USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 950 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 108 THR OG1 : rot 120:sc= -1.86 USER MOD Set 1.2: A 114 LYS NZ :NH3+ -143:sc= -0.153 (180deg=-0.764) USER MOD Set 2.1: A 106 THR OG1 : rot 180:sc= -0.0394 USER MOD Set 2.2: A 107 ASN : amide:sc= -4.54! C(o=-4.6!,f=-7.4!) USER MOD Set 3.1: A 30 HIS : no HD1:sc= -4.12! C(o=-3.3!,f=-13!) USER MOD Set 3.2: A 124 SER OG : rot -135:sc= 0.859 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -1.49 K(o=-1.5,f=-3.6!) USER MOD Single : A 11 ASN : amide:sc= -2.48 K(o=-2.5,f=-3.5!) USER MOD Single : A 12 GLN : amide:sc= -0.726 X(o=-0.73,f=-0.68) USER MOD Single : A 14 LYS NZ :NH3+ -127:sc= -1.39 (180deg=-3.29!) USER MOD Single : A 15 SER OG : rot 108:sc= 0.855 USER MOD Single : A 20 SER OG : rot 157:sc= -2.83! USER MOD Single : A 25 ASN : amide:sc= -0.45 X(o=-0.45,f=-0.51) USER MOD Single : A 29 TYR OH : rot 71:sc= -4.04! USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot -177:sc= -2.4! USER MOD Single : A 42 ASN : amide:sc= -2.22! K(o=-2.2!,f=-1.5) USER MOD Single : A 43 LYS NZ :NH3+ -117:sc= -1.83 (180deg=-4.64!) USER MOD Single : A 49 ASN : amide:sc= 0.681 K(o=0.68,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 139:sc= -0.233 USER MOD Single : A 59 ASN : amide:sc= -1.23 K(o=-1.2,f=-2.1!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= -0.0334 (180deg=-0.0334) USER MOD Single : A 64 SER OG : rot 180:sc= -0.806 USER MOD Single : A 73 ASN : amide:sc= -8.79! C(o=-8.8!,f=-17!) USER MOD Single : A 74 SER OG : rot 180:sc= -1.37 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot -8:sc= -1.11! USER MOD Single : A 85 ASN : amide:sc= -3.16! C(o=-3.2!,f=-10!) USER MOD Single : A 87 ASN : amide:sc= -8.75 K(o=-8.7,f=-16!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 179:sc= -6.53! (180deg=-6.59!) USER MOD Single : A 99 SER OG : rot 81:sc= 0.503 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= -5.18! C(o=-5.2!,f=-10!) USER MOD Single : A 104 SER OG : rot -140:sc= -1.3 USER MOD Single : A 105 THR OG1 : rot -41:sc= 0.956 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -6.5! C(o=-6.5!,f=-7.9!) USER MOD Single : A 117 SER OG : rot 180:sc= -1.02! USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -4.07! C(o=-4.1!,f=-5.4!) USER MOD Single : A 128 HIS : no HD1:sc= -0.351 X(o=-0.35,f=-0.49) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -16.224 21.311 -1.091 1.00 0.00 N ATOM 33 CA LYS A 3 -16.139 20.041 -0.379 1.00 0.00 C ATOM 34 C LYS A 3 -16.001 18.879 -1.354 1.00 0.00 C ATOM 35 O LYS A 3 -16.498 17.780 -1.102 1.00 0.00 O ATOM 36 CB LYS A 3 -17.375 19.840 0.498 1.00 0.00 C ATOM 37 CG LYS A 3 -17.226 20.419 1.895 1.00 0.00 C ATOM 38 CD LYS A 3 -18.295 21.460 2.186 1.00 0.00 C ATOM 39 CE LYS A 3 -17.833 22.855 1.799 1.00 0.00 C ATOM 40 NZ LYS A 3 -18.926 23.650 1.174 1.00 0.00 N ATOM 0 HA LYS A 3 -15.252 20.068 0.255 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -18.235 20.301 0.012 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -17.586 18.774 0.576 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -17.289 19.617 2.630 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -16.239 20.871 1.999 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -19.205 21.212 1.639 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.545 21.440 3.247 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -17.467 23.375 2.685 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.996 22.780 1.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -18.569 24.595 0.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -19.258 23.168 0.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -19.715 23.744 1.845 1.00 0.00 H new ATOM 54 N THR A 4 -15.325 19.127 -2.469 1.00 0.00 N ATOM 55 CA THR A 4 -15.123 18.102 -3.483 1.00 0.00 C ATOM 56 C THR A 4 -14.118 17.059 -3.006 1.00 0.00 C ATOM 57 O THR A 4 -14.457 15.888 -2.845 1.00 0.00 O ATOM 58 CB THR A 4 -14.637 18.734 -4.787 1.00 0.00 C ATOM 59 OG1 THR A 4 -15.546 19.721 -5.235 1.00 0.00 O ATOM 60 CG2 THR A 4 -14.457 17.731 -5.905 1.00 0.00 C ATOM 0 H THR A 4 -14.907 20.030 -2.693 1.00 0.00 H new ATOM 0 HA THR A 4 -16.078 17.608 -3.661 1.00 0.00 H new ATOM 0 HB THR A 4 -13.666 19.171 -4.553 1.00 0.00 H new ATOM 0 HG1 THR A 4 -15.216 20.115 -6.070 1.00 0.00 H new ATOM 0 HG21 THR A 4 -14.111 18.244 -6.802 1.00 0.00 H new ATOM 0 HG22 THR A 4 -13.722 16.983 -5.608 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.409 17.242 -6.112 1.00 0.00 H new ATOM 68 N ASN A 5 -12.880 17.494 -2.784 1.00 0.00 N ATOM 69 CA ASN A 5 -11.819 16.601 -2.328 1.00 0.00 C ATOM 70 C ASN A 5 -12.293 15.715 -1.178 1.00 0.00 C ATOM 71 O ASN A 5 -11.980 14.527 -1.129 1.00 0.00 O ATOM 72 CB ASN A 5 -10.598 17.412 -1.890 1.00 0.00 C ATOM 73 CG ASN A 5 -9.628 17.656 -3.030 1.00 0.00 C ATOM 74 OD1 ASN A 5 -8.413 17.564 -2.856 1.00 0.00 O ATOM 75 ND2 ASN A 5 -10.163 17.967 -4.204 1.00 0.00 N ATOM 0 H ASN A 5 -12.587 18.462 -2.913 1.00 0.00 H new ATOM 0 HA ASN A 5 -11.545 15.956 -3.163 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -10.927 18.369 -1.485 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.084 16.885 -1.086 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -9.561 18.141 -5.009 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -11.176 18.032 -4.302 1.00 0.00 H new ATOM 82 N LEU A 6 -13.049 16.300 -0.257 1.00 0.00 N ATOM 83 CA LEU A 6 -13.565 15.571 0.884 1.00 0.00 C ATOM 84 C LEU A 6 -14.595 14.543 0.452 1.00 0.00 C ATOM 85 O LEU A 6 -14.348 13.341 0.515 1.00 0.00 O ATOM 86 CB LEU A 6 -14.191 16.549 1.879 1.00 0.00 C ATOM 87 CG LEU A 6 -13.230 17.133 2.915 1.00 0.00 C ATOM 88 CD1 LEU A 6 -13.155 16.224 4.129 1.00 0.00 C ATOM 89 CD2 LEU A 6 -11.846 17.348 2.318 1.00 0.00 C ATOM 0 H LEU A 6 -13.317 17.284 -0.283 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.738 15.045 1.360 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -14.641 17.370 1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -14.999 16.040 2.404 1.00 0.00 H new ATOM 0 HG LEU A 6 -13.612 18.105 3.228 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -12.468 16.650 4.860 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -14.145 16.129 4.574 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -12.798 15.240 3.825 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.183 17.764 3.077 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -11.447 16.395 1.971 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -11.915 18.039 1.478 1.00 0.00 H new ATOM 101 N GLY A 7 -15.751 15.026 0.006 1.00 0.00 N ATOM 102 CA GLY A 7 -16.808 14.137 -0.431 1.00 0.00 C ATOM 103 C GLY A 7 -16.371 13.198 -1.537 1.00 0.00 C ATOM 104 O GLY A 7 -17.009 12.174 -1.772 1.00 0.00 O ATOM 0 H GLY A 7 -15.973 16.019 -0.060 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.157 13.551 0.419 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.654 14.730 -0.778 1.00 0.00 H new ATOM 108 N GLU A 8 -15.291 13.547 -2.225 1.00 0.00 N ATOM 109 CA GLU A 8 -14.792 12.719 -3.315 1.00 0.00 C ATOM 110 C GLU A 8 -13.697 11.764 -2.845 1.00 0.00 C ATOM 111 O GLU A 8 -13.450 10.742 -3.483 1.00 0.00 O ATOM 112 CB GLU A 8 -14.269 13.595 -4.460 1.00 0.00 C ATOM 113 CG GLU A 8 -12.883 14.174 -4.216 1.00 0.00 C ATOM 114 CD GLU A 8 -11.830 13.571 -5.127 1.00 0.00 C ATOM 115 OE1 GLU A 8 -11.802 12.331 -5.263 1.00 0.00 O ATOM 116 OE2 GLU A 8 -11.035 14.342 -5.705 1.00 0.00 O ATOM 0 H GLU A 8 -14.747 14.392 -2.049 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.627 12.119 -3.676 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.248 13.003 -5.375 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -14.969 14.414 -4.626 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -12.913 15.253 -4.366 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -12.600 14.004 -3.177 1.00 0.00 H new ATOM 123 N LEU A 9 -13.042 12.088 -1.730 1.00 0.00 N ATOM 124 CA LEU A 9 -11.988 11.228 -1.215 1.00 0.00 C ATOM 125 C LEU A 9 -12.496 10.385 -0.058 1.00 0.00 C ATOM 126 O LEU A 9 -11.964 9.312 0.223 1.00 0.00 O ATOM 127 CB LEU A 9 -10.776 12.049 -0.771 1.00 0.00 C ATOM 128 CG LEU A 9 -9.986 12.718 -1.897 1.00 0.00 C ATOM 129 CD1 LEU A 9 -8.875 13.586 -1.322 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.414 11.671 -2.840 1.00 0.00 C ATOM 0 H LEU A 9 -13.222 12.926 -1.177 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.679 10.565 -2.023 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -11.115 12.821 -0.080 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.102 11.398 -0.215 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.663 13.357 -2.464 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.322 14.055 -2.136 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.308 14.357 -0.686 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.198 12.967 -0.733 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -8.855 12.164 -3.635 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.749 11.007 -2.287 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.227 11.090 -3.275 1.00 0.00 H new ATOM 142 N ILE A 10 -13.524 10.882 0.623 1.00 0.00 N ATOM 143 CA ILE A 10 -14.084 10.172 1.757 1.00 0.00 C ATOM 144 C ILE A 10 -15.035 9.067 1.318 1.00 0.00 C ATOM 145 O ILE A 10 -15.038 7.983 1.902 1.00 0.00 O ATOM 146 CB ILE A 10 -14.806 11.118 2.733 1.00 0.00 C ATOM 147 CG1 ILE A 10 -16.051 11.772 2.102 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.862 12.179 3.232 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.605 12.951 2.902 1.00 0.00 C ATOM 0 H ILE A 10 -13.981 11.768 0.408 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.239 9.720 2.277 1.00 0.00 H new ATOM 0 HB ILE A 10 -15.146 10.511 3.572 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.800 12.113 1.098 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.831 11.018 1.997 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.388 12.840 3.921 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -13.026 11.708 3.748 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.488 12.759 2.388 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -17.480 13.357 2.394 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.889 12.613 3.899 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.842 13.725 2.985 1.00 0.00 H new ATOM 161 N ASN A 11 -15.833 9.330 0.284 1.00 0.00 N ATOM 162 CA ASN A 11 -16.771 8.329 -0.223 1.00 0.00 C ATOM 163 C ASN A 11 -16.072 6.986 -0.365 1.00 0.00 C ATOM 164 O ASN A 11 -16.617 5.940 -0.011 1.00 0.00 O ATOM 165 CB ASN A 11 -17.333 8.757 -1.578 1.00 0.00 C ATOM 166 CG ASN A 11 -18.374 9.847 -1.456 1.00 0.00 C ATOM 167 OD1 ASN A 11 -18.862 10.139 -0.363 1.00 0.00 O ATOM 168 ND2 ASN A 11 -18.719 10.457 -2.581 1.00 0.00 N ATOM 0 H ASN A 11 -15.850 10.219 -0.215 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.593 8.238 0.487 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -16.518 9.107 -2.211 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -17.774 7.892 -2.074 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -19.416 11.202 -2.564 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -18.288 10.181 -3.463 1.00 0.00 H new ATOM 175 N GLN A 12 -14.851 7.038 -0.876 1.00 0.00 N ATOM 176 CA GLN A 12 -14.041 5.841 -1.062 1.00 0.00 C ATOM 177 C GLN A 12 -13.304 5.490 0.227 1.00 0.00 C ATOM 178 O GLN A 12 -13.025 4.322 0.496 1.00 0.00 O ATOM 179 CB GLN A 12 -13.037 6.050 -2.197 1.00 0.00 C ATOM 180 CG GLN A 12 -12.010 7.132 -1.905 1.00 0.00 C ATOM 181 CD GLN A 12 -11.164 7.475 -3.114 1.00 0.00 C ATOM 182 OE1 GLN A 12 -11.197 6.780 -4.130 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.395 8.554 -3.011 1.00 0.00 N ATOM 0 H GLN A 12 -14.396 7.902 -1.171 1.00 0.00 H new ATOM 0 HA GLN A 12 -14.703 5.015 -1.323 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.519 5.111 -2.391 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -13.578 6.309 -3.107 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.522 8.030 -1.558 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.361 6.802 -1.094 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.398 9.102 -2.151 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.802 8.834 -3.792 1.00 0.00 H new ATOM 192 N GLY A 13 -12.996 6.513 1.023 1.00 0.00 N ATOM 193 CA GLY A 13 -12.299 6.292 2.277 1.00 0.00 C ATOM 194 C GLY A 13 -13.072 5.383 3.210 1.00 0.00 C ATOM 195 O GLY A 13 -12.637 4.270 3.506 1.00 0.00 O ATOM 0 H GLY A 13 -13.217 7.488 0.821 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.321 5.855 2.075 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.125 7.250 2.767 1.00 0.00 H new ATOM 199 N LYS A 14 -14.230 5.850 3.667 1.00 0.00 N ATOM 200 CA LYS A 14 -15.066 5.056 4.561 1.00 0.00 C ATOM 201 C LYS A 14 -15.499 3.772 3.860 1.00 0.00 C ATOM 202 O LYS A 14 -15.782 2.764 4.507 1.00 0.00 O ATOM 203 CB LYS A 14 -16.296 5.844 5.047 1.00 0.00 C ATOM 204 CG LYS A 14 -16.736 6.980 4.129 1.00 0.00 C ATOM 205 CD LYS A 14 -16.163 8.318 4.584 1.00 0.00 C ATOM 206 CE LYS A 14 -16.938 9.490 3.998 1.00 0.00 C ATOM 207 NZ LYS A 14 -18.361 9.498 4.439 1.00 0.00 N ATOM 0 H LYS A 14 -14.609 6.768 3.435 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.473 4.807 5.441 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.129 5.151 5.168 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.079 6.256 6.032 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.412 6.772 3.109 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -17.824 7.035 4.113 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.187 8.373 5.672 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -15.117 8.387 4.285 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.462 10.424 4.296 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -16.896 9.444 2.