG2 VAL A 93 5.984 -2.366 -5.525 1.00 0.00 C ATOM 0 H VAL A 93 2.755 -2.271 -5.481 1.00 0.00 H new ATOM 0 HA VAL A 93 4.654 -1.506 -3.322 1.00 0.00 H new ATOM 0 HB VAL A 93 4.625 -0.822 -6.241 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.893 0.128 -5.818 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.628 0.981 -4.900 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.684 -0.193 -4.080 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.730 -2.214 -6.305 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.483 -2.622 -4.591 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.316 -3.178 -5.814 1.00 0.00 H new ATOM 1539 N ILE A 94 3.609 0.810 -2.995 1.00 0.00 N ATOM 1540 CA ILE A 94 2.985 2.128 -2.798 1.00 0.00 C ATOM 1541 C ILE A 94 4.025 3.239 -2.657 1.00 0.00 C ATOM 1542 O ILE A 94 5.107 3.022 -2.104 1.00 0.00 O ATOM 1543 CB ILE A 94 1.940 2.169 -1.656 1.00 0.00 C ATOM 1544 CG1 ILE A 94 2.481 1.929 -0.230 1.00 0.00 C ATOM 1545 CG2 ILE A 94 0.735 1.266 -1.960 1.00 0.00 C ATOM 1546 CD1 ILE A 94 2.682 0.470 0.195 1.00 0.00 C ATOM 0 H ILE A 94 4.303 0.573 -2.286 1.00 0.00 H new ATOM 0 HA ILE A 94 2.421 2.315 -3.712 1.00 0.00 H new ATOM 0 HB ILE A 94 1.615 3.209 -1.640 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.437 2.445 -0.138 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.796 2.398 0.477 1.00 0.00 H new ATOM 0 HG21 ILE A 94 0.023 1.320 -1.137 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.253 1.599 -2.879 1.00 0.00 H new ATOM 0 HG23 ILE A 94 1.073 0.237 -2.080 1.00 0.00 H new ATOM 0 HD11 ILE A 94 3.065 0.438 1.215 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.729 -0.057 0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.395 -0.009 -0.476 1.00 0.00 H new ATOM 1558 N ARG A 95 3.692 4.442 -3.144 1.00 0.00 N ATOM 1559 CA ARG A 95 4.544 5.637 -3.006 1.00 0.00 C ATOM 1560 C ARG A 95 4.178 6.399 -1.735 1.00 0.00 C ATOM 1561 O ARG A 95 3.283 7.242 -1.748 1.00 0.00 O ATOM 1562 CB ARG A 95 4.498 6.522 -4.267 1.00 0.00 C ATOM 1563 CG ARG A 95 5.737 7.430 -4.324 1.00 0.00 C ATOM 1564 CD ARG A 95 5.682 8.392 -5.514 1.00 0.00 C ATOM 1565 NE ARG A 95 6.868 9.271 -5.540 1.00 0.00 N ATOM 1566 CZ ARG A 95 7.385 9.898 -6.580 1.00 0.00 C ATOM 1567 NH1 ARG A 95 8.446 10.630 -6.415 1.00 0.00 N ATOM 1568 NH2 ARG A 95 6.874 9.821 -7.775 1.00 0.00 N ATOM 0 H ARG A 95 2.822 4.617 -3.647 1.00 0.00 H new ATOM 0 HA ARG A 95 5.581 5.316 -2.909 1.00 0.00 H new ATOM 0 HB2 ARG A 95 4.456 5.896 -5.158 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.593 7.129 -4.261 1.00 0.00 H new ATOM 0 HG2 ARG A 95 5.812 8.001 -3.398 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.635 6.816 -4.394 1.00 0.00 H new ATOM 0 HD2 ARG A 95 5.626 7.824 -6.443 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.778 8.997 -5.455 1.00 0.00 H new ATOM 0 HE ARG A 95 7.344 9.410 -4.649 1.00 0.00 H new ATOM 0 HH11 ARG A 95 8.869 10.714 -5.491 1.00 0.00 H new ATOM 0 HH12 ARG A 95 8.856 11.120 -7.210 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.039 9.258 -7.937 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.309 10.324 -8.549 1.00 0.00 H new ATOM 1582 N ILE A 96 4.865 6.098 -0.636 1.00 0.00 N ATOM 1583 CA ILE A 96 4.685 6.803 0.640 1.00 0.00 C ATOM 1584 C ILE A 96 5.326 8.197 0.600 1.00 0.00 C ATOM 1585 O ILE A 96 6.262 8.439 -0.168 1.00 0.00 O ATOM 1586 CB ILE A 96 5.096 5.953 1.865 1.00 0.00 C ATOM 1587 CG1 ILE A 96 6.604 5.624 1.974 1.00 0.00 C ATOM 1588 CG2 ILE A 96 4.289 4.646 1.916 1.00 0.00 C ATOM 1589 CD1 ILE A 96 7.408 6.659 2.767 1.00 0.00 C ATOM 0 H ILE A 96 5.565 5.357 -0.600 1.00 0.00 H new ATOM 0 HA ILE A 96 3.616 6.964 0.776 1.00 0.00 H new ATOM 0 HB ILE A 96 4.868 6.590 2.719 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.720 4.648 2.446 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.022 5.544 0.971 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.594 4.064 2.785 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.226 4.877 1.989 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.473 4.069 1.010 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.455 6.359 2.799 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.324 7.633 2.284 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.017 6.723 3.783 1.00 0.00 H new ATOM 1601 N GLN A 97 4.807 9.133 1.393 1.00 0.00 N ATOM 1602 CA GLN A 97 5.354 10.480 1.592 1.00 0.00 C ATOM 1603 C GLN A 97 5.622 10.756 3.080 1.00 0.00 C ATOM 1604 O GLN A 97 4.918 10.257 3.959 1.00 0.00 O ATOM 1605 CB GLN A 97 4.424 11.562 0.997 1.00 0.00 C ATOM 1606 CG GLN A 97 4.749 11.986 -0.448 1.00 0.00 C ATOM 1607 CD GLN A 97 4.040 11.183 -1.538 1.00 0.00 C ATOM 1608 OE1 GLN A 97 3.080 11.634 -2.144 1.00 0.00 O ATOM 1609 NE2 GLN A 97 4.480 9.988 -1.860 1.00 0.00 N ATOM 0 H GLN A 97 3.960 8.970 1.938 1.00 0.00 H new ATOM 0 HA GLN A 97 6.304 10.526 1.060 