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.982 9.551 3.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.565 8.627 4.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.530 10.322 5.050 1.00 0.00 H new ATOM 221 N SER A 15 -15.520 3.812 2.529 1.00 0.00 N ATOM 222 CA SER A 15 -15.883 2.647 1.735 1.00 0.00 C ATOM 223 C SER A 15 -14.718 1.663 1.696 1.00 0.00 C ATOM 224 O SER A 15 -14.908 0.461 1.510 1.00 0.00 O ATOM 225 CB SER A 15 -16.267 3.065 0.314 1.00 0.00 C ATOM 226 OG SER A 15 -17.634 3.433 0.243 1.00 0.00 O ATOM 0 H SER A 15 -15.289 4.640 1.981 1.00 0.00 H new ATOM 0 HA SER A 15 -16.744 2.163 2.197 1.00 0.00 H new ATOM 0 HB2 SER A 15 -15.645 3.902 -0.003 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.072 2.244 -0.375 1.00 0.00 H new ATOM 0 HG SER A 15 -17.706 4.404 0.136 1.00 0.00 H new ATOM 232 N LEU A 16 -13.509 2.186 1.898 1.00 0.00 N ATOM 233 CA LEU A 16 -12.309 1.371 1.913 1.00 0.00 C ATOM 234 C LEU A 16 -12.260 0.582 3.210 1.00 0.00 C ATOM 235 O LEU A 16 -12.278 -0.647 3.210 1.00 0.00 O ATOM 236 CB LEU A 16 -11.064 2.259 1.799 1.00 0.00 C ATOM 237 CG LEU A 16 -10.369 2.250 0.439 1.00 0.00 C ATOM 238 CD1 LEU A 16 -9.669 3.578 0.192 1.00 0.00 C ATOM 239 CD2 LEU A 16 -9.376 1.099 0.361 1.00 0.00 C ATOM 0 H LEU A 16 -13.341 3.180 2.054 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.328 0.686 1.065 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -11.348 3.284 2.035 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.345 1.945 2.556 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.122 2.110 -0.336 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.179 3.555 -0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.402 4.385 0.210 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.924 3.747 0.970 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.888 1.105 -0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -8.625 1.212 1.143 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.902 0.154 0.498 1.00 0.00 H new ATOM 251 N LEU A 17 -12.210 1.316 4.318 1.00 0.00 N ATOM 252 CA LEU A 17 -12.169 0.711 5.640 1.00 0.00 C ATOM 253 C LEU A 17 -13.374 -0.201 5.856 1.00 0.00 C ATOM 254 O LEU A 17 -13.332 -1.115 6.681 1.00 0.00 O ATOM 255 CB LEU A 17 -12.123 1.807 6.709 1.00 0.00 C ATOM 256 CG LEU A 17 -10.828 1.865 7.522 1.00 0.00 C ATOM 257 CD1 LEU A 17 -9.823 2.826 6.886 1.00 0.00 C ATOM 258 CD2 LEU A 17 -11.133 2.262 8.960 1.00 0.00 C ATOM 0 H LEU A 17 -12.197 2.336 4.323 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.269 0.101 5.719 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -12.274 2.772 6.225 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -12.958 1.660 7.394 1.00 0.00 H new ATOM 0 HG LEU A 17 -10.375 0.874 7.525 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -8.912 2.848 7.484 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -9.586 2.489 5.877 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -10.253 3.827 6.843 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -10.206 2.301 9.531 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -11.609 3.243 8.974 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -11.803 1.527 9.406 1.00 0.00 H new ATOM 270 N ASP A 18 -14.444 0.046 5.105 1.00 0.00 N ATOM 271 CA ASP A 18 -15.653 -0.761 5.214 1.00 0.00 C ATOM 272 C ASP A 18 -15.519 -2.063 4.423 1.00 0.00 C ATOM 273 O ASP A 18 -16.207 -3.044 4.707 1.00 0.00 O ATOM 274 CB ASP A 18 -16.864 0.029 4.714 1.00 0.00 C ATOM 275 CG ASP A 18 -18.164 -0.729 4.897 1.00 0.00 C ATOM 276 OD1 ASP A 18 -18.222 -1.604 5.786 1.00 0.00 O ATOM 277 OD2 ASP A 18 -19.124 -0.448 4.149 1.00 0.00 O ATOM 0 H ASP A 18 -14.497 0.797 4.417 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.797 -1.011 6.265 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.921 0.977 5.248 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -16.730 0.265 3.658 1.00 0.00 H new ATOM 282 N GLU A 19 -14.634 -2.067 3.428 1.00 0.00 N ATOM 283 CA GLU A 19 -14.417 -3.248 2.597 1.00 0.00 C ATOM 284 C GLU A 19 -13.130 -3.971 2.989 1.00 0.00 C ATOM 285 O GLU A 19 -13.016 -5.186 2.831 1.00 0.00 O ATOM 286 CB GLU A 19 -14.363 -2.855 1.120 1.00 0.00 C ATOM 287 CG GLU A 19 -14.973 -3.893 0.192 1.00 0.00 C ATOM 288 CD GLU A 19 -16.482 -3.778 0.099 1.00 0.00 C ATOM 289 OE1 GLU A 19 -16.967 -2.784 -0.481 1.00 0.00 O ATOM 290 OE2 GLU A 19 -17.179 -4.681 0.608 1.00 0.00 O ATOM 0 H GLU A 19 -14.056 -1.265 3.178 1.00 0.00 H new ATOM 0 HA GLU A 19 -15.254 -3.928 2.758 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -14.885 -1.908 0.985 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -13.324 -2.690 0.834 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -14.542 -3.783 -0.803 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -14.709 -4.890 0.545 1.00 0.00 H new ATOM 297 N SER A 20 -12.168 -3.214 3.505 1.00 0.00 N ATOM 298 CA SER A 20 -10.893 -3.772 3.926 1.00 0.00 C ATOM 299 C SER A 20 -10.872 -3.950 5.427 1.00 0.00 C ATOM 300 O SER A 20 -10.861 -2.977 6.180 1.00 0.00 O ATOM 301 CB SER A 20 -9.751 -2.850 3.528 1.00 0.00 C ATOM 302 OG SER A 20 -10.086 -1.518 3.829 1.00 0.00 O ATOM 0 H SER A 20 -12.250 -2.207 3.641 1.00 0.00 H new ATOM 0 HA SER A 20 -10.769 -4.738 3.437 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.841 -3.134 4.057 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.545 -2.951 2.462 1.00 0.00 H new ATOM 0 HG SER A 20 -9.267 -0.987 3.920 1.00 0.00 H new ATOM 308 N VAL A 21 -10.863 -5.190 5.858 1.00 0.00 N ATOM 309 CA VAL A 21 -10.841 -5.492 7.270 1.00 0.00 C ATOM 310 C VAL A 21 -9.500 -6.066 7.671 1.00 0.00 C ATOM 311 O VAL A 21 -8.839 -6.729 6.884 1.00 0.00 O ATOM 312 CB VAL A 21 -11.949 -6.484 7.635 1.00 0.00 C ATOM 313 CG1 VAL A 21 -11.776 -7.788 6.874 1.00 0.00 C ATOM 314 CG2 VAL A 21 -11.989 -6.725 9.136 1.00 0.00 C ATOM 0 H VAL A 21 -10.871 -6.008 5.249 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.009 -4.560 7.810 1.00 0.00 H new ATOM 0 HB VAL A 21 -12.905 -6.049 7.343 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.574 -8.478 7.149 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -11.818 -7.592 5.803 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.812 -8.230 7.124 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.784 -7.433 9.370 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.033 -7.132 9.465 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.179 -5.783 9.651 1.00 0.00 H new ATOM 324 N GLU A 22 -9.101 -5.805 8.897 1.00 0.00 N ATOM 325 CA GLU A 22 -7.828 -6.304 9.385 1.00 0.00 C ATOM 326 C GLU A 22 -7.929 -7.793 9.713 1.00 0.00 C ATOM 327 O GLU A 22 -8.575 -8.185 10.684 1.00 0.00 O ATOM 328 CB GLU A 22 -7.404 -5.528 10.631 1.00 0.00 C ATOM 329 CG GLU A 22 -8.445 -5.539 11.738 1.00 0.00 C ATOM 330 CD GLU A 22 -8.035 -6.398 12.918 1.00 0.00 C ATOM 331 OE1 GLU A 22 -7.322 -7.402 12.701 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.426 -6.069 14.057 1.00 0.00 O ATOM 0 H GLU A 22 -9.633 -5.255 9.572 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.080 -6.166 8.605 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.475 -5.951 11.013 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.194 -4.496 10.352 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.617 -4.518 12.079 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.391 -5.905 11.338 1.00 0.00 H new ATOM 339 N GLY A 23 -7.279 -8.614 8.892 1.00 0.00 N ATOM 340 CA GLY A 23 -7.295 -10.049 9.097 1.00 0.00 C ATOM 341 C GLY A 23 -5.903 -10.654 9.050 1.00 0.00 C ATOM 342 O GLY A 23 -5.251 -10.799 10.083 1.00 0.00 O ATOM 0 H GLY A 23 -6.739 -8.306 8.084 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.753 -10.271 10.061 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.917 -10.516 8.334 1.00 0.00 H new ATOM 346 N PHE A 24 -5.445 -11.006 7.846 1.00 0.00 N ATOM 347 CA PHE A 24 -4.116 -11.598 7.668 1.00 0.00 C ATOM 348 C PHE A 24 -3.963 -12.220 6.280 1.00 0.00 C ATOM 349 O PHE A 24 -3.466 -13.339 6.144 1.00 0.00 O ATOM 350 CB PHE A 24 -3.846 -12.662 8.739 1.00 0.00 C ATOM 351 CG PHE A 24 -5.041 -13.516 9.060 1.00 0.00 C ATOM 352 CD1 PHE A 24 -5.694 -14.222 8.062 1.00 0.00 C ATOM 353 CD2 PHE A 24 -5.512 -13.610 10.360 1.00 0.00 C ATOM 354 CE1 PHE A 24 -6.793 -15.007 8.356 1.00 0.00 C ATOM 355 CE2 PHE A 24 -6.611 -14.393 10.660 1.00 0.00 C ATOM 356 CZ PHE A 24 -7.252 -15.092 9.656 1.00 0.00 C ATOM 0 H PHE A 24 -5.974 -10.892 6.981 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.388 -10.793 7.770 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.032 -13.304 8.403 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.508 -12.169 9.650 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.340 -14.158 7.044 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -5.014 -13.065 11.148 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -7.293 -15.554 7.570 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -6.968 -14.458 11.677 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.111 -15.704 9.887 1.00 0.00 H new ATOM 366 N ASN A 25 -4.386 -11.492 5.250 1.00 0.00 N ATOM 367 CA ASN A 25 -4.285 -11.983 3.877 1.00 0.00 C ATOM 368 C ASN A 25 -4.851 -10.967 2.889 1.00 0.00 C ATOM 369 O ASN A 25 -5.445 -9.967 3.286 1.00 0.00 O ATOM 370 CB ASN A 25 -5.025 -13.315 3.732 1.00 0.00 C ATOM 371 CG ASN A 25 -4.296 -14.287 2.825 1.00 0.00 C ATOM 372 OD1 ASN A 25 -3.220 -14.779 3.161 1.00 0.00 O ATOM 373 ND2 ASN A 25 -4.881 -14.566 1.666 1.00 0.00 N ATOM 0 H ASN A 25 -4.800 -10.564 5.338 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.229 -12.133 3.652 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -5.151 -13.766 4.716 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -6.023 -13.131 3.335 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.437 -15.212 1.013 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.774 -14.134 1.429 1.00 0.00 H new ATOM 380 N VAL A 26 -4.667 -11.233 1.596 1.00 0.00 N ATOM 381 CA VAL A 26 -5.165 -10.339 0.553 1.00 0.00 C ATOM 382 C VAL A 26 -6.622 -9.965 0.809 1.00 0.00 C ATOM 383 O VAL A 26 -7.480 -10.835 0.954 1.00 0.00 O ATOM 384 CB VAL A 26 -5.039 -10.974 -0.846 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.888 -12.232 -0.946 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.425 -9.971 -1.925 1.00 0.00 C ATOM 0 H VAL A 26 -4.178 -12.058 1.247 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.550 -9.440 0.583 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.998 -11.258 -1.001 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.784 -12.663 -1.942 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.556 -12.955 -0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.933 -11.981 -0.767 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.330 -10.437 -2.906 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.456 -9.652 -1.773 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.766 -9.105 -1.869 1.00 0.00 H new ATOM 396 N GLY A 27 -6.889 -8.667 0.881 1.00 0.00 N ATOM 397 CA GLY A 27 -8.238 -8.203 1.139 1.00 0.00 C ATOM 398 C GLY A 27 -8.419 -7.766 2.579 1.00 0.00 C ATOM 399 O GLY A 27 -9.333 -7.004 2.895 1.00 0.00 O ATOM 0 H GLY A 27 -6.196 -7.928 0.765 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.469 -7.370 0.475 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -8.946 -8.999 0.909 1.00 0.00 H new ATOM 403 N GLU A 28 -7.535 -8.243 3.452 1.00 0.00 N ATOM 404 CA GLU A 28 -7.583 -7.901 4.862 1.00 0.00 C ATOM 405 C GLU A 28 -6.185 -7.579 5.361 1.00 0.00 C ATOM 406 O GLU A 28 -5.236 -8.297 5.066 1.00 0.00 O ATOM 407 CB GLU A 28 -8.185 -9.052 5.670 1.00 0.00 C ATOM 408 CG GLU A 28 -9.628 -9.362 5.304 1.00 0.00 C ATOM 409 CD GLU A 28 -9.739 -10.311 4.128 1.00 0.00 C ATOM 410 OE1 GLU A 28 -9.199 -11.434 4.216 1.00 0.00 O ATOM 411 OE2 GLU A 28 -10.366 -9.930 3.116 1.00 0.00 O ATOM 0 H GLU A 28 -6.773 -8.872 3.200 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.216 -7.023 4.992 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.580 -9.946 5.519 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.132 -8.807 6.731 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.132 -9.797 6.167 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.147 -8.433 5.067 1.00 0.00 H new ATOM 418 N TYR A 29 -6.055 -6.488 6.104 1.00 0.00 N ATOM 419 CA TYR A 29 -4.745 -6.083 6.609 1.00 0.00 C ATOM 420 C TYR A 29 -4.485 -6.635 8.004 1.00 0.00 C ATOM 421 O TYR A 29 -5.336 -7.293 8.590 1.00 0.00 O ATOM 422 CB TYR A 29 -4.617 -4.559 6.598 1.00 0.00 C ATOM 423 CG TYR A 29 -5.413 -3.867 7.670 1.00 0.00 C ATOM 424 CD1 TYR A 29 -6.759 -3.570 7.485 1.00 0.00 C ATOM 425 CD2 TYR A 29 -4.814 -3.503 8.868 1.00 0.00 C ATOM 426 CE1 TYR A 29 -7.485 -2.930 8.466 1.00 0.00 C ATOM 427 CE2 TYR A 29 -5.535 -2.862 9.853 1.00 0.00 C ATOM 428 CZ TYR A 29 -6.867 -2.578 9.650 1.00 0.00 C ATOM 429 OH TYR A 29 -7.581 -1.944 10.637 1.00 0.00 O ATOM 0 H TYR A 29 -6.826 -5.874 6.369 1.00 0.00 H new ATOM 0 HA TYR A 29 -3.989 -6.503 5.946 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -3.566 -4.293 6.712 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.937 -4.186 5.625 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.242 -3.845 6.559 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.770 -3.725 9.031 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -8.530 -2.705 8.310 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.057 -2.584 10.780 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.212 -2.575 11.041 1.00 0.00 H new ATOM 439 N HIS A 30 -3.294 -6.378 8.526 1.00 0.00 N ATOM 440 CA HIS A 30 -2.936 -6.876 9.851 1.00 0.00 C ATOM 441 C HIS A 30 -3.520 -6.005 10.961 1.00 0.00 C ATOM 442 O HIS A 30 -4.435 -6.425 11.669 1.00 0.00 O ATOM 443 CB HIS A 30 -1.421 -6.962 9.997 1.00 0.00 C ATOM 444 CG HIS A 30 -0.973 -8.088 10.877 1.00 0.00 C ATOM 445 ND1 HIS A 30 -0.972 -9.405 10.469 1.00 0.00 N ATOM 446 CD2 HIS A 30 -0.515 -8.090 12.151 1.00 0.00 C ATOM 447 CE1 HIS A 30 -0.534 -10.169 11.454 1.00 0.00 C ATOM 448 NE2 HIS A 30 -0.248 -9.395 12.485 1.00 0.00 N ATOM 0 H HIS A 30 -2.566 -5.835 8.061 1.00 0.00 H new ATOM 0 HA HIS A 30 -3.363 -7.874 9.950 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -0.974 -7.082 9.010 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.048 -6.022 10.404 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -0.384 -7.226 12.786 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -0.428 -11.243 11.421 1.00 0.00 H new ATOM 0 HE2 HIS A 30 0.113 -9.715 13.384 1.00 0.00 H new ATOM 457 N LYS A 31 -2.987 -4.797 11.117 1.00 0.00 N ATOM 458 CA LYS A 31 -3.465 -3.887 12.153 1.00 0.00 C ATOM 459 C LYS A 31 -2.870 -2.492 11.982 1.00 0.00 C ATOM 460 O LYS A 31 -1.721 -2.343 11.569 1.00 0.00 O ATOM 461 CB LYS A 31 -3.112 -4.434 13.538 1.00 0.00 C ATOM 462 CG LYS A 31 -1.617 -4.517 13.799 1.00 0.00 C ATOM 463 CD LYS A 31 -1.278 -4.139 15.231 1.00 0.00 C ATOM 464 CE LYS A 31 -0.167 -5.014 15.790 1.00 0.00 C ATOM 465 NZ LYS A 31 0.679 -4.279 16.770 1.00 0.00 N ATOM 0 H LYS A 31 -2.229 -4.427 10.544 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.548 -3.811 12.058 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.570 -3.800 14.297 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.547 -5.427 13.648 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.267 -5.529 13.597 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.090 -3.855 13.113 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.973 -3.093 15.270 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.167 -4.236 15.854 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -0.602 -5.890 16.271 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.456 -5.376 14.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.424 -4.910 17.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.115 -3.457 16.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.090 -3.955 17.563 1.00 0.00 H new ATOM 479 N GLY A 32 -3.661 -1.474 12.311 1.00 0.00 N ATOM 480 CA GLY A 32 -3.193 -0.103 12.197 1.00 0.00 C ATOM 481 C GLY A 32 -3.692 0.591 10.944 1.00 0.00 C ATOM 482 O GLY A 32 -3.767 1.819 10.897 1.00 0.00 O ATOM 0 H GLY A 32 -4.616 -1.574 12.654 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -3.518 0.460 13.072 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.103 -0.095 12.200 1.00 0.00 H new ATOM 486 N ALA A 33 -4.027 -0.191 9.922 1.00 0.00 N ATOM 487 CA ALA A 33 -4.512 0.363 8.663 1.00 0.00 C ATOM 488 C ALA A 33 -5.752 1.233 8.870 1.00 0.00 C ATOM 489 O ALA A 33 -5.712 2.443 8.653 1.00 0.00 O ATOM 490 CB ALA A 33 -4.801 -0.761 7.680 1.00 0.00 C ATOM 0 H ALA A 33 -3.971 -1.209 9.941 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.732 1.004 8.252 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -5.163 -0.340 6.742 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.888 -1.327 7.495 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -5.560 -1.423 8.097 1.00 0.00 H new ATOM 496 N LYS A 34 -6.856 0.601 9.272 1.00 0.00 N ATOM 497 CA LYS A 34 -8.126 1.291 9.495 1.00 0.00 C ATOM 498 C LYS A 34 -7.929 2.708 10.039 1.00 0.00 C ATOM 499 O LYS A 34 -8.224 3.688 9.358 1.00 0.00 O ATOM 500 CB LYS A 34 -8.999 0.492 10.470 1.00 0.00 C ATOM 501 CG LYS A 34 -9.883 -0.549 9.797 1.00 0.00 C ATOM 502 CD LYS A 34 -11.191 -0.739 10.549 1.00 0.00 C ATOM 503 CE LYS A 34 -12.358 -0.937 9.595 1.00 0.00 C ATOM 504 NZ LYS A 34 -13.658 -0.577 10.225 1.00 0.00 N ATOM 0 H LYS A 34 -6.894 -0.402 9.452 1.00 0.00 H new ATOM 0 HA LYS A 34 -8.620 1.368 8.526 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.355 -0.007 11.194 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -9.630 1.184 11.028 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.092 -0.242 8.772 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -9.352 -1.499 9.743 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -11.110 -1.602 11.210 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -11.379 0.130 11.180 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.206 -0.328 8.704 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.388 -1.977 9.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.428 -0.726 9.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.816 -1.175 11.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.639 0.422 10.513 1.00 0.00 H new ATOM 518 N ASP A 35 -7.447 2.797 11.277 1.00 0.00 N ATOM 519 CA ASP A 35 -7.221 4.081 11.946 1.00 0.00 C ATOM 520 C ASP A 35 -6.777 5.178 10.978 1.00 0.00 C ATOM 521 O ASP A 35 -7.518 6.118 10.731 1.00 0.00 O ATOM 522 CB ASP A 35 -6.176 3.915 13.040 1.00 0.00 C ATOM 523 CG ASP A 35 -6.512 4.705 14.290 1.00 0.00 C ATOM 524 OD1 ASP A 35 -7.690 4.686 14.704 1.00 0.00 O ATOM 525 OD2 ASP A 35 -5.598 5.340 14.855 1.00 0.00 O ATOM 0 H ASP A 35 -7.202 1.986 11.845 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.174 4.391 12.375 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.086 2.859 13.295 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.205 4.235 12.662 1.00 0.00 H new ATOM 530 N GLY A 36 -5.565 5.054 10.446 1.00 0.00 N ATOM 531 CA GLY A 36 -5.037 6.045 9.518 1.00 0.00 C ATOM 532 C GLY A 36 -6.092 6.609 8.587 1.00 0.00 C ATOM 533 O GLY A 36 -6.549 7.737 8.768 1.00 0.00 O ATOM 0 H GLY A 36 -4.932 4.278 10.642 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.587 6.861 10.084 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.242 5.592 8.925 1.00 0.00 H new ATOM 537 N LEU A 37 -6.485 5.824 7.590 1.00 0.00 N ATOM 538 CA LEU A 37 -7.496 6.254 6.638 1.00 0.00 C ATOM 539 C LEU A 37 -8.748 6.755 7.357 1.00 0.00 C ATOM 540 O LEU A 37 -9.279 7.810 7.029 1.00 0.00 O ATOM 541 CB LEU A 37 -7.852 5.103 5.690 1.00 0.00 C ATOM 542 CG LEU A 37 -9.206 5.224 4.979 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.414 6.630 4.452 1.00 0.00 C ATOM 544 CD2 LEU A 37 -9.299 4.213 3.851 1.00 0.00 C ATOM 0 H LEU A 37 -6.118 4.887 7.422 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.087 7.080 6.056 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.071 5.024 4.934 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.842 4.172 6.257 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.994 5.014 5.702 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.380 6.692 3.952 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.389 7.337 5.281 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.623 6.874 3.743 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.265 4.309 3.355 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.501 4.396 3.131 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.198 3.206 4.256 1.00 0.00 H new ATOM 556 N THR A 38 -9.221 6.000 8.338 1.00 0.00 N ATOM 557 CA THR A 38 -10.414 6.395 9.076 1.00 0.00 C ATOM 558 C THR A 38 -10.179 7.701 9.829 1.00 0.00 C ATOM 559 O THR A 38 -11.040 8.576 9.859 1.00 0.00 O ATOM 560 CB THR A 38 -10.838 5.273 10.029 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.194 4.931 9.816 1.00 0.00 O ATOM 562 CG2 THR A 38 -10.685 5.597 11.494 1.00 0.00 C ATOM 0 H THR A 38 -8.803 5.120 8.640 1.00 0.00 H new ATOM 0 HA THR A 38 -11.224 6.567 8.367 1.00 0.00 H new ATOM 0 HB THR A 38 -10.161 4.450 9.797 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.464 4.246 10.462 1.00 0.00 H new ATOM 0 HG21 THR A 38 -11.009 4.745 12.091 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.639 5.815 11.711 1.00 0.00 H new ATOM 0 HG23 THR A 38 -11.296 6.466 11.740 1.00 0.00 H new ATOM 570 N VAL A 39 -9.007 7.822 10.426 1.00 0.00 N ATOM 571 CA VAL A 39 -8.637 9.014 11.175 1.00 0.00 C ATOM 572 C VAL A 39 -8.842 10.252 10.320 1.00 0.00 C ATOM 573 O VAL A 39 -9.349 11.270 10.793 1.00 0.00 O ATOM 574 CB VAL A 39 -7.176 8.901 11.655 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.592 10.248 12.049 1.00 0.00 C ATOM 576 CG2 VAL A 39 -7.101 7.923 12.810 1.00 0.00 C ATOM 0 H VAL A 39 -8.286 7.101 10.407 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.277 9.102 12.053 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.574 8.533 10.824 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.562 10.115 12.380 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.614 10.919 11.190 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -7.181 10.677 12.860 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.069 7.841 13.151 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.727 8.278 13.629 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.453 6.945 12.482 1.00 0.00 H new ATOM 586 N GLU A 40 -8.491 10.143 9.047 1.00 0.00 N ATOM 587 CA GLU A 40 -8.693 11.246 8.125 1.00 0.00 C ATOM 588 C GLU A 40 -10.167 11.303 7.752 1.00 0.00 C ATOM 589 O GLU A 40 -10.692 12.369 7.457 1.00 0.00 O ATOM 590 CB GLU A 40 -7.815 11.135 6.870 1.00 0.00 C ATOM 591 CG GLU A 40 -7.478 9.721 6.453 1.00 0.00 C ATOM 592 CD GLU A 40 -8.115 9.333 5.134 1.00 0.00 C ATOM 593 OE1 GLU A 40 -9.362 9.316 5.060 1.00 0.00 O ATOM 594 OE2 GLU A 40 -7.369 9.050 4.173 1.00 0.00 O ATOM 0 H GLU A 40 -8.070 9.311 8.634 1.00 0.00 H new ATOM 0 HA GLU A 40 -8.393 12.169 8.621 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.324 11.631 6.043 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.886 11.678 7.045 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.396 9.618 6.373 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.808 9.029 7.228 1.00 0.00 H new ATOM 601 N ILE A 41 -10.843 10.148 7.817 1.00 0.00 N ATOM 602 CA ILE A 41 -12.275 10.081 7.536 1.00 0.00 C ATOM 603 C ILE A 41 -13.022 10.787 8.652 1.00 0.00 C ATOM 604 O ILE A 41 -13.692 11.794 8.425 1.00 0.00 O ATOM 605 CB ILE A 41 -12.788 8.629 7.430 1.00 0.00 C ATOM 606 CG1 ILE A 41 -12.071 7.894 6.304 1.00 0.00 C ATOM 607 CG2 ILE A 41 -14.293 8.606 7.209 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.426 8.397 4.923 1.00 0.00 C ATOM 0 H ILE A 41 -10.419 9.253 8.061 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.449 10.562 6.574 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.573 8.119 8.369 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.995 7.988 6.449 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.310 6.832 6.366 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.634 7.573 7.137 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.791 9.095 8.046 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.533 9.133 6.285 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.876 7.825 4.175 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -13.497 8.278 4.756 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.161 9.451 4.841 1.00 0.00 H new ATOM 620 N ASN A 42 -12.873 10.268 9.876 1.00 0.00 N ATOM 621 CA ASN A 42 -13.503 10.878 11.038 1.00 0.00 C ATOM 622 C ASN A 42 -13.252 12.378 11.012 1.00 0.00 C ATOM 623 O ASN A 42 -14.137 13.181 11.306 1.00 0.00 O ATOM 624 CB ASN A 42 -12.932 10.282 12.328 1.00 0.00 C ATOM 625 CG ASN A 42 -12.929 8.767 12.324 1.00 0.00 C ATOM 626 OD1 ASN A 42 -13.714 8.132 11.620 1.00 0.00 O ATOM 627 ND2 ASN A 42 -12.039 8.180 13.117 1.00 0.00 N ATOM 0 H ASN A 42 -12.324 9.433 10.080 1.00 0.00 H new ATOM 0 HA ASN A 42 -14.575 10.682 11.008 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.913 10.642 12.469 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -13.516 10.637 13.177 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.987 7.162 13.160 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -11.408 8.747 13.683 1.00 0.00 H new ATOM 634 N LYS A 43 -12.025 12.740 10.641 1.00 0.00 N ATOM 635 CA LYS A 43 -11.629 14.144 10.556 1.00 0.00 C ATOM 636 C LYS A 43 -12.099 14.790 9.246 1.00 0.00 C ATOM 637 O LYS A 43 -12.276 16.007 9.181 1.00 0.00 O ATOM 638 CB LYS A 43 -10.110 14.268 10.678 1.00 0.00 C ATOM 639 CG LYS A 43 -9.643 15.664 11.056 1.00 0.00 C ATOM 640 CD LYS A 43 -9.254 16.473 9.829 1.00 0.00 C ATOM 641 CE LYS A 43 -8.033 15.888 9.138 1.00 0.00 C ATOM 642 NZ LYS A 43 -8.401 15.107 7.925 1.00 0.00 N ATOM 0 H LYS A 43 -11.288 12.080 10.394 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.108 14.672 11.380 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -9.755 13.560 11.427 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.653 13.985 9.730 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -10.436 16.180 11.597 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -8.791 15.593 11.732 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -10.090 16.500 9.130 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.049 17.503 10.121 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -7.354 16.693 8.859 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -7.495 15.245 9.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -8.128 14.112 8.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -9.428 15.167 7.