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.399 11.194 1.028 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.465 12.445 1.635 1.00 0.00 H new ATOM 0 HG2 GLN A 97 4.490 13.038 -0.568 1.00 0.00 H new ATOM 0 HG3 GLN A 97 5.825 11.903 -0.600 1.00 0.00 H new ATOM 0 HE21 GLN A 97 5.280 9.590 -1.369 1.00 0.00 H new ATOM 0 HE22 GLN A 97 4.022 9.458 -2.601 1.00 0.00 H new ATOM 1618 N ASP A 98 6.620 11.600 3.357 1.00 0.00 N ATOM 1619 CA ASP A 98 7.055 11.982 4.713 1.00 0.00 C ATOM 1620 C ASP A 98 6.497 13.353 5.171 1.00 0.00 C ATOM 1621 O ASP A 98 7.010 13.984 6.095 1.00 0.00 O ATOM 1622 CB ASP A 98 8.588 11.890 4.767 1.00 0.00 C ATOM 1623 CG ASP A 98 9.179 11.929 6.188 1.00 0.00 C ATOM 1624 OD1 ASP A 98 8.621 11.285 7.108 1.00 0.00 O ATOM 1625 OD2 ASP A 98 10.261 12.541 6.362 1.00 0.00 O ATOM 0 H ASP A 98 7.167 12.053 2.625 1.00 0.00 H new ATOM 0 HA ASP A 98 6.634 11.286 5.438 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.901 10.966 4.282 1.00 0.00 H new ATOM 0 HB3 ASP A 98 9.010 12.712 4.189 1.00 0.00 H new ATOM 1630 N GLY A 99 5.452 13.845 4.493 1.00 0.00 N ATOM 1631 CA GLY A 99 4.724 15.082 4.827 1.00 0.00 C ATOM 1632 C GLY A 99 5.418 16.393 4.418 1.00 0.00 C ATOM 1633 O GLY A 99 4.937 17.473 4.766 1.00 0.00 O ATOM 0 H GLY A 99 5.075 13.379 3.668 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.745 15.046 4.350 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.553 15.103 5.903 1.00 0.00 H new ATOM 1637 N THR A 100 6.536 16.310 3.687 1.00 0.00 N ATOM 1638 CA THR A 100 7.400 17.451 3.305 1.00 0.00 C ATOM 1639 C THR A 100 7.758 17.485 1.802 1.00 0.00 C ATOM 1640 O THR A 100 8.547 18.315 1.346 1.00 0.00 O ATOM 1641 CB THR A 100 8.628 17.471 4.240 1.00 0.00 C ATOM 1642 OG1 THR A 100 9.313 18.705 4.186 1.00 0.00 O ATOM 1643 CG2 THR A 100 9.623 16.340 3.964 1.00 0.00 C ATOM 0 H THR A 100 6.882 15.420 3.329 1.00 0.00 H new ATOM 0 HA THR A 100 6.841 18.377 3.442 1.00 0.00 H new ATOM 0 HB THR A 100 8.217 17.323 5.239 1.00 0.00 H new ATOM 0 HG1 THR A 100 9.378 19.002 3.255 1.00 0.00 H new ATOM 0 HG21 THR A 100 10.461 16.415 4.657 1.00 0.00 H new ATOM 0 HG22 THR A 100 9.127 15.379 4.097 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.990 16.420 2.941 1.00 0.00 H new ATOM 1651 N GLY A 101 7.182 16.576 1.000 1.00 0.00 N ATOM 1652 CA GLY A 101 7.465 16.404 -0.440 1.00 0.00 C ATOM 1653 C GLY A 101 8.532 15.340 -0.741 1.00 0.00 C ATOM 1654 O GLY A 101 8.722 14.948 -1.895 1.00 0.00 O ATOM 0 H GLY A 101 6.483 15.917 1.344 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.542 16.134 -0.952 1.00 0.00 H new ATOM 0 HA3 GLY A 101 7.791 17.359 -0.853 1.00 0.00 H new ATOM 1658 N ARG A 102 9.180 14.819 0.309 1.00 0.00 N ATOM 1659 CA ARG A 102 10.000 13.613 0.332 1.00 0.00 C ATOM 1660 C ARG A 102 9.094 12.395 0.170 1.00 0.00 C ATOM 1661 O ARG A 102 8.085 12.270 0.867 1.00 0.00 O ATOM 1662 CB ARG A 102 10.756 13.617 1.671 1.00 0.00 C ATOM 1663 CG ARG A 102 11.507 12.321 1.979 1.00 0.00 C ATOM 1664 CD ARG A 102 12.146 12.410 3.369 1.00 0.00 C ATOM 1665 NE ARG A 102 12.968 11.222 3.666 1.00 0.00 N ATOM 1666 CZ ARG A 102 13.188 10.669 4.848 1.00 0.00 C ATOM 1667 NH1 ARG A 102 14.037 9.686 4.955 1.00 0.00 N ATOM 1668 NH2 ARG A 102 12.595 11.054 5.942 1.00 0.00 N ATOM 0 H ARG A 102 9.139 15.264 1.226 1.00 0.00 H new ATOM 0 HA ARG A 102 10.723 13.579 -0.483 1.00 0.00 H new ATOM 0 HB2 ARG A 102 11.467 14.443 1.670 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.045 13.810 2.475 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.822 11.474 1.937 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.275 12.147 1.226 1.00 0.00 H new ATOM 0 HD2 ARG A 102 12.765 13.305 3.429 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.365 12.511 4.123 1.00 0.00 H new ATOM 0 HE ARG A 102 13.419 10.775 2.868 1.00 0.00 H new ATOM 0 HH11 ARG A 102 14.529 9.345 4.129 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.209 9.257 5.864 1.00 0.00 H new ATOM 0 HH21 ARG A 102 11.921 11.819 5.915 1.00 0.00 H new ATOM 0 HH22 ARG A 102 12.804 10.590 6.826 1.00 0.00 H new ATOM 1682 N SER A 103 9.484 11.499 -0.727 1.00 0.00 N ATOM 1683 CA SER A 103 8.756 10.265 -1.063 1.00 0.00 C ATOM 1684 C SER A 103 9.661 9.042 -1.260 1.00 0.00 C ATOM 1685 O SER A 103 10.857 9.171 -1.533 1.00 0.00 O ATOM 1686 CB SER A 103 7.878 10.474 -2.305 1.00 0.00 C ATOM 1687 OG SER A 103 8.649 10.691 -3.477 1.00 0.00 O ATOM 0 H SER A 103 10.345 11.608 -1.264 1.00 0.00 H new ATOM 0 HA SER A 103 8.130 10.048 -0.197 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.241 9.602 -2.448 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.219 11.327 -2.143 1.00 0.00 H new ATOM 0 HG SER A 103 8.463 11.586 -3.830 1.00 0.00 H new ATOM 1693 N ALA A 104 9.072 7.848 -1.137 1.00 0.00 N ATOM 1694 CA ALA A 104 9.705 6.564 -1.444 1.00 0.00 C ATOM 1695 C ALA A 104 8.676 5.546 -1.963 1.00 0.00 C ATOM 1696 O ALA A 104 7.536 5.521 -1.502 