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -7.905 15.496 7.098 1.00 0.00 H new ATOM 656 N ALA A 44 -12.289 13.979 8.202 1.00 0.00 N ATOM 657 CA ALA A 44 -12.726 14.491 6.903 1.00 0.00 C ATOM 658 C ALA A 44 -14.228 14.714 6.871 1.00 0.00 C ATOM 659 O ALA A 44 -14.690 15.825 6.632 1.00 0.00 O ATOM 660 CB ALA A 44 -12.326 13.541 5.786 1.00 0.00 C ATOM 0 H ALA A 44 -12.147 12.969 8.232 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.231 15.450 6.750 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.661 13.942 4.830 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -11.242 13.431 5.773 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.788 12.568 5.953 1.00 0.00 H new ATOM 666 N GLU A 45 -14.987 13.650 7.109 1.00 0.00 N ATOM 667 CA GLU A 45 -16.444 13.734 7.105 1.00 0.00 C ATOM 668 C GLU A 45 -16.916 14.923 7.930 1.00 0.00 C ATOM 669 O GLU A 45 -17.782 15.686 7.503 1.00 0.00 O ATOM 670 CB GLU A 45 -17.045 12.446 7.652 1.00 0.00 C ATOM 671 CG GLU A 45 -16.485 11.198 7.000 1.00 0.00 C ATOM 672 CD GLU A 45 -17.424 10.015 7.142 1.00 0.00 C ATOM 673 OE1 GLU A 45 -18.624 10.173 6.836 1.00 0.00 O ATOM 674 OE2 GLU A 45 -16.965 8.939 7.576 1.00 0.00 O ATOM 0 H GLU A 45 -14.619 12.720 7.307 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.778 13.873 6.077 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.866 12.398 8.726 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.125 12.468 7.509 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.302 11.392 5.943 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.523 10.954 7.450 1.00 0.00 H new ATOM 681 N GLU A 46 -16.322 15.085 9.107 1.00 0.00 N ATOM 682 CA GLU A 46 -16.660 16.196 9.984 1.00 0.00 C ATOM 683 C GLU A 46 -16.458 17.514 9.248 1.00 0.00 C ATOM 684 O GLU A 46 -17.069 18.523 9.589 1.00 0.00 O ATOM 685 CB GLU A 46 -15.804 16.163 11.251 1.00 0.00 C ATOM 686 CG GLU A 46 -14.318 16.339 10.987 1.00 0.00 C ATOM 687 CD GLU A 46 -13.616 17.100 12.095 1.00 0.00 C ATOM 688 OE1 GLU A 46 -13.376 16.502 13.166 1.00 0.00 O ATOM 689 OE2 GLU A 46 -13.305 18.292 11.892 1.00 0.00 O ATOM 0 H GLU A 46 -15.604 14.460 9.474 1.00 0.00 H new ATOM 0 HA GLU A 46 -17.706 16.105 10.275 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.140 16.950 11.927 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -15.964 15.214 11.762 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.854 15.359 10.874 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -14.180 16.868 10.044 1.00 0.00 H new ATOM 696 N VAL A 47 -15.604 17.483 8.224 1.00 0.00 N ATOM 697 CA VAL A 47 -15.326 18.656 7.413 1.00 0.00 C ATOM 698 C VAL A 47 -16.197 18.643 6.162 1.00 0.00 C ATOM 699 O VAL A 47 -16.734 19.672 5.753 1.00 0.00 O ATOM 700 CB VAL A 47 -13.823 18.745 7.034 1.00 0.00 C ATOM 701 CG1 VAL A 47 -13.613 18.881 5.530 1.00 0.00 C ATOM 702 CG2 VAL A 47 -13.184 19.918 7.743 1.00 0.00 C ATOM 0 H VAL A 47 -15.092 16.648 7.940 1.00 0.00 H new ATOM 0 HA VAL A 47 -15.565 19.540 8.004 1.00 0.00 H new ATOM 0 HB VAL A 47 -13.353 17.814 7.349 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.546 18.940 5.315 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -14.038 18.014 5.023 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.105 19.786 5.174 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -12.129 19.976 7.473 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -13.685 20.839 7.446 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.276 19.786 8.821 1.00 0.00 H new ATOM 712 N PHE A 48 -16.335 17.462 5.559 1.00 0.00 N ATOM 713 CA PHE A 48 -17.142 17.303 4.355 1.00 0.00 C ATOM 714 C PHE A 48 -18.516 17.931 4.546 1.00 0.00 C ATOM 715 O PHE A 48 -18.997 18.679 3.695 1.00 0.00 O ATOM 716 CB PHE A 48 -17.292 15.819 4.005 1.00 0.00 C ATOM 717 CG PHE A 48 -18.277 15.556 2.899 1.00 0.00 C ATOM 718 CD1 PHE A 48 -18.218 16.275 1.716 1.00 0.00 C ATOM 719 CD2 PHE A 48 -19.262 14.593 3.046 1.00 0.00 C ATOM 720 CE1 PHE A 48 -19.124 16.038 0.700 1.00 0.00 C ATOM 721 CE2 PHE A 48 -20.171 14.351 2.033 1.00 0.00 C ATOM 722 CZ PHE A 48 -20.102 15.075 0.859 1.00 0.00 C ATOM 0 H PHE A 48 -15.896 16.602 5.887 1.00 0.00 H new ATOM 0 HA PHE A 48 -16.635 17.811 3.535 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -16.319 15.423 3.715 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -17.605 15.274 4.896 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -17.456 17.029 1.587 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -19.320 14.025 3.963 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -19.068 16.605 -0.218 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.934 13.597 2.159 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.811 14.889 0.066 1.00 0.00 H new ATOM 732 N ASN A 49 -19.141 17.624 5.676 1.00 0.00 N ATOM 733 CA ASN A 49 -20.458 18.163 5.985 1.00 0.00 C ATOM 734 C ASN A 49 -20.345 19.421 6.841 1.00 0.00 C ATOM 735 O ASN A 49 -21.333 19.879 7.414 1.00 0.00 O ATOM 736 CB ASN A 49 -21.304 17.113 6.708 1.00 0.00 C ATOM 737 CG ASN A 49 -21.281 15.769 6.009 1.00 0.00 C ATOM 738 OD1 ASN A 49 -22.160 15.459 5.205 1.00 0.00 O ATOM 739 ND2 ASN A 49 -20.271 14.960 6.313 1.00 0.00 N ATOM 0 H ASN A 49 -18.758 17.006 6.391 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.944 18.428 5.046 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -20.938 16.995 7.728 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -22.333 17.465 6.778 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -20.203 14.042 5.874 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -19.564 15.257 6.985 1.00 0.00 H new ATOM 746 N LYS A 50 -19.137 19.975 6.933 1.00 0.00 N ATOM 747 CA LYS A 50 -18.914 21.176 7.734 1.00 0.00 C ATOM 748 C LYS A 50 -19.145 22.447 6.924 1.00 0.00 C ATOM 749 O LYS A 50 -19.153 22.421 5.694 1.00 0.00 O ATOM 750 CB LYS A 50 -17.494 21.174 8.285 1.00 0.00 C ATOM 751 CG LYS A 50 -17.323 21.972 9.566 1.00 0.00 C ATOM 752 CD LYS A 50 -15.911 21.831 10.116 1.00 0.00 C ATOM 753 CE LYS A 50 -15.293 23.183 10.432 1.00 0.00 C ATOM 754 NZ LYS A 50 -14.753 23.237 11.819 1.00 0.00 N ATOM 0 H LYS A 50 -18.304 19.615 6.467 1.00 0.00 H new ATOM 0 HA LYS A 50 -19.632 21.164 8.554 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -17.189 20.144 8.468 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -16.821 21.576 7.527 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -17.539 23.023 9.375 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -18.042 21.629 10.310 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -15.931 21.220 11.019 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -15.289 21.307 9.391 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -14.492 23.391 9.722 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -16.043 23.964 10.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -14.340 24.175 11.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -15.522 23.064 12.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -14.019 22.509 11.934 1.00 0.00 H new ATOM 768 N GLU A 51 -19.318 23.563 7.629 1.00 0.00 N ATOM 769 CA GLU A 51 -19.533 24.851 6.982 1.00 0.00 C ATOM 770 C GLU A 51 -18.209 25.538 6.726 1.00 0.00 C ATOM 771 O GLU A 51 -18.060 26.261 5.740 1.00 0.00 O ATOM 772 CB GLU A 51 -20.442 25.742 7.832 1.00 0.00 C ATOM 773 CG GLU A 51 -20.826 27.045 7.150 1.00 0.00 C ATOM 774 CD GLU A 51 -22.182 26.973 6.477 1.00 0.00 C ATOM 775 OE1 GLU A 51 -23.165 26.612 7.159 1.00 0.00 O ATOM 776 OE2 GLU A 51 -22.262 27.276 5.269 1.00 0.00 O ATOM 0 H GLU A 51 -19.313 23.599 8.648 1.00 0.00 H new ATOM 0 HA GLU A 51 -20.026 24.676 6.026 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -21.349 25.190 8.080 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.939 25.968 8.772 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.832 27.848 7.887 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -20.069 27.299 6.408 1.00 0.00 H new ATOM 783 N ASP A 52 -17.232 25.285 7.587 1.00 0.00 N ATOM 784 CA ASP A 52 -15.921 25.867 7.390 1.00 0.00 C ATOM 785 C ASP A 52 -15.081 24.968 6.501 1.00 0.00 C ATOM 786 O ASP A 52 -13.864 25.130 6.412 1.00 0.00 O ATOM 787 CB ASP A 52 -15.198 26.130 8.706 1.00 0.00 C ATOM 788 CG ASP A 52 -16.081 26.818 9.729 1.00 0.00 C ATOM 789 OD1 ASP A 52 -16.966 27.599 9.319 1.00 0.00 O ATOM 790 OD2 ASP A 52 -15.888 26.576 10.938 1.00 0.00 O ATOM 0 H ASP A 52 -17.323 24.692 8.412 1.00 0.00 H new ATOM 0 HA ASP A 52 -16.065 26.832 6.904 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -14.842 25.185 9.116 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -14.319 26.747 8.517 1.00 0.00 H new ATOM 795 N ALA A 53 -15.746 24.053 5.797 1.00 0.00 N ATOM 796 CA ALA A 53 -15.075 23.178 4.869 1.00 0.00 C ATOM 797 C ALA A 53 -14.787 23.983 3.621 1.00 0.00 C ATOM 798 O ALA A 53 -15.091 23.578 2.503 1.00 0.00 O ATOM 799 CB ALA A 53 -15.929 21.959 4.559 1.00 0.00 C ATOM 0 H ALA A 53 -16.754 23.907 5.861 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.145 22.803 5.297 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -15.401 21.314 3.857 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -16.126 21.409 5.479 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -16.873 22.279 4.119 1.00 0.00 H new ATOM 805 N THR A 54 -14.230 25.158 3.858 1.00 0.00 N ATOM 806 CA THR A 54 -13.893 26.102 2.815 1.00 0.00 C ATOM 807 C THR A 54 -12.467 25.885 2.331 1.00 0.00 C ATOM 808 O THR A 54 -12.077 24.778 1.966 1.00 0.00 O ATOM 809 CB THR A 54 -14.101 27.525 3.348 1.00 0.00 C ATOM 810 OG1 THR A 54 -13.074 27.876 4.259 1.00 0.00 O ATOM 811 CG2 THR A 54 -15.426 27.708 4.058 1.00 0.00 C ATOM 0 H THR A 54 -13.997 25.485 4.796 1.00 0.00 H new ATOM 0 HA THR A 54 -14.545 25.950 1.955 1.00 0.00 H new ATOM 0 HB THR A 54 -14.084 28.169 2.468 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.798 28.803 4.099 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.511 28.736 4.411 1.00 0.00 H new ATOM 0 HG22 THR A 54 -16.242 27.493 3.368 1.00 0.00 H new ATOM 0 HG23 THR A 54 -15.481 27.027 4.908 1.00 0.00 H new ATOM 819 N GLU A 55 -11.705 26.950 2.316 1.00 0.00 N ATOM 820 CA GLU A 55 -10.319 26.899 1.862 1.00 0.00 C ATOM 821 C GLU A 55 -9.354 26.561 2.997 1.00 0.00 C ATOM 822 O GLU A 55 -8.190 26.252 2.752 1.00 0.00 O ATOM 823 CB GLU A 55 -9.925 28.236 1.231 1.00 0.00 C ATOM 824 CG GLU A 55 -9.933 29.398 2.211 1.00 0.00 C ATOM 825 CD GLU A 55 -9.503 30.703 1.571 1.00 0.00 C ATOM 826 OE1 GLU A 55 -8.682 30.661 0.631 1.00 0.00 O ATOM 827 OE2 GLU A 55 -9.986 31.768 2.011 1.00 0.00 O ATOM 0 H GLU A 55 -12.016 27.875 2.614 1.00 0.00 H new ATOM 0 HA GLU A 55 -10.249 26.104 1.120 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.929 28.144 0.798 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -10.610 28.457 0.412 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -10.935 29.513 2.624 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -9.269 29.170 3.045 1.00 0.00 H new ATOM 834 N GLU A 56 -9.825 26.640 4.238 1.00 0.00 N ATOM 835 CA GLU A 56 -8.971 26.357 5.388 1.00 0.00 C ATOM 836 C GLU A 56 -9.114 24.923 5.906 1.00 0.00 C ATOM 837 O GLU A 56 -8.118 24.248 6.157 1.00 0.00 O ATOM 838 CB GLU A 56 -9.268 27.343 6.520 1.00 0.00 C ATOM 839 CG GLU A 56 -8.172 28.375 6.728 1.00 0.00 C ATOM 840 CD GLU A 56 -8.596 29.497 7.654 1.00 0.00 C ATOM 841 OE1 GLU A 56 -8.561 29.295 8.886 1.00 0.00 O ATOM 842 OE2 GLU A 56 -8.962 30.578 7.148 1.00 0.00 O ATOM 0 H GLU A 56 -10.784 26.895 4.473 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.943 26.473 5.046 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -10.205 27.858 6.306 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -9.413 26.787 7.446 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.289 27.884 7.138 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.885 28.794 5.764 1.00 0.00 H new ATOM 849 N GLU A 57 -10.352 24.484 6.120 1.00 0.00 N ATOM 850 CA GLU A 57 -10.602 23.153 6.676 1.00 0.00 C ATOM 851 C GLU A 57 -10.475 22.017 5.657 1.00 0.00 C ATOM 852 O GLU A 57 -10.015 20.931 6.006 1.00 0.00 O ATOM 853 CB GLU A 57 -11.984 23.112 7.322 1.00 0.00 C ATOM 854 CG GLU A 57 -12.197 24.195 8.365 1.00 0.00 C ATOM 855 CD GLU A 57 -11.573 23.848 9.702 1.00 0.00 C ATOM 856 OE1 GLU A 57 -11.853 22.747 10.220 1.00 0.00 O ATOM 857 OE2 GLU A 57 -10.803 24.678 10.231 1.00 0.00 O ATOM 0 H GLU A 57 -11.193 25.025 5.919 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.823 22.985 7.419 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -12.742 23.212 6.546 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -12.130 22.137 7.787 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -11.773 25.132 8.003 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -13.266 24.360 8.499 1.00 0.00 H new ATOM 864 N ILE A 58 -10.892 22.241 4.416 1.00 0.00 N ATOM 865 CA ILE A 58 -10.818 21.191 3.402 1.00 0.00 C ATOM 866 C ILE A 58 -9.391 20.699 3.219 1.00 0.00 C ATOM 867 O ILE A 58 -9.075 19.561 3.556 1.00 0.00 O ATOM 868 CB ILE A 58 -11.373 21.661 2.051 1.00 0.00 C ATOM 869 CG1 ILE A 58 -12.813 22.134 2.231 1.00 0.00 C ATOM 870 CG2 ILE A 58 -11.296 20.543 1.015 1.00 0.00 C ATOM 871 CD1 ILE A 58 -13.505 22.519 0.942 1.00 0.00 C ATOM 0 H ILE A 58 -11.280 23.126 4.089 1.00 0.00 H new ATOM 0 HA ILE A 58 -11.435 20.368 3.762 1.00 0.00 H new ATOM 0 HB ILE A 58 -10.768 22.491 1.687 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -13.386 21.343 2.715 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -12.821 22.991 2.904 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -11.695 20.899 0.065 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -10.257 20.241 0.882 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.881 19.689 1.357 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -14.523 22.843 1.158 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -12.959 23.333 0.465 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -13.533 21.659 0.273 1.00 0.00 H new ATOM 883 N ASN A 59 -8.528 21.562 2.693 1.00 0.00 N ATOM 884 CA ASN A 59 -7.125 21.191 2.485 1.00 0.00 C ATOM 885 C ASN A 59 -6.574 20.561 3.755 1.00 0.00 C ATOM 886 O ASN A 59 -5.828 19.584 3.713 1.00 0.00 O ATOM 887 CB ASN A 59 -6.263 22.401 2.095 1.00 0.00 C ATOM 888 CG ASN A 59 -6.947 23.733 2.333 1.00 0.00 C ATOM 889 OD1 ASN A 59 -6.783 24.348 3.388 1.00 0.00 O ATOM 890 ND2 ASN A 59 -7.717 24.183 1.352 1.00 0.00 N ATOM 0 H ASN A 59 -8.766 22.511 2.405 1.00 0.00 H new ATOM 0 HA ASN A 59 -7.087 20.478 1.662 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.333 22.373 2.663 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.996 22.322 1.041 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.204 25.074 1.453 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.823 23.639 0.496 1.00 0.00 H new ATOM 897 N LEU A 60 -6.973 21.130 4.883 1.00 0.00 N ATOM 898 CA LEU A 60 -6.554 20.639 6.184 1.00 0.00 C ATOM 899 C LEU A 60 -7.114 19.240 6.427 1.00 0.00 C ATOM 900 O LEU A 60 -6.455 18.392 7.029 1.00 0.00 O ATOM 901 CB LEU A 60 -7.028 21.596 7.281 1.00 0.00 C ATOM 902 CG LEU A 60 -6.043 22.711 7.649 1.00 0.00 C ATOM 903 CD1 LEU A 60 -5.525 23.407 6.400 1.00 0.00 C ATOM 904 CD2 LEU A 60 -6.702 23.714 8.587 1.00 0.00 C ATOM 0 H LEU A 60 -7.592 21.940 4.921 1.00 0.00 H new ATOM 0 HA LEU A 60 -5.466 20.586 6.207 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.965 22.052 6.962 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -7.245 21.015 8.178 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.194 22.262 8.164 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.828 24.195 6.685 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -5.015 22.683 5.765 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.361 23.843 5.853 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -5.989 24.499 8.839 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -7.570 24.155 8.097 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -7.019 23.206 9.498 1.00 0.00 H new ATOM 916 N ALA A 61 -8.341 19.005 5.957 1.00 0.00 N ATOM 917 CA ALA A 61 -8.989 17.710 6.126 1.00 0.00 C ATOM 918 C ALA A 61 -8.616 16.734 5.008 1.00 0.00 C ATOM 919 O ALA A 61 -8.797 15.524 5.147 1.00 0.00 O ATOM 920 CB ALA A 61 -10.499 17.888 6.176 1.00 0.00 C ATOM 0 H ALA A 61 -8.902 19.695 5.458 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.637 17.285 7.066 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.976 16.916 6.302 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.762 18.533 7.015 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.843 18.343 5.247 1.00 0.00 H new ATOM 926 N LYS A 62 -8.112 17.263 3.896 1.00 0.00 N ATOM 927 CA LYS A 62 -7.738 16.433 2.754 1.00 0.00 C ATOM 928 C LYS A 62 -6.288 15.953 2.848 1.00 0.00 C ATOM 929 O LYS A 62 -5.924 14.941 2.248 1.00 0.00 O ATOM 930 CB LYS A 62 -7.960 17.206 1.445 1.00 0.00 C ATOM 931 CG LYS A 62 -6.749 17.999 0.974 1.00 0.00 C ATOM 932 CD LYS A 62 -7.088 18.875 -0.220 1.00 0.00 C ATOM 933 CE LYS A 62 -5.982 19.878 -0.508 1.00 0.00 C ATOM 934 NZ LYS A 62 -6.486 21.061 -1.258 1.00 0.00 N ATOM 0 H LYS A 62 -7.953 18.262 3.761 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.376 15.549 2.764 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.244 16.501 0.664 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.798 17.890 1.578 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -6.380 18.621 1.790 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.945 17.313 0.707 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -7.250 18.249 -1.097 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -8.021 19.405 -0.030 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -5.536 20.206 0.431 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.193 19.393 -1.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -5.701 21.720 -1.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -6.888 20.751 -2.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -7.221 21.539 -0.699 1.00 0.00 H new ATOM 948 N GLU A 63 -5.464 16.687 3.592 1.00 0.00 N ATOM 949 CA GLU A 63 -4.052 16.338 3.751 1.00 0.00 C ATOM 950 C GLU A 63 -3.867 14.843 4.006 1.00 0.00 C ATOM 951 O GLU A 63 -3.067 14.183 3.340 1.00 0.00 O ATOM 952 CB GLU A 63 -3.438 17.138 4.901 1.00 0.00 C ATOM 953 CG GLU A 63 -1.995 17.548 4.654 1.00 0.00 C ATOM 954 CD GLU A 63 -1.104 16.370 4.315 1.00 0.00 C ATOM 955 OE1 GLU A 63 -1.208 15.853 3.183 1.00 0.00 O ATOM 956 OE2 GLU A 63 -0.302 15.963 5.182 1.00 0.00 O ATOM 0 H GLU A 63 -5.749 17.528 4.095 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.543 16.587 2.820 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.037 18.033 5.071 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.487 16.543 5.813 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.961 18.271 3.839 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.607 18.049 5.541 1.00 0.00 H new ATOM 963 N SER A 64 -4.609 14.316 4.973 1.00 0.00 N ATOM 964 CA SER A 64 -4.532 12.904 5.321 1.00 0.00 C ATOM 965 C SER A 64 -5.616 12.096 4.609 1.00 0.00 C ATOM 966 O SER A 64 -5.591 10.869 4.616 1.00 0.00 O ATOM 967 CB SER A 64 -4.659 12.726 6.835 1.00 0.00 C ATOM 968 OG SER A 64 -4.659 11.353 7.188 1.00 0.00 O ATOM 0 H SER A 64 -5.274 14.850 5.532 1.00 0.00 H new ATOM 0 HA SER A 64 -3.561 12.531 4.994 1.00 0.00 H new ATOM 0 HB2 SER A 64 -3.834 13.233 7.335 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.579 13.195 7.184 1.00 0.00 H new ATOM 0 HG SER A 64 -4.740 11.265 8.161 1.00 0.00 H new ATOM 974 N LEU A 65 -6.571 12.784 3.998 1.00 0.00 N ATOM 975 CA LEU A 65 -7.651 12.117 3.300 1.00 0.00 C ATOM 976 C LEU A 65 -7.129 11.420 2.060 1.00 0.00 C ATOM 977 O LEU A 65 -7.514 10.292 1.758 1.00 0.00 O ATOM 978 CB LEU A 65 -8.730 13.126 2.918 1.00 0.00 C ATOM 979 CG LEU A 65 -10.046 12.519 2.439 1.00 0.00 C ATOM 980 CD1 LEU A 65 -10.494 11.395 3.362 1.00 0.00 C ATOM 981 CD2 LEU A 65 -11.115 13.592 2.341 1.00 0.00 C ATOM 0 H LEU A 65 -6.616 13.803 3.974 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.084 11.369 3.964 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.934 13.760 3.781 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.339 13.772 2.132 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.888 12.095 1.447 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.434 10.979 2.999 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -9.734 10.614 3.379 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.635 11.786 4.370 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -12.048 13.145 1.998 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.267 14.044 3.321 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.798 14.358 1.633 1.00 0.00 H new ATOM 993 N GLU A 66 -6.249 12.105 1.343 1.00 0.00 N ATOM 994 CA GLU A 66 -5.670 11.559 0.135 1.00 0.00 C ATOM 995 C GLU A 66 -4.327 10.888 0.412 1.00 0.00 C ATOM 996 O GLU A 66 -3.899 10.005 -0.333 1.00 0.00 O ATOM 997 CB GLU A 66 -5.499 12.655 -0.919 1.00 0.00 C ATOM 998 CG GLU A 66 -4.498 13.729 -0.522 1.00 0.00 C ATOM 999 CD GLU A 66 -4.351 14.806 -1.579 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -5.362 15.134 -2.237 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -3.227 15.324 -1.747 1.00 0.00 O ATOM 0 H GLU A 66 -5.923 13.042 1.582 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.355 10.801 -0.245 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -5.179 12.200 -1.856 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.466 13.122 -1.106 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.813 14.186 0.416 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.527 13.267 -0.341 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.657 11.322 1.475 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.362 10.763 1.815 1.00 0.00 C ATOM 1010 C GLY A 67 -2.450 9.517 2.678 1.00 0.00 C ATOM 1011 O GLY A 67 -1.504 8.732 2.732 1.00 0.00 O ATOM 0 H GLY A 67 -3.988 12.051 2.107 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.826 10.523 0.897 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.775 11.518 2.338 1.00 0.00 H new ATOM 1015 N ALA A 68 -3.576 9.332 3.361 1.00 0.00 N ATOM 1016 CA ALA A 68 -3.748 8.170 4.224 1.00 0.00 C ATOM 1017 C ALA A 68 -4.385 7.002 3.475 1.00 0.00 C ATOM 1018 O ALA A 68 -4.005 5.850 3.683 1.00 0.00 O ATOM 1019 CB ALA A 68 -4.569 8.526 5.448 1.00 0.00 C ATOM 0 H ALA A 68 -4.375 9.965 3.334 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.756 7.855 4.549 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.685 7.644 6.078 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.062 9.310 6.011 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.551 8.881 5.137 1.00 0.00 H new ATOM 1025 N ILE A 69 -5.335 7.292 2.583 1.00 0.00 N ATOM 1026 CA ILE A 69 -5.971 6.238 1.805 1.00 0.00 C ATOM 1027 C ILE A 69 -4.907 5.541 1.007 1.00 0.00 C ATOM 1028 O ILE A 69 -4.853 4.314 0.928 1.00 0.00 O ATOM 1029 CB ILE A 69 -7.031 6.768 0.821 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -6.567 8.065 0.149 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -8.352 6.965 1.526 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -7.644 8.731 -0.686 1.00 0.00 C ATOM 0 H ILE A 69 -5.674 8.234 2.387 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.475 5.573 2.506 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.168 6.024 0.036 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.230 8.762 0.916 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.708 7.849 -0.486 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.090 7.340 0.817 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -8.692 6.013 1.935 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.229 7.684 2.336 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.247 9.643 -1.132 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.965 8.051 -1.475 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.495 8.978 -0.052 1.00 0.00 H new ATOM 1044 N ALA A 70 -4.035 6.359 0.437 1.00 0.00 N ATOM 1045 CA ALA A 70 -2.929 5.862 -0.343 1.00 0.00 C ATOM 1046 C ALA A 70 -2.181 4.782 0.434 1.00 0.00 C ATOM 1047 O ALA A 70 -1.563 3.892 -0.149 1.00 0.00 O ATOM 1048 CB ALA A 70 -2.009 7.012 -0.720 1.00 0.00 C ATOM 0 H ALA A 70 -4.079 7.376 0.505 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.305 5.411 -1.262 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.174 6.632 -1.309 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -2.564 7.744 -1.306 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.628 7.485 0.185 1.00 0.00 H new ATOM 1054 N ARG A 71 -2.269 4.862 1.762 1.00 0.00 N ATOM 1055 CA ARG A 71 -1.634 3.888 2.634 1.00 0.00 C ATOM 1056 C ARG A 71 -2.585 2.726 2.905 1.00 0.00 C ATOM 1057 O ARG A 71 -2.277 1.577 2.584 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.217 4.545 3.953 1.00 0.00 C ATOM 1059 CG ARG A 71 0.225 5.024 3.965 1.00 0.00 C ATOM 1060 CD ARG A 71 0.459 6.113 2.929 1.00 0.00 C ATOM 1061 NE ARG A 71 1.830 6.101 2.423 1.00 0.00 N ATOM 1062 CZ ARG A 71 2.890 6.455 3.144 1.00 0.00 C ATOM 1063 NH1 ARG A 71 2.743 6.849 4.404 1.00 0.00 N ATOM 1064 NH2 ARG A 71 4.101 6.415 2.607 1.00 0.00 N ATOM 0 H ARG A 71 -2.777 5.597 2.254 1.00 0.00 H new ATOM 0 HA ARG A 71 -0.742 3.506 2.137 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -1.874 5.392 4.151 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -1.361 3.833 4.765 1.00 0.00 H new ATOM 0 HG2 ARG A 71 0.475 5.403 4.956 1.00 0.00 H new ATOM 0 HG3 ARG A 71 0.890 4.184 3.768 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -0.235 5.979 2.099 1.00 0.00 H new ATOM 0 HD3 ARG A 71 0.244 7.086 3.371 1.00 0.00 H new ATOM 0 HE ARG A 71 1.983 5.803 1.459 1.00 0.00 H new ATOM 0 HH11 ARG A 71 1.814 6.881 4.823 1.00 0.00 H new ATOM 0 HH12 ARG A 71 3.559 7.119 4.952 1.00 0.00 H new ATOM 0 HH21 ARG A 71 4.220 6.113 1.640 1.00 0.00 H new ATOM 0 HH22 ARG A 71 4.914 6.687 3.161 1.00 0.00 H new ATOM 1078 N PHE A 72 -3.748 3.026 3.492 1.00 0.00 N ATOM 1079 CA PHE A 72 -4.737 2.007 3.796 1.00 0.00 C ATOM 1080 C PHE A 72 -4.999 1.101 2.595 1.00 0.00 C ATOM 1081 O PHE A 72 -5.198 -0.104 2.745 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.034 2.677 4.229 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.021 1.717 4.801 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -6.744 1.037 5.971 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -8.224 1.493 4.168 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -7.656 0.147 6.501 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -9.137 0.613 4.690 1.00 0.00 C ATOM 1088 CZ PHE A 72 -8.855 -0.064 5.860 1.00 0.00 C ATOM 0 H PHE A 72 -4.021 3.971 3.764 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.349 1.385 4.603 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.811 3.445 4.970 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.480 3.181 3.372 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -5.804 1.204 6.476 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.450 2.016 3.251 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.429 -0.382 7.415 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -10.078 0.449 4.185 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.574 -0.757 6.271 1.00 0.00 H new ATOM 1098 N ASN A 73 -4.996 1.691 1.405 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.231 0.940 0.177 1.00 0.00 C ATOM 1100 C ASN A 73 -4.235 -0.204 0.054 1.00 0.00 C ATOM 1101 O ASN A 73 -4.562 -1.278 -0.448 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.121 1.860 -1.040 1.00 0.00 C ATOM 1103 CG ASN A 73 -6.255 2.866 -1.114 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.420 2.517 -0.933 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -5.916 4.122 -1.386 1.00 0.00 N ATOM 0 H ASN A 73 -4.833 2.688 1.264 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.239 0.526 0.216 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -4.170 2.392 -1.004 