1.00 0.00 O ATOM 1697 CB ALA A 104 10.408 6.038 -0.184 1.00 0.00 C ATOM 0 H ALA A 104 8.111 7.747 -0.811 1.00 0.00 H new ATOM 0 HA ALA A 104 10.440 6.710 -2.235 1.00 0.00 H new ATOM 0 HB1 ALA A 104 10.882 5.082 -0.404 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.166 6.754 0.135 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.676 5.905 0.612 1.00 0.00 H new ATOM 1703 N PHE A 105 9.087 4.670 -2.881 1.00 0.00 N ATOM 1704 CA PHE A 105 8.320 3.476 -3.244 1.00 0.00 C ATOM 1705 C PHE A 105 8.701 2.317 -2.309 1.00 0.00 C ATOM 1706 O PHE A 105 9.869 1.923 -2.247 1.00 0.00 O ATOM 1707 CB PHE A 105 8.542 3.119 -4.719 1.00 0.00 C ATOM 1708 CG PHE A 105 7.808 4.003 -5.714 1.00 0.00 C ATOM 1709 CD1 PHE A 105 8.492 5.020 -6.409 1.00 0.00 C ATOM 1710 CD2 PHE A 105 6.444 3.776 -5.987 1.00 0.00 C ATOM 1711 CE1 PHE A 105 7.821 5.781 -7.386 1.00 0.00 C ATOM 1712 CE2 PHE A 105 5.778 4.520 -6.976 1.00 0.00 C ATOM 1713 CZ PHE A 105 6.470 5.521 -7.679 1.00 0.00 C ATOM 0 H PHE A 105 9.963 4.768 -3.395 1.00 0.00 H new ATOM 0 HA PHE A 105 7.255 3.675 -3.121 1.00 0.00 H new ATOM 0 HB2 PHE A 105 9.610 3.168 -4.932 1.00 0.00 H new ATOM 0 HB3 PHE A 105 8.233 2.086 -4.877 1.00 0.00 H new ATOM 0 HD1 PHE A 105 9.532 5.216 -6.192 1.00 0.00 H new ATOM 0 HD2 PHE A 105 5.905 3.023 -5.431 1.00 0.00 H new ATOM 0 HE1 PHE A 105 8.345 6.566 -7.911 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.739 4.323 -7.195 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.964 6.091 -8.444 1.00 0.00 H new ATOM 1723 N ILE A 106 7.718 1.771 -1.590 1.00 0.00 N ATOM 1724 CA ILE A 106 7.873 0.604 -0.700 1.00 0.00 C ATOM 1725 C ILE A 106 6.976 -0.547 -1.161 1.00 0.00 C ATOM 1726 O ILE A 106 5.868 -0.314 -1.641 1.00 0.00 O ATOM 1727 CB ILE A 106 7.644 0.959 0.790 1.00 0.00 C ATOM 1728 CG1 ILE A 106 6.164 1.235 1.143 1.00 0.00 C ATOM 1729 CG2 ILE A 106 8.540 2.146 1.183 1.00 0.00 C ATOM 1730 CD1 ILE A 106 5.903 1.465 2.637 1.00 0.00 C ATOM 0 H ILE A 106 6.765 2.133 -1.607 1.00 0.00 H new ATOM 0 HA ILE A 106 8.909 0.273 -0.771 1.00 0.00 H new ATOM 0 HB ILE A 106 7.920 0.080 1.373 1.00 0.00 H new ATOM 0 HG12 ILE A 106 5.828 2.111 0.588 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.559 0.393 0.806 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.377 2.394 2.232 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.586 1.878 1.032 1.00 0.00 H new ATOM 0 HG23 ILE A 106 8.293 3.009 0.564 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.841 1.651 2.796 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.205 0.581 3.199 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.478 2.326 2.978 1.00 0.00 H new ATOM 1742 N GLY A 107 7.441 -1.784 -1.006 1.00 0.00 N ATOM 1743 CA GLY A 107 6.652 -2.983 -1.288 1.00 0.00 C ATOM 1744 C GLY A 107 5.877 -3.411 -0.046 1.00 0.00 C ATOM 1745 O GLY A 107 6.422 -3.343 1.056 1.00 0.00 O ATOM 0 H GLY A 107 8.386 -1.986 -0.678 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.960 -2.787 -2.107 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.308 -3.791 -1.612 1.00 0.00 H new ATOM 1749 N ILE A 108 4.638 -3.873 -0.210 1.00 0.00 N ATOM 1750 CA ILE A 108 3.852 -4.534 0.836 1.00 0.00 C ATOM 1751 C ILE A 108 3.321 -5.898 0.395 1.00 0.00 C ATOM 1752 O ILE A 108 2.949 -6.099 -0.763 1.00 0.00 O ATOM 1753 CB ILE A 108 2.723 -3.663 1.432 1.00 0.00 C ATOM 1754 CG1 ILE A 108 1.657 -3.224 0.403 1.00 0.00 C ATOM 1755 CG2 ILE A 108 3.332 -2.476 2.187 1.00 0.00 C ATOM 1756 CD1 ILE A 108 0.386 -2.648 1.050 1.00 0.00 C ATOM 0 H ILE A 108 4.139 -3.797 -1.096 1.00 0.00 H new ATOM 0 HA ILE A 108 4.564 -4.695 1.646 1.00 0.00 H new ATOM 0 HB ILE A 108 2.171 -4.286 2.136 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.090 -2.475 -0.261 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.386 -4.079 -0.216 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.534 -1.863 2.606 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.968 -2.844 2.992 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.928 -1.875 1.500 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.320 -2.360 0.271 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.069 -3.402 1.692 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.646 -1.773 1.646 1.00 0.00 H new ATOM 1768 N GLY A 109 3.274 -6.830 1.345 1.00 0.00 N ATOM 1769 CA GLY A 109 2.764 -8.184 1.160 1.00 0.00 C ATOM 1770 C GLY A 109 1.676 -8.559 2.160 1.00 0.00 C ATOM 1771 O GLY A 109 1.784 -8.278 3.359 1.00 0.00 O ATOM 0 H GLY A 109 3.601 -6.656 2.295 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.368 -8.281 0.149 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.589 -8.891 1.248 1.00 0.00 H new ATOM 1775 N PHE A 110 0.650 -9.232 1.645 1.00 0.00 N ATOM 1776 CA PHE A 110 -0.375 -9.945 2.406 1.00 0.00 C ATOM 1777 C PHE A 110 -0.102 -11.457 2.367 1.00 0.00 C ATOM 1778 O PHE A 110 0.629 -11.948 1.506 1.00 0.00 O ATOM 1779 CB