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.115 1.257 -1.948 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -6.636 4.842 -1.452 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -4.936 4.366 -1.529 1.00 0.00 H new ATOM 1112 N SER A 74 -3.015 0.040 0.516 1.00 0.00 N ATOM 1113 CA SER A 74 -1.960 -0.964 0.461 1.00 0.00 C ATOM 1114 C SER A 74 -1.659 -1.528 1.849 1.00 0.00 C ATOM 1115 O SER A 74 -0.503 -1.769 2.194 1.00 0.00 O ATOM 1116 CB SER A 74 -0.692 -0.363 -0.155 1.00 0.00 C ATOM 1117 OG SER A 74 -0.733 1.052 -0.126 1.00 0.00 O ATOM 0 H SER A 74 -2.731 0.926 0.934 1.00 0.00 H new ATOM 0 HA SER A 74 -2.307 -1.785 -0.166 1.00 0.00 H new ATOM 0 HB2 SER A 74 0.183 -0.716 0.390 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.586 -0.706 -1.184 1.00 0.00 H new ATOM 0 HG SER A 74 0.088 1.411 -0.523 1.00 0.00 H new ATOM 1123 N LEU A 75 -2.706 -1.738 2.643 1.00 0.00 N ATOM 1124 CA LEU A 75 -2.547 -2.273 3.993 1.00 0.00 C ATOM 1125 C LEU A 75 -3.113 -3.692 4.091 1.00 0.00 C ATOM 1126 O LEU A 75 -2.590 -4.532 4.824 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.243 -1.359 5.007 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.311 -0.478 5.843 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -1.401 -1.333 6.709 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -1.491 0.436 4.947 1.00 0.00 C ATOM 0 H LEU A 75 -3.672 -1.546 2.376 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.482 -2.314 4.220 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.941 -0.715 4.472 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.834 -1.977 5.683 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.923 0.143 6.497 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.746 -0.689 7.296 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.005 -1.943 7.380 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -0.798 -1.981 6.073 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.835 1.054 5.560 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.890 -0.166 4.266 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.159 1.077 4.372 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.179 -3.943 3.341 1.00 0.00 N ATOM 1143 CA LEU A 76 -4.845 -5.249 3.319 1.00 0.00 C ATOM 1144 C LEU A 76 -4.030 -6.273 2.542 1.00 0.00 C ATOM 1145 O LEU A 76 -4.541 -6.921 1.628 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.228 -5.115 2.674 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.299 -4.215 1.427 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.592 -2.775 1.830 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -5.013 -4.299 0.595 1.00 0.00 C ATOM 0 H LEU A 76 -4.610 -3.250 2.729 1.00 0.00 H new ATOM 0 HA LEU A 76 -4.943 -5.592 4.349 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.579 -6.110 2.402 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.920 -4.726 3.420 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.115 -4.575 0.800 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.639 -2.150 0.938 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.546 -2.731 2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.800 -2.412 2.486 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.101 -3.650 -0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.166 -3.979 1.202 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.858 -5.327 0.268 1.00 0.00 H new ATOM 1161 N ILE A 77 -2.758 -6.398 2.884 1.00 0.00 N ATOM 1162 CA ILE A 77 -1.883 -7.326 2.181 1.00 0.00 C ATOM 1163 C ILE A 77 -1.983 -7.059 0.705 1.00 0.00 C ATOM 1164 O ILE A 77 -2.420 -7.913 -0.065 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.245 -8.797 2.465 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.545 -9.002 3.951 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.121 -9.715 2.010 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.455 -8.502 4.875 1.00 0.00 C ATOM 0 H ILE A 77 -2.310 -5.875 3.636 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.865 -7.168 2.536 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.144 -9.047 1.901 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.477 -8.493 4.196 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -2.704 -10.064 4.136 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.391 -10.751 2.217 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.959 -9.589 0.939 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.206 -9.464 2.547 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.744 -8.684 5.910 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.525 -9.029 4.660 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.310 -7.433 4.721 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.591 -5.839 0.331 1.00 0.00 N ATOM 1181 CA GLU A 78 -1.640 -5.397 -1.051 1.00 0.00 C ATOM 1182 C GLU A 78 -1.854 -6.570 -1.984 1.00 0.00 C ATOM 1183 O GLU A 78 -1.063 -7.513 -2.016 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.373 -4.631 -1.419 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.638 -3.166 -1.720 1.00 0.00 C ATOM 1186 CD GLU A 78 -0.335 -2.799 -3.159 1.00 0.00 C ATOM 1187 OE1 GLU A 78 0.674 -3.298 -3.700 1.00 0.00 O ATOM 1188 OE2 GLU A 78 -1.107 -2.013 -3.746 1.00 0.00 O ATOM 0 H GLU A 78 -1.233 -5.138 0.980 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.487 -4.720 -1.162 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.342 -4.705 -0.600 1.00 0.00 H new ATOM 0 HB3 GLU A 78 0.089 -5.098 -2.289 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.682 -2.938 -1.504 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.033 -2.548 -1.057 1.00 0.00 H new ATOM 1195 N GLU A 79 -2.953 -6.505 -2.711 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.351 -7.549 -3.646 1.00 0.00 C ATOM 1197 C GLU A 79 -2.154 -8.230 -4.323 1.00 0.00 C ATOM 1198 O GLU A 79 -2.257 -9.379 -4.755 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.309 -6.953 -4.674 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.373 -6.058 -4.041 1.00 0.00 C ATOM 1201 CD GLU A 79 -6.754 -6.292 -4.620 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.104 -5.618 -5.612 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.487 -7.149 -4.082 1.00 0.00 O ATOM 0 H GLU A 79 -3.603 -5.720 -2.671 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.856 -8.336 -3.085 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.740 -6.375 -5.402 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.797 -7.760 -5.220 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.399 -6.236 -2.966 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.096 -5.014 -4.184 1.00 0.00 H new ATOM 1210 N SER A 80 -1.017 -7.536 -4.400 1.00 0.00 N ATOM 1211 CA SER A 80 0.176 -8.111 -5.010 1.00 0.00 C ATOM 1212 C SER A 80 1.455 -7.739 -4.247 1.00 0.00 C ATOM 1213 O SER A 80 2.479 -7.453 -4.867 1.00 0.00 O ATOM 1214 CB SER A 80 0.290 -7.657 -6.466 1.00 0.00 C ATOM 1215 OG SER A 80 0.841 -8.680 -7.278 1.00 0.00 O ATOM 0 H SER A 80 -0.900 -6.585 -4.051 1.00 0.00 H new ATOM 0 HA SER A 80 0.072 -9.195 -4.967 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.695 -7.381 -6.842 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.915 -6.766 -6.524 1.00 0.00 H new ATOM 0 HG SER A 80 0.902 -8.365 -8.204 1.00 0.00 H new ATOM 1221 N THR A 81 1.416 -7.746 -2.905 1.00 0.00 N ATOM 1222 CA THR A 81 2.608 -7.409 -2.124 1.00 0.00 C ATOM 1223 C THR A 81 3.471 -8.637 -1.846 1.00 0.00 C ATOM 1224 O THR A 81 4.593 -8.512 -1.355 1.00 0.00 O ATOM 1225 CB THR A 81 2.214 -6.748 -0.807 1.00 0.00 C ATOM 1226 OG1 THR A 81 3.340 -6.606 0.041 1.00 0.00 O ATOM 1227 CG2 THR A 81 1.159 -7.518 -0.049 1.00 0.00 C ATOM 0 H THR A 81 0.590 -7.976 -2.352 1.00 0.00 H new ATOM 0 HA THR A 81 3.197 -6.711 -2.719 1.00 0.00 H new ATOM 0 HB THR A 81 1.805 -5.775 -1.081 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.103 -7.084 -0.346 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.923 -6.996 0.878 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.259 -7.599 -0.659 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.532 -8.516 0.182 1.00 0.00 H new ATOM 1235 N GLY A 82 2.955 -9.823 -2.163 1.00 0.00 N ATOM 1236 CA GLY A 82 3.710 -11.043 -1.939 1.00 0.00 C ATOM 1237 C GLY A 82 5.131 -10.955 -2.466 1.00 0.00 C ATOM 1238 O GLY A 82 6.032 -11.625 -1.959 1.00 0.00 O ATOM 0 H GLY A 82 2.030 -9.960 -2.570 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.735 -11.259 -0.871 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.199 -11.876 -2.421 1.00 0.00 H new ATOM 1242 N ASP A 83 5.333 -10.123 -3.485 1.00 0.00 N ATOM 1243 CA ASP A 83 6.653 -9.947 -4.079 1.00 0.00 C ATOM 1244 C ASP A 83 7.506 -8.994 -3.247 1.00 0.00 C ATOM 1245 O ASP A 83 7.674 -7.826 -3.597 1.00 0.00 O ATOM 1246 CB ASP A 83 6.531 -9.422 -5.512 1.00 0.00 C ATOM 1247 CG ASP A 83 5.590 -8.239 -5.621 1.00 0.00 C ATOM 1248 OD1 ASP A 83 6.013 -7.111 -5.290 1.00 0.00 O ATOM 1249 OD2 ASP A 83 4.430 -8.440 -6.039 1.00 0.00 O ATOM 0 H ASP A 83 4.599 -9.561 -3.915 1.00 0.00 H new ATOM 0 HA ASP A 83 7.143 -10.921 -4.098 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.517 -9.132 -5.874 1.00 0.00 H new ATOM 0 HB3 ASP A 83 6.177 -10.224 -6.160 1.00 0.00 H new ATOM 1254 N PHE A 84 8.041 -9.503 -2.143 1.00 0.00 N ATOM 1255 CA PHE A 84 8.879 -8.705 -1.257 1.00 0.00 C ATOM 1256 C PHE A 84 10.196 -8.347 -1.930 1.00 0.00 C ATOM 1257 O PHE A 84 10.521 -7.172 -2.099 1.00 0.00 O ATOM 1258 CB PHE A 84 9.155 -9.472 0.039 1.00 0.00 C ATOM 1259 CG PHE A 84 8.035 -9.417 1.048 1.00 0.00 C ATOM 1260 CD1 PHE A 84 6.948 -8.568 0.876 1.00 0.00 C ATOM 1261 CD2 PHE A 84 8.074 -10.221 2.176 1.00 0.00 C ATOM 1262 CE1 PHE A 84 5.930 -8.525 1.807 1.00 0.00 C ATOM 1263 CE2 PHE A 84 7.056 -10.180 3.109 1.00 0.00 C ATOM 1264 CZ PHE A 84 5.985 -9.331 2.925 1.00 0.00 C ATOM 0 H PHE A 84 7.908 -10.468 -1.840 1.00 0.00 H new ATOM 0 HA PHE A 84 8.345 -7.783 -1.026 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.355 -10.515 -0.206 1.00 0.00 H new ATOM 0 HB3 PHE A 84 10.060 -9.073 0.497 1.00 0.00 H new ATOM 0 HD1 PHE A 84 6.899 -7.934 0.003 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.910 -10.888 2.328 1.00 0.00 H new ATOM 0 HE1 PHE A 84 5.091 -7.861 1.660 1.00 0.00 H new ATOM 0 HE2 PHE A 84 7.099 -10.813 3.983 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.190 -9.297 3.655 1.00 0.00 H new ATOM 1274 N ASN A 85 10.947 -9.370 -2.313 1.00 0.00 N ATOM 1275 CA ASN A 85 12.232 -9.167 -2.974 1.00 0.00 C ATOM 1276 C ASN A 85 12.040 -8.431 -4.289 1.00 0.00 C ATOM 1277 O ASN A 85 12.942 -7.746 -4.771 1.00 0.00 O ATOM 1278 CB ASN A 85 12.927 -10.507 -3.239 1.00 0.00 C ATOM 1279 CG ASN A 85 12.620 -11.555 -2.188 1.00 0.00 C ATOM 1280 OD1 ASN A 85 11.457 -11.847 -1.906 1.00 0.00 O ATOM 1281 ND2 ASN A 85 13.660 -12.130 -1.604 1.00 0.00 N ATOM 0 H ASN A 85 10.691 -10.348 -2.178 1.00 0.00 H new ATOM 0 HA ASN A 85 12.858 -8.569 -2.312 1.00 0.00 H new ATOM 0 HB2 ASN A 85 12.621 -10.881 -4.216 1.00 0.00 H new ATOM 0 HB3 ASN A 85 14.005 -10.348 -3.281 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.514 -12.844 -0.891 1.00 0.00 H new ATOM 0 HD22 ASN A 85 14.607 -11.859 -1.867 1.00 0.00 H new ATOM 1288 N GLY A 86 10.860 -8.593 -4.873 1.00 0.00 N ATOM 1289 CA GLY A 86 10.568 -7.955 -6.140 1.00 0.00 C ATOM 1290 C GLY A 86 11.088 -8.762 -7.314 1.00 0.00 C ATOM 1291 O GLY A 86 10.816 -8.437 -8.469 1.00 0.00 O ATOM 0 H GLY A 86 10.100 -9.155 -4.491 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.491 -7.822 -6.240 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.014 -6.961 -6.157 1.00 0.00 H new ATOM 1295 N ASN A 87 11.839 -9.820 -7.013 1.00 0.00 N ATOM 1296 CA ASN A 87 12.399 -10.678 -8.051 1.00 0.00 C ATOM 1297 C ASN A 87 11.297 -11.407 -8.815 1.00 0.00 C ATOM 1298 O ASN A 87 11.483 -11.800 -9.967 1.00 0.00 O ATOM 1299 CB ASN A 87 13.365 -11.694 -7.436 1.00 0.00 C ATOM 1300 CG ASN A 87 12.781 -12.385 -6.219 1.00 0.00 C ATOM 1301 OD1 ASN A 87 11.572 -12.591 -6.130 1.00 0.00 O ATOM 1302 ND2 ASN A 87 13.642 -12.745 -5.275 1.00 0.00 N ATOM 0 H ASN A 87 12.072 -10.102 -6.061 1.00 0.00 H new ATOM 0 HA ASN A 87 12.943 -10.045 -8.752 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.626 -12.442 -8.185 1.00 0.00 H new ATOM 0 HB3 ASN A 87 14.289 -11.189 -7.155 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.309 -13.213 -4.432 1.00 0.00 H new ATOM 0 HD22 ASN A 87 14.637 -12.553 -5.392 1.00 0.00 H new ATOM 1309 N GLY A 88 10.147 -11.583 -8.170 1.00 0.00 N ATOM 1310 CA GLY A 88 9.035 -12.260 -8.810 1.00 0.00 C ATOM 1311 C GLY A 88 8.892 -13.703 -8.365 1.00 0.00 C ATOM 1312 O GLY A 88 8.644 -14.588 -9.184 1.00 0.00 O ATOM 0 H GLY A 88 9.966 -11.269 -7.217 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.113 -11.723 -8.589 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.170 -12.229 -9.891 1.00 0.00 H new ATOM 1316 N LYS A 89 9.045 -13.943 -7.067 1.00 0.00 N ATOM 1317 CA LYS A 89 8.927 -15.288 -6.518 1.00 0.00 C ATOM 1318 C LYS A 89 8.622 -15.238 -5.026 1.00 0.00 C ATOM 1319 O LYS A 89 9.434 -14.761 -4.233 1.00 0.00 O ATOM 1320 CB LYS A 89 10.211 -16.081 -6.766 1.00 0.00 C ATOM 1321 CG LYS A 89 11.476 -15.327 -6.386 1.00 0.00 C ATOM 1322 CD LYS A 89 12.669 -16.263 -6.275 1.00 0.00 C ATOM 1323 CE LYS A 89 13.895 -15.542 -5.740 1.00 0.00 C ATOM 1324 NZ LYS A 89 15.067 -16.454 -5.619 1.00 0.00 N ATOM 0 H LYS A 89 9.251 -13.222 -6.375 1.00 0.00 H new ATOM 0 HA LYS A 89 8.101 -15.789 -7.023 1.00 0.00 H new ATOM 0 HB2 LYS A 89 10.169 -17.011 -6.199 1.00 0.00 H new ATOM 0 HB3 LYS A 89 10.263 -16.352 -7.820 1.00 0.00 H new ATOM 0 HG2 LYS A 89 11.682 -14.560 -7.132 1.00 0.00 H new ATOM 0 HG3 LYS A 89 11.324 -14.815 -5.436 1.00 0.00 H new ATOM 0 HD2 LYS A 89 12.419 -17.096 -5.617 1.00 0.00 H new ATOM 0 HD3 LYS A 89 12.893 -16.686 -7.254 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.147 -14.713 -6.402 1.00 0.00 H new ATOM 0 HE3 LYS A 89 13.667 -15.113 -4.