PHE A 110 -1.760 -9.624 1.823 1.00 0.00 C ATOM 1780 CG PHE A 110 -2.152 -8.163 1.909 1.00 0.00 C ATOM 1781 CD1 PHE A 110 -2.843 -7.692 3.039 1.00 0.00 C ATOM 1782 CD2 PHE A 110 -1.822 -7.275 0.866 1.00 0.00 C ATOM 1783 CE1 PHE A 110 -3.211 -6.337 3.123 1.00 0.00 C ATOM 1784 CE2 PHE A 110 -2.198 -5.924 0.948 1.00 0.00 C ATOM 1785 CZ PHE A 110 -2.899 -5.458 2.069 1.00 0.00 C ATOM 0 H PHE A 110 0.503 -9.299 0.638 1.00 0.00 H new ATOM 0 HA PHE A 110 -0.349 -9.622 3.447 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -1.781 -9.932 0.778 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.508 -10.220 2.346 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -3.091 -8.370 3.842 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -1.280 -7.633 0.003 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -3.732 -5.972 3.995 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -1.947 -5.244 0.147 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.200 -4.422 2.124 1.00 0.00 H new ATOM 1795 N THR A 111 -0.729 -12.215 3.269 1.00 0.00 N ATOM 1796 CA THR A 111 -0.640 -13.690 3.294 1.00 0.00 C ATOM 1797 C THR A 111 -1.768 -14.382 2.513 1.00 0.00 C ATOM 1798 O THR A 111 -1.642 -15.535 2.099 1.00 0.00 O ATOM 1799 CB THR A 111 -0.575 -14.163 4.756 1.00 0.00 C ATOM 1800 OG1 THR A 111 -0.053 -15.473 4.829 1.00 0.00 O ATOM 1801 CG2 THR A 111 -1.916 -14.141 5.496 1.00 0.00 C ATOM 0 H THR A 111 -1.316 -11.829 4.008 1.00 0.00 H new ATOM 0 HA THR A 111 0.274 -13.982 2.777 1.00 0.00 H new ATOM 0 HB THR A 111 0.077 -13.443 5.250 1.00 0.00 H new ATOM 0 HG1 THR A 111 -0.017 -15.759 5.766 1.00 0.00 H new ATOM 0 HG21 THR A 111 -1.773 -14.490 6.519 1.00 0.00 H new ATOM 0 HG22 THR A 111 -2.306 -13.123 5.511 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.624 -14.794 4.985 1.00 0.00 H new ATOM 1809 N ASP A 112 -2.883 -13.683 2.278 1.00 0.00 N ATOM 1810 CA ASP A 112 -4.202 -14.331 2.167 1.00 0.00 C ATOM 1811 C ASP A 112 -4.801 -14.359 0.752 1.00 0.00 C ATOM 1812 O ASP A 112 -5.720 -15.136 0.488 1.00 0.00 O ATOM 1813 CB ASP A 112 -5.145 -13.622 3.149 1.00 0.00 C ATOM 1814 CG ASP A 112 -6.503 -14.332 3.292 1.00 0.00 C ATOM 1815 OD1 ASP A 112 -7.514 -13.809 2.768 1.00 0.00 O ATOM 1816 OD2 ASP A 112 -6.556 -15.410 3.934 1.00 0.00 O ATOM 0 H ASP A 112 -2.903 -12.670 2.161 1.00 0.00 H new ATOM 0 HA ASP A 112 -4.072 -15.385 2.412 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.666 -13.563 4.127 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.309 -12.598 2.813 1.00 0.00 H new ATOM 1821 N ARG A 113 -4.305 -13.496 -0.148 1.00 0.00 N ATOM 1822 CA ARG A 113 -4.944 -13.064 -1.412 1.00 0.00 C ATOM 1823 C ARG A 113 -6.295 -12.363 -1.224 1.00 0.00 C ATOM 1824 O ARG A 113 -6.464 -11.265 -1.736 1.00 0.00 O ATOM 1825 CB ARG A 113 -5.009 -14.229 -2.415 1.00 0.00 C ATOM 1826 CG ARG A 113 -5.406 -13.743 -3.816 1.00 0.00 C ATOM 1827 CD ARG A 113 -5.570 -14.914 -4.792 1.00 0.00 C ATOM 1828 NE ARG A 113 -6.783 -15.709 -4.510 1.00 0.00 N ATOM 1829 CZ ARG A 113 -7.137 -16.842 -5.093 1.00 0.00 C ATOM 1830 NH1 ARG A 113 -8.239 -17.443 -4.749 1.00 0.00 N ATOM 1831 NH2 ARG A 113 -6.413 -17.399 -6.024 1.00 0.00 N ATOM 0 H ARG A 113 -3.397 -13.053 -0.011 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.302 -12.291 -1.835 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -4.039 -14.725 -2.462 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.729 -14.970 -2.068 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -6.340 -13.184 -3.757 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -4.647 -13.057 -4.193 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -5.617 -14.531 -5.812 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -4.693 -15.559 -4.734 1.00 0.00 H new ATOM 0 HE ARG A 113 -7.411 -15.347 -3.793 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -8.835 -17.040 -4.026 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.506 -18.317 -5.203 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -5.543 -16.960 -6.324 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -6.717 -18.274 -6.452 1.00 0.00 H new ATOM 1845 N GLY A 114 -7.219 -12.917 -0.445 1.00 0.00 N ATOM 1846 CA GLY A 114 -8.501 -12.283 -0.101 1.00 0.00 C ATOM 1847 C GLY A 114 -8.362 -10.921 0.602 1.00 0.00 C ATOM 1848 O GLY A 114 -9.171 -10.022 0.373 1.00 0.00 O ATOM 0 H GLY A 114 -7.101 -13.838 -0.023 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.084 -12.151 -1.012 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.065 -12.956 0.544 1.00 0.00 H new ATOM 1852 N ASP A 115 -7.295 -10.715 1.382 1.00 0.00 N ATOM 1853 CA ASP A 115 -7.005 -9.425 2.031 1.00 0.00 C ATOM 1854 C ASP A 115 -6.329 -8.426 1.077 1.00 0.00 C ATOM 1855 O ASP A 115 -6.606 -7.229 1.142 1.00 0.00 O ATOM 1856 CB ASP A 115 -6.179 -9.642 3.308 1.00 0.00 C ATOM 1857 CG ASP A 115 -6.969 -10.365 4.416 1.00 0.00 C ATOM 1858 OD1 ASP A 115 -6.359 -11.163 5.164 1.00 0.00 O ATOM 1859 OD2 ASP A 115 -8.182 -10.086 4.581 1.00 0.00 O ATOM 0 H ASP A 115 -6.604 -11.438 1.583 1.00 0.00 H new ATOM 0 HA ASP A 115 -7.958 -8.976 2.312 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -5.289 -10.223 3.065 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -5.838 -8.677 3.682 1.00 0.00 H new ATOM 1864 N ALA A 116 -5.522 -8.913 0.127 1.00 0.00 N ATOM 1865 CA ALA A 116 -5.022 -8.109 -0.990 1.00 0.00 C ATOM 1866 C ALA A 116 -6.123 -7.706 -1.992 1.00 0.00 C ATOM 1867 O ALA A 116 -6.093 -6.613 -2.567 1.00 0.00 O ATOM 1868 CB ALA A 116 -3.943 -8.930 -1.680 1.00 0.00 C ATOM 0 H ALA A 116 -5.197 -9.880 0.113 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.629 -7.169 -0.603 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.541 -8.367 -2.522 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.143 -9.147 -0.973 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -4.372 -9.865 -2.040 1.00 0.00 H new ATOM 1874 N PHE A 117 -7.127 -8.566 -2.174 1.00 0.00 N ATOM 1875 CA PHE A 117 -8.372 -8.223 -2.862 1.00 0.00 C ATOM 1876 C PHE A 117 -9.090 -7.084 -2.123 1.00 0.00 C ATOM 1877 O PHE A 117 -9.428 -6.081 -2.744 1.00 0.00 O ATOM 1878 CB PHE A 117 -9.256 -9.465 -3.054 1.00 0.00 C ATOM 1879 CG PHE A 117 -9.010 -10.234 -4.346 1.00 0.00 C ATOM 1880 CD1 PHE A 117 -7.712 -10.637 -4.721 1.00 0.00 C ATOM 1881 CD2 PHE A 117 -10.097 -10.551 -5.186 1.00 0.00 C ATOM 1882 CE1 PHE A 117 -7.504 -11.347 -5.917 1.00 0.00 C ATOM 1883 CE2 PHE A 117 -9.890 -11.263 -6.382 1.00 0.00 C ATOM 1884 CZ PHE A 117 -8.593 -11.663 -6.747 1.00 0.00 C ATOM 0 H PHE A 117 -7.098 -9.531 -1.844 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.140 -7.858 -3.863 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.099 -10.139 -2.212 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.301 -9.157 -3.025 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -6.872 -10.399 -4.086 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.095 -10.245 -4.910 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -6.506 -11.650 -6.198 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -10.728 -11.502 -7.020 1.00 0.00 H new ATOM 0 HZ PHE A 117 -8.434 -12.212 -7.663 1.00 0.00 H new ATOM 1894 N ASP A 118 -9.233 -7.169 -0.797 1.00 0.00 N ATOM 1895 CA ASP A 118 -9.850 -6.108 0.013 1.00 0.00 C ATOM 1896 C ASP A 118 -9.086 -4.766 -0.094 1.00 0.00 C ATOM 1897 O ASP A 118 -9.702 -3.716 -0.290 1.00 0.00 O ATOM 1898 CB ASP A 118 -9.962 -6.583 1.476 1.00 0.00 C ATOM 1899 CG ASP A 118 -11.246 -6.130 2.195 1.00 0.00 C ATOM 1900 OD1 ASP A 118 -11.584 -6.773 3.218 1.00 0.00 O ATOM 1901 OD2 ASP A 118 -11.923 -5.171 1.757 1.00 0.00 O ATOM 0 H ASP A 118 -8.925 -7.975 -0.252 1.00 0.00 H new ATOM 0 HA ASP A 118 -10.849 -5.915 -0.378 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -9.913 -7.672 1.497 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -9.100 -6.215 2.032 1.00 0.00 H new ATOM 1906 N PHE A 119 -7.745 -4.799 -0.066 1.00 0.00 N ATOM 1907 CA PHE A 119 -6.872 -3.635 -0.279 1.00 0.00 C ATOM 1908 C PHE A 119 -7.190 -2.890 -1.587 1.00 0.00 C ATOM 1909 O PHE A 119 -7.466 -1.691 -1.567 1.00 0.00 O ATOM 1910 CB PHE A 119 -5.400 -4.093 -0.239 1.00 0.00 C ATOM 1911 CG PHE A 119 -4.383 -3.044 -0.660 1.00 0.00 C ATOM 1912 CD1 PHE A 119 -4.034 -2.892 -2.016 1.00 0.00 C ATOM 1913 CD2 PHE A 119 -3.793 -2.200 0.297 1.00 0.00 C ATOM 1914 CE1 PHE A 119 -3.145 -1.878 -2.416 1.00 0.00 C ATOM 1915 CE2 PHE A 119 -2.918 -1.175 -0.101 1.00 0.00 C ATOM 1916 CZ PHE A 119 -2.593 -1.012 -1.458 1.00 0.00 C ATOM 0 H PHE A 119 -7.224 -5.658 0.110 1.00 0.00 H new ATOM 0 HA PHE A 119 -7.054 -2.921 0.524 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.165 -4.418 0.775 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.289 -4.963 -0.886 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.452 -3.560 -2.755 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -4.014 -2.340 1.345 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.887 -1.766 -3.459 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.494 -0.511 0.638 1.00 0.00 H new ATOM 0 HZ PHE A 119 -1.921 -0.224 -1.763 1.00 0.00 H new ATOM 1926 N ASN A 120 -7.187 -3.587 -2.729 1.00 0.00 N ATOM 1927 CA ASN A 120 -7.368 -2.923 -4.031 1.00 0.00 C ATOM 1928 C ASN A 120 -8.834 -2.648 -4.402 1.00 0.00 C ATOM 1929 O ASN A 120 -9.113 -1.712 -5.155 1.00 0.00 O ATOM 1930 CB ASN A 120 -6.609 -3.655 -5.145 1.00 0.00 C ATOM 1931 CG ASN A 120 -7.331 -4.843 -5.749 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -8.037 -4.732 -6.739 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -7.179 -6.018 -5.198 1.00 0.00 N ATOM 0 H ASN A 120 -7.063 -4.598 -2.782 1.00 0.00 H new ATOM 0 HA ASN A 120 -6.924 -1.934 -3.921 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -6.388 -2.943 -5.940 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -5.653 -3.996 -4.747 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -7.648 -6.832 -5.595 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -6.591 -6.121 -4.371 1.00 0.00 H new ATOM 1940 N VAL A 121 -9.781 -3.431 -3.878 1.00 0.00 N ATOM 1941 CA VAL A 121 -11.213 -3.223 -4.132 1.00 0.00 C ATOM 1942 C VAL A 121 -11.746 -2.038 -3.319 1.00 0.00 C ATOM 1943 O VAL A 121 -12.470 -1.205 -3.865 1.00 0.00 O ATOM 1944 CB VAL A 121 -12.015 -4.517 -3.891 1.00 0.00 C ATOM 1945 CG1 VAL A 121 -13.534 -4.302 -3.920 1.00 0.00 C ATOM 1946 CG2 VAL A 121 -11.687 -5.555 -4.975 1.00 0.00 C ATOM 0 H VAL A 121 -9.580 -4.224 -3.268 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.343 -2.969 -5.184 1.00 0.00 H new ATOM 0 HB VAL A 121 -11.726 -4.860 -2.897 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.039 -5.252 -3.744 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -13.816 -3.591 -3.143 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -13.827 -3.910 -4.894 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.260 -6.464 -4.793 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -11.946 -5.153 -5.954 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.622 -5.786 -4.948 1.00 0.00 H new ATOM 1956 N SER A 122 -11.335 -1.889 -2.055 1.00 0.00 N ATOM 1957 CA SER A 122 -11.711 -0.727 -1.230 1.00 0.00 C ATOM 1958 C SER A 122 -11.161 0.600 -1.774 1.00 0.00 C ATOM 1959 O SER A 122 -11.819 1.633 -1.640 1.00 0.00 O ATOM 1960 CB SER A 122 -11.267 -0.926 0.221 1.00 0.00 C ATOM 1961 OG SER A 122 -9.863 -1.023 0.316 1.00 0.00 O ATOM 0 H SER A 122 -10.737 -2.562 -1.575 1.00 0.00 H new ATOM 0 HA SER A 122 -12.798 -0.661 -1.271 1.00 0.00 H new ATOM 0 HB2 SER A 122 -11.619 -0.093 0.829 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.725 -1.830 0.623 1.00 0.00 H new ATOM 0 HG SER A 122 -9.584 -1.940 0.113 1.00 0.00 H new ATOM 1967 N LEU A 123 -10.007 0.572 -2.455 1.00 0.00 N ATOM 1968 CA LEU A 123 -9.468 1.710 -3.205 1.00 0.00 C ATOM 1969 C LEU A 123 -10.317 2.029 -4.445 1.00 0.00 C ATOM 1970 O LEU A 123 -10.857 3.131 -4.549 1.00 0.00 O ATOM 1971 CB LEU A 123 -7.993 1.452 -3.565 1.00 0.00 C ATOM 1972 CG LEU A 123 -7.010 1.611 -2.388 1.00 0.00 C ATOM 1973 CD1 LEU A 123 -5.630 1.096 -2.800 1.00 0.00 C ATOM 1974 CD2 LEU A 123 -6.856 3.074 -1.956 1.00 0.00 C ATOM 0 H LEU A 123 -9.414 -0.257 -2.500 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.513 2.594 -2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -7.901 0.442 -3.965 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.701 2.137 -4.361 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.416 1.039 -1.553 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.936 1.209 -1.967 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.701 0.043 -3.073 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.268 1.668 -3.654 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.154 3.136 -1.124 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.480 3.663 -2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.824 3.465 -1.643 1.00 0.00 H new ATOM 1986 N GLN A 124 -10.482 1.081 -5.377 1.00 0.00 N ATOM 1987 CA GLN A 124 -11.149 1.360 -6.662 1.00 0.00 C ATOM 1988 C GLN A 124 -12.635 1.732 -6.508 1.00 0.00 C ATOM 1989 O GLN A 124 -13.144 2.562 -7.264 1.00 0.00 O ATOM 1990 CB GLN A 124 -10.925 0.191 -7.641 1.00 0.00 C ATOM 1991 CG GLN A 124 -11.788 -1.048 -7.372 1.00 0.00 C ATOM 1992 CD GLN A 124 -11.264 -2.275 -8.113 1.00 0.00 C ATOM 1993 OE1 GLN A 124 -11.818 -2.731 -9.104 1.00 0.00 O ATOM 1994 NE2 GLN A 124 -10.173 -2.845 -7.652 1.00 0.00 N ATOM 0 H GLN A 124 -10.165 0.117 -5.269 1.00 0.00 H new ATOM 0 HA GLN A 124 -10.685 2.251 -7.086 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.123 0.541 -8.654 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -9.875 -0.100 -7.603 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.809 -1.251 -6.301 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -12.815 -0.849 -7.679 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -9.710 -2.466 -6.826 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -9.790 -3.666 -8.120 1.00 0.00 H new ATOM 2003 N ASP A 125 -13.314 1.194 -5.490 1.00 0.00 N ATOM 2004 CA ASP A 125 -14.719 1.475 -5.185 1.00 0.00 C ATOM 2005 C ASP A 125 -14.903 2.765 -4.362 1.00 0.00 C ATOM 2006 O ASP A 125 -16.035 3.199 -4.156 1.00 0.00 O ATOM 2007 CB ASP A 125 -15.330 0.243 -4.492 1.00 0.00 C ATOM 2008 CG ASP A 125 -16.846 0.363 -4.254 1.00 0.00 C ATOM 2009 OD1 ASP A 125 -17.294 0.222 -3.091 1.00 0.00 O ATOM 2010 OD2 ASP A 125 -17.604 0.599 -5.226 1.00 0.00 O ATOM 0 H ASP A 125 -12.890 0.534 -4.839 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.251 1.661 -6.118 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.134 -0.640 -5.100 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.831 0.089 -3.535 1.00 0.00 H new ATOM 2015 N HIS A 126 -13.822 