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 15.883 -15.924 -5.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 14.836 -17.231 -4.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 15.301 -16.844 -6.554 1.00 0.00 H new ATOM 1338 N ILE A 90 7.448 -15.731 -4.650 1.00 0.00 N ATOM 1339 CA ILE A 90 7.037 -15.739 -3.251 1.00 0.00 C ATOM 1340 C ILE A 90 7.227 -17.117 -2.633 1.00 0.00 C ATOM 1341 O ILE A 90 6.559 -18.077 -3.015 1.00 0.00 O ATOM 1342 CB ILE A 90 5.562 -15.315 -3.084 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.170 -14.271 -4.134 1.00 0.00 C ATOM 1344 CG2 ILE A 90 5.328 -14.777 -1.681 1.00 0.00 C ATOM 1345 CD1 ILE A 90 6.207 -13.185 -4.333 1.00 0.00 C ATOM 0 H ILE A 90 6.764 -16.130 -5.293 1.00 0.00 H new ATOM 0 HA ILE A 90 7.671 -15.017 -2.737 1.00 0.00 H new ATOM 0 HB ILE A 90 4.933 -16.192 -3.233 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.997 -14.774 -5.086 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.227 -13.810 -3.840 1.00 0.00 H new ATOM 0 HG21 ILE A 90 4.284 -14.481 -1.574 1.00 0.00 H new ATOM 0 HG22 ILE A 90 5.562 -15.552 -0.951 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.970 -13.912 -1.511 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.858 -12.484 -5.091 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.364 -12.655 -3.393 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.146 -13.634 -4.658 1.00 0.00 H new ATOM 1357 N ASP A 91 8.143 -17.208 -1.675 1.00 0.00 N ATOM 1358 CA ASP A 91 8.421 -18.473 -1.003 1.00 0.00 C ATOM 1359 C ASP A 91 9.576 -18.322 -0.022 1.00 0.00 C ATOM 1360 O ASP A 91 9.382 -18.362 1.193 1.00 0.00 O ATOM 1361 CB ASP A 91 8.746 -19.564 -2.028 1.00 0.00 C ATOM 1362 CG ASP A 91 7.580 -20.507 -2.258 1.00 0.00 C ATOM 1363 OD1 ASP A 91 7.104 -21.113 -1.276 1.00 0.00 O ATOM 1364 OD2 ASP A 91 7.144 -20.637 -3.421 1.00 0.00 O ATOM 0 H ASP A 91 8.705 -16.423 -1.346 1.00 0.00 H new ATOM 0 HA ASP A 91 7.529 -18.763 -0.448 1.00 0.00 H new ATOM 0 HB2 ASP A 91 9.026 -19.099 -2.973 1.00 0.00 H new ATOM 0 HB3 ASP A 91 9.609 -20.135 -1.686 1.00 0.00 H new ATOM 1369 N ILE A 92 10.778 -18.145 -0.557 1.00 0.00 N ATOM 1370 CA ILE A 92 11.963 -17.984 0.273 1.00 0.00 C ATOM 1371 C ILE A 92 12.099 -16.548 0.769 1.00 0.00 C ATOM 1372 O ILE A 92 12.902 -16.264 1.657 1.00 0.00 O ATOM 1373 CB ILE A 92 13.243 -18.379 -0.485 1.00 0.00 C ATOM 1374 CG1 ILE A 92 14.471 -18.197 0.421 1.00 0.00 C ATOM 1375 CG2 ILE A 92 13.373 -17.570 -1.770 1.00 0.00 C ATOM 1376 CD1 ILE A 92 15.176 -16.865 0.258 1.00 0.00 C ATOM 0 H ILE A 92 10.957 -18.110 -1.561 1.00 0.00 H new ATOM 0 HA ILE A 92 11.839 -18.649 1.127 1.00 0.00 H new ATOM 0 HB ILE A 92 13.182 -19.431 -0.762 1.00 0.00 H new ATOM 0 HG12 ILE A 92 14.160 -18.305 1.460 1.00 0.00 H new ATOM 0 HG13 ILE A 92 15.181 -18.998 0.216 1.00 0.00 H new ATOM 0 HG21 ILE A 92 14.283 -17.862 -2.293 1.00 0.00 H new ATOM 0 HG22 ILE A 92 12.510 -17.760 -2.409 1.00 0.00 H new ATOM 0 HG23 ILE A 92 13.418 -16.508 -1.528 1.00 0.00 H new ATOM 0 HD11 ILE A 92 16.030 -16.820 0.934 1.00 0.00 H new ATOM 0 HD12 ILE A 92 15.521 -16.759 -0.771 1.00 0.00 H new ATOM 0 HD13 ILE A 92 14.484 -16.056 0.493 1.00 0.00 H new ATOM 1388 N GLY A 93 11.308 -15.644 0.198 1.00 0.00 N ATOM 1389 CA GLY A 93 11.361 -14.257 0.608 1.00 0.00 C ATOM 1390 C GLY A 93 10.696 -14.019 1.953 1.00 0.00 C ATOM 1391 O GLY A 93 10.623 -12.885 2.423 1.00 0.00 O ATOM 0 H GLY A 93 10.634 -15.849 -0.539 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.402 -13.937 0.660 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.875 -13.640 -0.148 1.00 0.00 H new ATOM 1395 N ASP A 94 10.207 -15.090 2.575 1.00 0.00 N ATOM 1396 CA ASP A 94 9.547 -14.984 3.870 1.00 0.00 C ATOM 1397 C ASP A 94 10.511 -15.313 5.003 1.00 0.00 C ATOM 1398 O ASP A 94 10.608 -14.577 5.985 1.00 0.00 O ATOM 1399 CB ASP A 94 8.343 -15.924 3.930 1.00 0.00 C ATOM 1400 CG ASP A 94 7.599 -15.829 5.249 1.00 0.00 C ATOM 1401 OD1 ASP A 94 7.214 -14.705 5.635 1.00 0.00 O ATOM 1402 OD2 ASP A 94 7.401 -16.880 5.896 1.00 0.00 O ATOM 0 H ASP A 94 10.256 -16.038 2.202 1.00 0.00 H new ATOM 0 HA ASP A 94 9.208 -13.955 3.990 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.661 -15.688 3.113 1.00 0.00 H new ATOM 0 HB3 ASP A 94 8.679 -16.950 3.779 1.00 0.00 H new ATOM 1407 N LEU A 95 11.209 -16.433 4.864 1.00 0.00 N ATOM 1408 CA LEU A 95 12.158 -16.878 5.881 1.00 0.00 C ATOM 1409 C LEU A 95 13.572 -16.380 5.592 1.00 0.00 C ATOM 1410 O LEU A 95 14.551 -17.033 5.955 1.00 0.00 O ATOM 1411 CB LEU A 95 12.154 -18.406 5.973 1.00 0.00 C ATOM 1412 CG LEU A 95 12.276 -18.968 7.390 1.00 0.00 C ATOM 1413 CD1 LEU A 95 11.999 -20.464 7.395 1.00 0.00 C ATOM 1414 CD2 LEU A 95 13.655 -18.677 7.961 1.00 0.00 C ATOM 0 H LEU A 95 11.137 -17.052 4.056 1.00 0.00 H new ATOM 0 HA LEU A 95 11.842 -16.454 6.834 1.00 0.00 H new ATOM 0 HB2 LEU A 95 11.232 -18.779 5.528 1.00 0.00 H new ATOM 0 HB3 LEU A 95 12.977 -18.793 5.372 1.00 0.00 H new ATOM 0 HG LEU A 95 11.533 -18.479 8.021 1.00 0.00 H new ATOM 0 HD11 LEU A 95 12.090 -20.848 8.411 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.990 -20.648 7.027 1.00 0.00 H new ATOM 0 HD13 LEU A 95 12.718 -20.969 6.751 1.00 0.00 H new ATOM 0 HD21 LEU A 95 13.724 -19.084 8.970 1.00 0.00 H new ATOM 0 HD22 LEU A 95 14.415 -19.139 7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 95 13.816 -17.599 7.993 1.00 0.00 H new ATOM 1426 N ALA A 96 13.682 -15.227 4.938 1.00 0.00 N ATOM 1427 CA ALA A 96 14.991 -14.668 4.613 1.00 0.00 C ATOM 1428 C ALA A 96 14.909 -13.189 4.238 1.00 0.00 C ATOM 1429 O ALA A 96 15.841 -12.428 4.496 1.00 0.00 O ATOM 1430 CB ALA A 96 15.630 -15.461 3.483 1.00 0.00 C ATOM 0 H ALA A 96 12.889 -14.666 4.625 1.00 0.00 H new ATOM 0 HA ALA A 96 15.610 -14.742 5.507 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.606 -15.037 3.247 1.00 0.00 H new ATOM 0 HB2 ALA A 96 15.750 -16.500 3.790 1.00 0.00 H new ATOM 0 HB3 ALA A 96 14.992 -15.415 2.600 1.00 0.00 H new ATOM 1436 N MET A 97 13.807 -12.789 3.614 1.00 0.00 N ATOM 1437 CA MET A 97 13.632 -11.403 3.195 1.00 0.00 C ATOM 1438 C MET A 97 12.975 -10.555 4.282 1.00 0.00 C ATOM 1439 O MET A 97 13.613 -9.694 4.884 1.00 0.00 O ATOM 1440 CB MET A 97 12.787 -11.340 1.920 1.00 0.00 C ATOM 1441 CG MET A 97 13.423 -10.539 0.795 1.00 0.00 C ATOM 1442 SD MET A 97 14.030 -8.929 1.337 1.00 0.00 S ATOM 1443 CE MET A 97 13.923 -8.003 -0.191 1.00 0.00 C ATOM 0 H MET A 97 13.024 -13.402 3.388 1.00 0.00 H new ATOM 0 HA MET A 97 14.625 -10.996 3.004 1.00 0.00 H new ATOM 0 HB2 MET A 97 12.601 -12.355 1.569 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.818 -10.903 2.160 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.249 -11.110 0.372 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.692 -10.397 -0.001 1.00 0.00 H new ATOM 0 HE1 MET A 97 14.248 -6.977 -0.018 1.00 0.00 H new ATOM 0 HE2 MET A 97 14.564 -8.465 -0.942 1.00 0.00 H new ATOM 0 HE3 MET A 97 12.892 -8.002 -0.545 1.00 0.00 H new ATOM 1453 N VAL A 98 11.685 -10.782 4.497 1.00 0.00 N ATOM 1454 CA VAL A 98 10.920 -10.020 5.479 1.00 0.00 C ATOM 1455 C VAL A 98 11.458 -10.165 6.903 1.00 0.00 C ATOM 1456 O VAL A 98 11.807 -9.171 7.539 1.00 0.00 O ATOM 1457 CB VAL A 98 9.424 -10.408 5.441 1.00 0.00 C ATOM 1458 CG1 VAL A 98 9.242 -11.910 5.564 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.640 -9.684 6.525 1.00 0.00 C ATOM 0 H VAL A 98 11.144 -11.491 4.002 1.00 0.00 H new ATOM 0 HA VAL A 98 11.031 -8.973 5.197 1.00 0.00 H new ATOM 0 HB VAL A 98 9.031 -10.097 4.473 1.00 0.00 H new ATOM 0 HG11 VAL A 98 8.179 -12.151 5.534 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.750 -12.407 4.738 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.665 -12.252 6.509 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.591 -9.977 6.473 1.00 0.00 H new ATOM 0 HG22 VAL A 98 9.043 -9.948 7.503 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.723 -8.607 6.377 1.00 0.00 H new ATOM 1469 N SER A 99 11.505 -11.386 7.419 1.00 0.00 N ATOM 1470 CA SER A 99 11.969 -11.605 8.784 1.00 0.00 C ATOM 1471 C SER A 99 13.394 -11.101 9.021 1.00 0.00 C ATOM 1472 O SER A 99 13.879 -11.138 10.153 1.00 0.00 O ATOM 1473 CB SER A 99 11.873 -13.077 9.169 1.00 0.00 C ATOM 1474 OG SER A 99 11.039 -13.791 8.275 1.00 0.00 O ATOM 0 H SER A 99 11.231 -12.232 6.920 1.00 0.00 H new ATOM 0 HA SER A 99 11.306 -11.019 9.421 1.00 0.00 H new ATOM 0 HB2 SER A 99 12.869 -13.520 9.172 1.00 0.00 H new ATOM 0 HB3 SER A 99 11.482 -13.165 10.183 1.00 0.00 H new ATOM 0 HG SER A 99 11.546 -14.022 7.469 1.00 0.00 H new ATOM 1480 N LYS A 100 14.079 -10.648 7.972 1.00 0.00 N ATOM 1481 CA LYS A 100 15.450 -10.173 8.129 1.00 0.00 C ATOM 1482 C LYS A 100 15.513 -8.738 8.631 1.00 0.00 C ATOM 1483 O LYS A 100 16.315 -8.420 9.510 1.00 0.00 O ATOM 1484 CB LYS A 100 16.238 -10.333 6.821 1.00 0.00 C ATOM 1485 CG LYS A 100 16.120 -9.156 5.862 1.00 0.00 C ATOM 1486 CD LYS A 100 17.209 -8.124 6.109 1.00 0.00 C ATOM 1487 CE LYS A 100 17.033 -6.903 5.221 1.00 0.00 C ATOM 1488 NZ LYS A 100 18.298 -6.533 4.528 1.00 0.00 N ATOM 0 H LYS A 100 13.714 -10.600 7.021 1.00 0.00 H new ATOM 0 HA LYS A 100 15.917 -10.796 8.892 1.00 0.00 H new ATOM 0 HB2 LYS A 100 17.290 -10.484 7.062 1.00 0.00 H new ATOM 0 HB3 LYS A 100 15.895 -11.234 6.313 1.00 0.00 H new ATOM 0 HG2 LYS A 100 16.184 -9.515 4.835 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.142 -8.689 5.977 1.00 0.00 H new ATOM 0 HD2 LYS A 100 17.192 -7.819 7.155 1.00 0.00 H new ATOM 0 HD3 LYS A 100 18.185 -8.572 5.923 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.258 -7.101 4.481 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.690 -6.062 5.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.136 -5.696 3.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 19.031 -6.319 5.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 18.612 -7.326 3.933 1.00 0.00 H new ATOM 1502 N ASN A 101 14.669 -7.876 8.093 1.00 0.00 N ATOM 1503 CA ASN A 101 14.650 -6.487 8.524 1.00 0.00 C ATOM 1504 C ASN A 101 13.798 -6.371 9.773 1.00 0.00 C ATOM 1505 O ASN A 101 14.249 -5.881 10.808 1.00 0.00 O ATOM 1506 CB ASN A 101 14.107 -5.556 7.424 1.00 0.00 C ATOM 1507 CG ASN A 101 13.624 -6.299 6.191 1.00 0.00 C ATOM 1508 OD1 ASN A 101 12.675 -7.080 6.255 1.00 0.00 O ATOM 1509 ND2 ASN A 101 14.278 -6.059 5.061 1.00 0.00 N ATOM 0 H ASN A 101 13.994 -8.108 7.364 1.00 0.00 H new ATOM 0 HA ASN A 101 15.673 -6.176 8.736 1.00 0.00 H new ATOM 0 HB2 ASN A 101 13.285 -4.967 7.830 1.00 0.00 H new ATOM 0 HB3 ASN A 101 14.889 -4.854 7.133 1.00 0.00 H new ATOM 0 HD21 ASN A 101 13.999 -6.530 4.200 1.00 0.00 H new ATOM 0 HD22 ASN A 101 15.059 -5.403 5.053 1.00 0.00 H new ATOM 1516 N ILE A 102 12.559 -6.833 9.649 1.00 0.00 N ATOM 1517 CA ILE A 102 11.586 -6.809 10.729 1.00 0.00 C ATOM 1518 C ILE A 102 11.725 -5.560 11.575 1.00 0.00 C ATOM 1519 O ILE A 102 12.587 -5.457 12.448 1.00 0.00 O ATOM 1520 CB ILE A 102 11.667 -8.072 11.609 1.00 0.00 C ATOM 1521 CG1 ILE A 102 11.280 -9.302 10.783 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.770 -7.952 12.838 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.780 -9.485 10.581 1.00 0.00 C ATOM 0 H ILE A 102 12.200 -7.239 8.785 1.00 0.00 H new ATOM 0 HA ILE A 102 10.602 -6.795 10.261 1.00 0.00 H new ATOM 0 HB ILE A 102 12.693 -8.181 11.960 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.759 -9.233 9.806 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.679 -10.191 11.271 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.850 -8.859 13.437 1.00 0.00 H new ATOM 0 HG22 ILE A 102 11.082 -7.095 13.434 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.736 -7.817 12.522 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.600 -10.380 9.986 1.00 0.00 H new ATOM 0 HD12 ILE A 102 9.292 -9.590 11.550 1.00 0.00 H new ATOM 0 HD13 ILE A 102 9.374 -8.616 10.063 1.00 0.00 H new ATOM 1535 N GLY A 103 10.854 -4.615 11.290 1.00 0.00 N ATOM 1536 CA GLY A 103 10.858 -3.355 12.004 1.00 0.00 C ATOM 1537 C GLY A 103 12.045 -2.493 11.625 1.00 0.00 C ATOM 1538 O GLY A 103 12.541 -1.713 12.438 1.00 0.00 O ATOM 0 H GLY A 103 10.135 -4.695 10.570 1.00 0.00 H new ATOM 0 HA2 GLY A 103 9.935 -2.815 11.792 1.00 0.00 H new ATOM 0 HA3 GLY A 103 10.876 -3.546 13.077 1.00 0.00 H new ATOM 1542 N SER A 104 12.504 -2.638 10.384 1.00 0.00 N ATOM 1543 CA SER A 104 13.644 -1.873 9.894 1.00 0.00 C ATOM 1544 C SER A 104 13.247 -0.433 9.580 1.00 0.00 C ATOM 1545 O SER A 104 14.077 0.475 9.633 1.00 0.00 O ATOM 1546 CB SER A 104 14.229 -2.535 8.645 1.00 0.00 C ATOM 1547 OG SER A 104 15.198 -3.509 8.990 1.00 0.00 O ATOM 0 H SER A 104 12.102 -3.279 9.700 1.00 0.00 H new ATOM 0 HA SER A 104 14.399 -1.857 10.680 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.430 -3.001 8.069 1.00 0.00 H new ATOM 0 HB3 SER A 104 14.682 -1.777 8.006 1.00 0.00 H new ATOM 0 HG SER A 104 15.949 -3.461 8.362 1.00 0.00 H new ATOM 1553 N THR A 105 11.976 -0.231 9.248 1.00 0.00 N ATOM 1554 CA THR A 105 11.471 1.099 8.923 1.00 0.00 C ATOM 1555 C THR A 105 12.231 1.697 7.741 1.00 0.00 C ATOM 1556 O THR A 105 12.325 2.917 7.606 1.00 0.00 O ATOM 1557 CB THR A 105 11.577 2.027 10.136 1.00 0.00 C ATOM 1558 OG1 THR A 105 12.889 2.549 10.259 1.00 0.00 O ATOM 1559 CG2 THR A 105 11.226 1.350 11.445 1.00 0.00 C ATOM 0 H THR A 105 11.276 -0.971 9.197 1.00 0.00 H new ATOM 0 HA THR A 105 10.421 1.000 8.646 1.00 0.00 H new ATOM 0 HB THR A 105 10.853 2.821 9.952 1.00 0.00 H new ATOM 0 HG1 THR A 105 13.541 1.841 10.075 1.00 0.00 H new ATOM 0 HG21 THR A 105 11.322 