3.435 -3.943 1.00 0.00 N ATOM 2016 CA HIS A 126 -13.904 4.811 -3.432 1.00 0.00 C ATOM 2017 C HIS A 126 -13.611 5.878 -4.501 1.00 0.00 C ATOM 2018 O HIS A 126 -13.920 7.049 -4.289 1.00 0.00 O ATOM 2019 CB HIS A 126 -13.052 4.980 -2.165 1.00 0.00 C ATOM 2020 CG HIS A 126 -13.537 6.128 -1.308 1.00 0.00 C ATOM 2021 ND1 HIS A 126 -12.894 7.356 -1.121 1.00 0.00 N ATOM 2022 CD2 HIS A 126 -14.726 6.149 -0.638 1.00 0.00 C ATOM 2023 CE1 HIS A 126 -13.719 8.088 -0.350 1.00 0.00 C ATOM 2024 NE2 HIS A 126 -14.821 7.385 -0.039 1.00 0.00 N ATOM 0 H HIS A 126 -12.879 3.047 -3.948 1.00 0.00 H new ATOM 0 HA HIS A 126 -14.943 4.983 -3.150 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -13.078 4.058 -1.585 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -12.013 5.151 -2.446 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -15.452 5.351 -0.588 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -13.523 9.099 -0.026 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -15.594 7.711 0.541 1.00 0.00 H new ATOM 2032 N PHE A 127 -13.092 5.483 -5.672 1.00 0.00 N ATOM 2033 CA PHE A 127 -12.774 6.388 -6.788 1.00 0.00 C ATOM 2034 C PHE A 127 -13.668 6.261 -8.031 1.00 0.00 C ATOM 2035 O PHE A 127 -13.522 7.083 -8.938 1.00 0.00 O ATOM 2036 CB PHE A 127 -11.297 6.222 -7.177 1.00 0.00 C ATOM 2037 CG PHE A 127 -10.296 6.778 -6.191 1.00 0.00 C ATOM 2038 CD1 PHE A 127 -10.219 8.167 -5.975 1.00 0.00 C ATOM 2039 CD2 PHE A 127 -9.383 5.920 -5.552 1.00 0.00 C ATOM 2040 CE1 PHE A 127 -9.221 8.693 -5.140 1.00 0.00 C ATOM 2041 CE2 PHE A 127 -8.376 6.447 -4.728 1.00 0.00 C ATOM 2042 CZ PHE A 127 -8.292 7.835 -4.530 1.00 0.00 C ATOM 0 H PHE A 127 -12.877 4.507 -5.875 1.00 0.00 H new ATOM 0 HA PHE A 127 -12.977 7.390 -6.410 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -11.093 5.160 -7.315 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -11.137 6.705 -8.141 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -10.928 8.828 -6.452 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -9.457 4.852 -5.696 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -9.168 9.758 -4.967 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -7.668 5.787 -4.248 1.00 0.00 H new ATOM 0 HZ PHE A 127 -7.510 8.244 -3.907 1.00 0.00 H new ATOM 2052 N LYS A 128 -14.597 5.292 -8.125 1.00 0.00 N ATOM 2053 CA LYS A 128 -15.417 5.106 -9.346 1.00 0.00 C ATOM 2054 C LYS A 128 -16.171 6.370 -9.788 1.00 0.00 C ATOM 2055 O LYS A 128 -16.250 6.661 -10.979 1.00 0.00 O ATOM 2056 CB LYS A 128 -16.344 3.873 -9.263 1.00 0.00 C ATOM 2057 CG LYS A 128 -17.626 3.999 -8.418 1.00 0.00 C ATOM 2058 CD LYS A 128 -17.390 3.746 -6.928 1.00 0.00 C ATOM 2059 CE LYS A 128 -18.679 3.970 -6.130 1.00 0.00 C ATOM 2060 NZ LYS A 128 -18.691 3.153 -4.893 1.00 0.00 N ATOM 0 H LYS A 128 -14.801 4.628 -7.378 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.695 4.905 -10.138 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.636 3.604 -10.278 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -15.761 3.041 -8.867 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -18.044 4.997 -8.549 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -18.368 3.292 -8.787 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -17.037 2.726 -6.779 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.609 4.411 -6.560 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.772 5.025 -5.873 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.541 3.714 -6.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -19.559 3.350 -4.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -18.660 2.144 -5.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -17.862 3.391 -4.311 1.00 0.00 H new ATOM 2074 N TRP A 129 -16.640 7.166 -8.825 1.00 0.00 N ATOM 2075 CA TRP A 129 -17.350 8.430 -9.054 1.00 0.00 C ATOM 2076 C TRP A 129 -16.411 9.578 -9.465 1.00 0.00 C ATOM 2077 O TRP A 129 -16.781 10.408 -10.295 1.00 0.00 O ATOM 2078 CB TRP A 129 -18.154 8.788 -7.793 1.00 0.00 C ATOM 2079 CG TRP A 129 -17.345 9.123 -6.571 1.00 0.00 C ATOM 2080 CD1 TRP A 129 -16.679 8.235 -5.798 1.00 0.00 C ATOM 2081 CD2 TRP A 129 -17.105 10.434 -5.960 1.00 0.00 C ATOM 2082 NE1 TRP A 129 -16.002 8.903 -4.799 1.00 0.00 N ATOM 2083 CE2 TRP A 129 -16.253 10.256 -4.826 1.00 0.00 C ATOM 2084 CE3 TRP A 129 -17.524 11.754 -6.239 1.00 0.00 C ATOM 2085 CZ2 TRP A 129 -15.838 11.323 -4.018 1.00 0.00 C ATOM 2086 CZ3 TRP A 129 -17.137 12.831 -5.417 1.00 0.00 C ATOM 2087 CH2 TRP A 129 -16.294 12.619 -4.310 1.00 0.00 C ATOM 0 H TRP A 129 -16.534 6.944 -7.835 1.00 0.00 H new ATOM 0 HA TRP A 129 -18.028 8.290 -9.896 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -18.796 9.638 -8.024 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -18.809 7.950 -7.553 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -16.678 7.165 -5.941 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -15.389 8.449 -4.122 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -18.152 11.941 -7.098 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -15.176 11.151 -3.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -17.490 13.827 -5.638 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -15.999 13.450 -3.687 1.00 0.00 H new ATOM 2098 N VAL A 130 -15.173 9.589 -8.956 1.00 0.00 N ATOM 2099 CA VAL A 130 -14.114 10.544 -9.342 1.00 0.00 C ATOM 2100 C VAL A 130 -13.652 10.283 -10.782 1.00 0.00 C ATOM 2101 O VAL A 130 -13.442 11.223 -11.550 1.00 0.00 O ATOM 2102 CB VAL A 130 -12.917 10.474 -8.363 1.00 0.00 C ATOM 2103 CG1 VAL A 130 -11.863 11.544 -8.666 1.00 0.00 C ATOM 2104 CG2 VAL A 130 -13.372 10.671 -6.911 1.00 0.00 C ATOM 0 H VAL A 130 -14.868 8.921 -8.248 1.00 0.00 H new ATOM 0 HA VAL A 130 -14.531 11.550 -9.290 1.00 0.00 H new ATOM 0 HB VAL A 130 -12.483 9.483 -8.495 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.042 11.457 -7.955 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -11.483 11.404 -9.678 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.314 12.533 -8.581 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -12.508 10.616 -6.248 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -13.847 11.646 -6.808 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -14.084 9.890 -6.644 1.00 0.00 H new ATOM 2114 N LYS A 131 -13.573 9.004 -11.175 1.00 0.00 N ATOM 2115 CA LYS A 131 -13.244 8.545 -12.541 1.00 0.00 C ATOM 2116 C LYS A 131 -14.432 8.503 -13.512 1.00 0.00 C ATOM 2117 O LYS A 131 -14.271 8.171 -14.687 1.00 0.00 O ATOM 2118 CB LYS A 131 -12.552 7.175 -12.458 1.00 0.00 C ATOM 2119 CG LYS A 131 -11.215 7.193 -11.694 1.00 0.00 C ATOM 2120 CD LYS A 131 -10.644 5.774 -11.569 1.00 0.00 C ATOM 2121 CE LYS A 131 -11.431 4.950 -10.539 1.00 0.00 C ATOM 2122 NZ LYS A 131 -11.255 3.496 -10.752 1.00 0.00 N ATOM 0 H LYS A 131 -13.741 8.230 -10.532 1.00 0.00 H new ATOM 0 HA LYS A 131 -12.573 9.292 -12.965 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -13.226 6.468 -11.974 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.376 6.807 -13.469 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -10.502 7.833 -12.214 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -11.363 7.620 -10.702 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -10.679 5.278 -12.539 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -9.596 5.825 -11.274 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -11.101 5.213 -9.534 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -12.490 5.202 -10.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -11.702 2.974 -9.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -11.699 3.221 -11.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -10.240 3.270 -10.784 1.00 0.00 H new ATOM 2136 N GLN A 132 -15.609 8.859 -13.008 1.00 0.00 N ATOM 2137 CA GLN A 132 -16.917 8.849 -13.686 1.00 0.00 C ATOM 2138 C GLN A 132 -17.235 7.544 -14.446 1.00 0.00 C ATOM 2139 O GLN A 132 -17.749 7.537 -15.569 1.00 0.00 O ATOM 2140 CB GLN A 132 -17.074 10.096 -14.556 1.00 0.00 C ATOM 2141 CG GLN A 132 -16.942 11.416 -13.773 1.00 0.00 C ATOM 2142 CD GLN A 132 -17.178 12.665 -14.625 1.00 0.00 C ATOM 2143 OE1 GLN A 132 -17.411 12.626 -15.828 1.00 0.00 O ATOM 2144 NE2 GLN A 132 -17.123 13.839 -14.030 1.00 0.00 N ATOM 0 H GLN A 132 -15.688 9.187 -12.046 1.00 0.00 H new ATOM 0 HA GLN A 132 -17.673 8.879 -12.901 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -16.322 10.075 -15.345 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -18.049 10.068 -15.043 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -17.654 11.411 -12.947 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -15.946 11.470 -13.334 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -16.931 13.895 -13.030 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -17.273 14.692 -14.569 1.00 0.00 H new ATOM 2153 N GLU A 133 -16.912 6.429 -13.800 1.00 0.00 N ATOM 2154 CA GLU A 133 -17.179 5.051 -14.253 1.00 0.00 C ATOM 2155 C GLU A 133 -18.604 4.562 -13.925 1.00 0.00 C ATOM 2156 O GLU A 133 -19.064 4.724 -12.770 1.00 0.00 O ATOM 2157 CB GLU A 133 -16.117 4.075 -13.712 1.00 0.00 C ATOM 2158 CG GLU A 133 -14.709 4.333 -14.272 1.00 0.00 C ATOM 2159 CD GLU A 133 -13.732 3.191 -13.906 1.00 0.00 C ATOM 2160 OE1 GLU A 133 -13.677 2.172 -14.639 1.00 0.00 O ATOM 2161 OE2 GLU A 133 -12.997 3.307 -12.893 1.00 0.00 O ATOM 2162 OXT GLU A 133 -19.261 4.008 -14.837 1.00 0.00 O ATOM 0 H GLU A 133 -16.432 6.453 -12.900 1.00 0.00 H new ATOM 0 HA GLU A 133 -17.112 5.072 -15.341 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -16.087 4.149 -12.625 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -16.415 3.055 -13.954 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -14.761 4.435 -15.356 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.329 5.277 -13.881 1.00 0.00 H new TER 2169 GLU A 133