2.065 12.262 1.00 0.00 H new ATOM 0 HG22 THR A 105 10.200 0.985 11.402 1.00 0.00 H new ATOM 0 HG23 THR A 105 11.903 0.512 11.614 1.00 0.00 H new ATOM 1567 N THR A 106 12.768 0.830 6.888 1.00 0.00 N ATOM 1568 CA THR A 106 13.516 1.273 5.717 1.00 0.00 C ATOM 1569 C THR A 106 12.721 1.013 4.442 1.00 0.00 C ATOM 1570 O THR A 106 12.170 1.937 3.843 1.00 0.00 O ATOM 1571 CB THR A 106 14.867 0.559 5.646 1.00 0.00 C ATOM 1572 OG1 THR A 106 14.705 -0.837 5.825 1.00 0.00 O ATOM 1573 CG2 THR A 106 15.855 1.044 6.684 1.00 0.00 C ATOM 0 H THR A 106 12.699 -0.183 6.986 1.00 0.00 H new ATOM 0 HA THR A 106 13.688 2.345 5.808 1.00 0.00 H new ATOM 0 HB THR A 106 15.264 0.787 4.657 1.00 0.00 H new ATOM 0 HG1 THR A 106 15.579 -1.277 5.775 1.00 0.00 H new ATOM 0 HG21 THR A 106 16.792 0.497 6.578 1.00 0.00 H new ATOM 0 HG22 THR A 106 16.039 2.109 6.542 1.00 0.00 H new ATOM 0 HG23 THR A 106 15.447 0.876 7.681 1.00 0.00 H new ATOM 1581 N ASN A 107 12.662 -0.251 4.036 1.00 0.00 N ATOM 1582 CA ASN A 107 11.927 -0.634 2.836 1.00 0.00 C ATOM 1583 C ASN A 107 10.497 -1.031 3.187 1.00 0.00 C ATOM 1584 O ASN A 107 10.268 -1.834 4.092 1.00 0.00 O ATOM 1585 CB ASN A 107 12.637 -1.786 2.124 1.00 0.00 C ATOM 1586 CG ASN A 107 12.684 -3.042 2.968 1.00 0.00 C ATOM 1587 OD1 ASN A 107 12.817 -2.980 4.190 1.00 0.00 O ATOM 1588 ND2 ASN A 107 12.578 -4.192 2.318 1.00 0.00 N ATOM 0 H ASN A 107 13.114 -1.027 4.520 1.00 0.00 H new ATOM 0 HA ASN A 107 11.892 0.224 2.165 1.00 0.00 H new ATOM 0 HB2 ASN A 107 12.125 -2.001 1.186 1.00 0.00 H new ATOM 0 HB3 ASN A 107 13.653 -1.483 1.871 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.605 -5.073 2.832 1.00 0.00 H new ATOM 0 HD22 ASN A 107 12.469 -4.196 1.304 1.00 0.00 H new ATOM 1595 N THR A 108 9.539 -0.452 2.474 1.00 0.00 N ATOM 1596 CA THR A 108 8.127 -0.729 2.716 1.00 0.00 C ATOM 1597 C THR A 108 7.615 -1.876 1.849 1.00 0.00 C ATOM 1598 O THR A 108 6.729 -2.625 2.257 1.00 0.00 O ATOM 1599 CB THR A 108 7.297 0.518 2.433 1.00 0.00 C ATOM 1600 OG1 THR A 108 6.006 0.395 3.000 1.00 0.00 O ATOM 1601 CG2 THR A 108 7.125 0.781 0.953 1.00 0.00 C ATOM 0 H THR A 108 9.714 0.214 1.722 1.00 0.00 H new ATOM 0 HA THR A 108 8.027 -1.020 3.762 1.00 0.00 H new ATOM 0 HB THR A 108 7.844 1.349 2.878 1.00 0.00 H new ATOM 0 HG1 THR A 108 5.864 1.115 3.649 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.526 1.681 0.810 1.00 0.00 H new ATOM 0 HG22 THR A 108 8.103 0.919 0.492 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.622 -0.067 0.489 1.00 0.00 H new ATOM 1609 N SER A 109 8.162 -1.993 0.643 1.00 0.00 N ATOM 1610 CA SER A 109 7.748 -3.034 -0.295 1.00 0.00 C ATOM 1611 C SER A 109 7.665 -4.404 0.376 1.00 0.00 C ATOM 1612 O SER A 109 6.971 -5.299 -0.105 1.00 0.00 O ATOM 1613 CB SER A 109 8.719 -3.096 -1.475 1.00 0.00 C ATOM 1614 OG SER A 109 8.749 -1.865 -2.177 1.00 0.00 O ATOM 0 H SER A 109 8.895 -1.378 0.290 1.00 0.00 H new ATOM 0 HA SER A 109 6.751 -2.775 -0.652 1.00 0.00 H new ATOM 0 HB2 SER A 109 9.719 -3.337 -1.115 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.423 -3.897 -2.152 1.00 0.00 H new ATOM 0 HG SER A 109 9.378 -1.930 -2.925 1.00 0.00 H new ATOM 1620 N LEU A 110 8.390 -4.567 1.476 1.00 0.00 N ATOM 1621 CA LEU A 110 8.410 -5.831 2.195 1.00 0.00 C ATOM 1622 C LEU A 110 7.311 -5.923 3.249 1.00 0.00 C ATOM 1623 O LEU A 110 7.201 -6.934 3.940 1.00 0.00 O ATOM 1624 CB LEU A 110 9.765 -6.017 2.864 1.00 0.00 C ATOM 1625 CG LEU A 110 10.609 -7.137 2.286 1.00 0.00 C ATOM 1626 CD1 LEU A 110 11.251 -6.686 0.981 1.00 0.00 C ATOM 1627 CD2 LEU A 110 11.650 -7.576 3.304 1.00 0.00 C ATOM 0 H LEU A 110 8.972 -3.838 1.888 1.00 0.00 H new ATOM 0 HA LEU A 110 8.231 -6.620 1.464 1.00 0.00 H new ATOM 0 HB2 LEU A 110 10.323 -5.084 2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.608 -6.210 3.925 1.00 0.00 H new ATOM 0 HG LEU A 110 9.976 -7.996 2.063 1.00 0.00 H new ATOM 0 HD11 LEU A 110 11.855 -7.497 0.573 1.00 0.00 H new ATOM 0 HD12 LEU A 110 10.473 -6.418 0.266 1.00 0.00 H new ATOM 0 HD13 LEU A 110 11.885 -5.820 1.168 1.00 0.00 H new ATOM 0 HD21 LEU A 110 12.253 -8.381 2.884 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.293 -6.732 3.553 1.00 0.00 H new ATOM 0 HD23 LEU A 110 11.150 -7.930 4.206 1.00 0.00 H new ATOM 1639 N ASP A 111 6.503 -4.879 3.378 1.00 0.00 N ATOM 1640 CA ASP A 111 5.443 -4.866 4.345 1.00 0.00 C ATOM 1641 C ASP A 111 4.106 -4.931 3.639 1.00 0.00 C ATOM 1642 O ASP A 111 3.675 -3.960 3.018 1.00 0.00 O ATOM 1643 CB ASP A 111 5.522 -3.596 5.197 1.00 0.00 C ATOM 1644 CG ASP A 111 6.935 -3.268 5.639 1.00 0.00 C ATOM 1645 OD1 ASP A 111 7.776 -2.975 4.764 1.00 0.00 O ATOM 1646 OD2 ASP A 111 7.199 -3.301 6.859 1.00 0.00 O ATOM 0 H ASP A 111 6.572 -4.031 2.816 1.00 0.00 H new ATOM 0 HA ASP A 111 5.547 -5.733 4.997 1.00 0.00 H new ATOM 0 HB2 ASP A 111 5.121 -2.757 4.628 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.890 -3.715 6.077 1.00 0.00 H new ATOM 1651 N LEU A 112 3.435 -6.065 3.759 1.00 0.00 N ATOM 1652 CA LEU A 112 2.124 -6.227 3.150 1.00 0.00 C ATOM 1653 C LEU A 112 1.180 -5.134 3.660 1.00 0.00 C ATOM 1654 O LEU A 112 0.073 -4.957 3.153 1.00 0.00 O ATOM 1655 CB LEU A 112 1.557 -7.611 3.481 1.00 0.00 C ATOM 1656 CG LEU A 112 2.552 -8.770 3.382 1.00 0.00 C ATOM 1657 CD1 LEU A 112 2.079 -9.960 4.212 1.00 0.00 C ATOM 1658 CD2 LEU A 112 2.758 -9.169 1.931 1.00 0.00 C ATOM 0 H LEU A 112 3.773 -6.882 4.268 1.00 0.00 H new ATOM 0 HA LEU A 112 2.219 -6.139 2.068 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.153 -7.587 4.493 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.722 -7.813 2.810 1.00 0.00 H new ATOM 0 HG LEU A 112 3.509 -8.439 3.785 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.801 -10.772 4.127 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.989 -9.662 5.257 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.109 -10.297 3.846 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.468 -9.994 1.878 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.806 -9.481 1.501 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.148 -8.318 1.372 1.00 0.00 H new ATOM 1670 N ASN A 113 1.647 -4.415 4.679 1.00 0.00 N ATOM 1671 CA ASN A 113 0.901 -3.343 5.306 1.00 0.00 C ATOM 1672 C ASN A 113 1.560 -1.988 5.063 1.00 0.00 C ATOM 1673 O ASN A 113 0.933 -0.946 5.238 1.00 0.00 O ATOM 1674 CB ASN A 113 0.872 -3.599 6.801 1.00 0.00 C ATOM 1675 CG ASN A 113 -0.398 -4.288 7.253 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -0.798 -5.311 6.694 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -1.043 -3.730 8.271 1.00 0.00 N ATOM 0 H ASN A 113 2.567 -4.568 5.092 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.102 -3.320 4.880 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.730 -4.212 7.077 1.00 0.00 H new ATOM 0 HB3 ASN A 113 0.974 -2.651 7.329 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -1.905 -4.149 8.619 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.676 -2.883 8.704 1.00 0.00 H new ATOM 1684 N LYS A 114 2.841 -2.015 4.702 1.00 0.00 N ATOM 1685 CA LYS A 114 3.610 -0.795 4.476 1.00 0.00 C ATOM 1686 C LYS A 114 3.413 0.177 5.631 1.00 0.00 C ATOM 1687 O LYS A 114 3.117 1.355 5.427 1.00 0.00 O ATOM 1688 CB LYS A 114 3.228 -0.136 3.150 1.00 0.00 C ATOM 1689 CG LYS A 114 1.768 0.268 3.054 1.00 0.00 C ATOM 1690 CD LYS A 114 1.486 1.030 1.772 1.00 0.00 C ATOM 1691 CE LYS A 114 2.299 2.312 1.694 1.00 0.00 C ATOM 1692 NZ LYS A 114 3.526 2.143 0.867 1.00 0.00 N ATOM 0 H LYS A 114 3.371 -2.875 4.559 1.00 0.00 H new ATOM 0 HA LYS A 114 4.664 -1.067 4.422 1.00 0.00 H new ATOM 0 HB2 LYS A 114 3.848 0.748 3.005 1.00 0.00 H new ATOM 0 HB3 LYS A 114 3.457 -0.824 2.336 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.140 -0.622 3.096 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.503 0.886 3.912 1.00 0.00 H new ATOM 0 HD2 LYS A 114 1.718 0.399 0.914 1.00 0.00 H new ATOM 0 HD3 LYS A 114 0.424 1.268 1.715 1.00 0.00 H new ATOM 0 HE2 LYS A 114 1.684 3.107 1.272 1.00 0.00 H new ATOM 0 HE3 LYS A 114 2.579 2.626 2.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 4.305 2.689 1.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 3.787 1.137 0.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.344 2.485 -0.098 1.00 0.00 H new ATOM 1706 N ASP A 115 3.581 -0.329 6.851 1.00 0.00 N ATOM 1707 CA ASP A 115 3.422 0.492 8.043 1.00 0.00 C ATOM 1708 C ASP A 115 4.752 1.133 8.449 1.00 0.00 C ATOM 1709 O ASP A 115 4.784 2.021 9.301 1.00 0.00 O ATOM 1710 CB ASP A 115 2.859 -0.349 9.193 1.00 0.00 C ATOM 1711 CG ASP A 115 2.690 0.453 10.471 1.00 0.00 C ATOM 1712 OD1 ASP A 115 3.670 0.557 11.238 1.00 0.00 O ATOM 1713 OD2 ASP A 115 1.580 0.976 10.702 1.00 0.00 O ATOM 0 H ASP A 115 3.827 -1.301 7.037 1.00 0.00 H new ATOM 0 HA ASP A 115 2.718 1.293 7.816 1.00 0.00 H new ATOM 0 HB2 ASP A 115 1.895 -0.763 8.898 1.00 0.00 H new ATOM 0 HB3 ASP A 115 3.524 -1.192 9.382 1.00 0.00 H new ATOM 1718 N GLY A 116 5.846 0.677 7.839 1.00 0.00 N ATOM 1719 CA GLY A 116 7.152 1.222 8.160 1.00 0.00 C ATOM 1720 C GLY A 116 7.884 0.363 9.167 1.00 0.00 C ATOM 1721 O GLY A 116 8.649 0.863 9.991 1.00 0.00 O ATOM 0 H GLY A 116 5.849 -0.057 7.131 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.746 1.303 7.250 1.00 0.00 H new ATOM 0 HA3 GLY A 116 7.038 2.231 8.557 1.00 0.00 H new ATOM 1725 N SER A 117 7.628 -0.937 9.103 1.00 0.00 N ATOM 1726 CA SER A 117 8.242 -1.895 10.016 1.00 0.00 C ATOM 1727 C SER A 117 7.865 -3.299 9.631 1.00 0.00 C ATOM 1728 O SER A 117 6.708 -3.701 9.749 1.00 0.00 O ATOM 1729 CB SER A 117 7.793 -1.633 11.458 1.00 0.00 C ATOM 1730 OG SER A 117 6.972 -0.480 11.541 1.00 0.00 O ATOM 0 H SER A 117 6.994 -1.356 8.423 1.00 0.00 H new ATOM 0 HA SER A 117 9.323 -1.776 9.950 1.00 0.00 H new ATOM 0 HB2 SER A 117 7.247 -2.498 11.834 1.00 0.00 H new ATOM 0 HB3 SER A 117 8.668 -1.506 12.096 1.00 0.00 H new ATOM 0 HG SER A 117 6.700 -0.338 12.472 1.00 0.00 H new ATOM 1736 N ILE A 118 8.852 -4.050 9.198 1.00 0.00 N ATOM 1737 CA ILE A 118 8.626 -5.417 8.828 1.00 0.00 C ATOM 1738 C ILE A 118 8.240 -6.208 10.060 1.00 0.00 C ATOM 1739 O ILE A 118 9.053 -6.493 10.931 1.00 0.00 O ATOM 1740 CB ILE A 118 9.860 -6.012 8.123 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.946 -5.456 6.706 1.00 0.00 C ATOM 1742 CG2 ILE A 118 9.800 -7.527 8.089 1.00 0.00 C ATOM 1743 CD1 ILE A 118 8.665 -5.638 5.924 1.00 0.00 C ATOM 0 H ILE A 118 9.816 -3.732 9.096 1.00 0.00 H new ATOM 0 HA ILE A 118 7.806 -5.469 8.112 1.00 0.00 H new ATOM 0 HB ILE A 118 10.751 -5.730 8.684 1.00 0.00 H new ATOM 0 HG12 ILE A 118 10.190 -4.395 6.752 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.762 -5.948 6.177 1.00 0.00 H new ATOM 0 HG21 ILE A 118 10.685 -7.915 7.585 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.764 -7.913 9.108 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.907 -7.844 7.550 1.00 0.00 H new ATOM 0 HD11 ILE A 118 8.787 -5.223 4.924 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.432 -6.700 5.850 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.851 -5.122 6.434 1.00 0.00 H new ATOM 1755 N ASP A 119 6.969 -6.514 10.145 1.00 0.00 N ATOM 1756 CA ASP A 119 6.444 -7.238 11.294 1.00 0.00 C ATOM 1757 C ASP A 119 5.517 -8.370 10.859 1.00 0.00 C ATOM 1758 O ASP A 119 5.720 -8.976 9.810 1.00 0.00 O ATOM 1759 CB ASP A 119 5.727 -6.266 12.235 1.00 0.00 C ATOM 1760 CG ASP A 119 5.901 -6.638 13.695 1.00 0.00 C ATOM 1761 OD1 ASP A 119 7.006 -7.090 14.065 1.00 0.00 O ATOM 1762 OD2 ASP A 119 4.934 -6.478 14.468 1.00 0.00 O ATOM 0 H ASP A 119 6.274 -6.277 9.438 1.00 0.00 H new ATOM 0 HA ASP A 119 7.277 -7.693 11.830 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.109 -5.258 12.072 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.665 -6.247 11.992 1.00 0.00 H new ATOM 1767 N GLU A 120 4.507 -8.660 11.670 1.00 0.00 N ATOM 1768 CA GLU A 120 3.564 -9.725 11.353 1.00 0.00 C ATOM 1769 C GLU A 120 2.764 -9.378 10.103 1.00 0.00 C ATOM 1770 O GLU A 120 2.529 -10.226 9.243 1.00 0.00 O ATOM 1771 CB GLU A 120 2.621 -9.970 12.532 1.00 0.00 C ATOM 1772 CG GLU A 120 3.288 -10.671 13.705 1.00 0.00 C ATOM 1773 CD GLU A 120 3.484 -9.755 14.897 1.00 0.00 C ATOM 1774 OE1 GLU A 120 2.558 -9.657 15.729 1.00 0.00 O ATOM 1775 OE2 GLU A 120 4.564 -9.135 14.998 1.00 0.00 O ATOM 0 H GLU A 120 4.320 -8.175 12.548 1.00 0.00 H new ATOM 0 HA GLU A 120 4.129 -10.637 11.161 1.00 0.00 H new ATOM 0 HB2 GLU A 120 2.219 -9.015 12.870 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.776 -10.569 12.193 1.00 0.00 H new ATOM 0 HG2 GLU A 120 2.682 -11.526 14.004 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.255 -11.061 13.388 1.00 0.00 H new ATOM 1782 N TYR A 121 2.350 -8.118 10.014 1.00 0.00 N ATOM 1783 CA TYR A 121 1.574 -7.633 8.877 1.00 0.00 C ATOM 1784 C TYR A 121 2.179 -8.085 7.546 1.00 0.00 C ATOM 1785 O TYR A 121 1.466 -8.219 6.555 1.00 0.00 O ATOM 1786 CB TYR A 121 1.465 -6.097 8.892 1.00 0.00 C ATOM 1787 CG TYR A 121 2.094 -5.411 10.089 1.00 0.00 C ATOM 1788 CD1 TYR A 121 1.482 -5.440 11.337 1.00 0.00 C ATOM 1789 CD2 TYR A 121 3.299 -4.731 9.968 1.00 0.00 C ATOM 1790 CE1 TYR A 121 2.053 -4.811 12.428 1.00 0.00 C ATOM 1791 CE2 TYR A 121 3.877 -4.100 11.054 1.00 0.00 C ATOM 1792 CZ TYR A 121 3.250 -4.144 12.280 1.00 0.00 C ATOM 1793 OH TYR A 121 3.822 -3.518 13.364 1.00 0.00 O ATOM 0 H TYR A 121 2.541 -7.409 10.722 1.00 0.00 H new ATOM 0 HA TYR A 121 0.577 -8.064 8.971 1.00 0.00 H new ATOM 0 HB2 TYR A 121 1.930 -5.708 7.986 1.00 0.00 H new ATOM 0 HB3 TYR A 121 0.410 -5.824 8.851 1.00 0.00 H new ATOM 0 HD1 TYR A 121 0.545 -5.963 11.456 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.793 -4.694 9.008 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.564 -4.842 13.390 1.00 0.00 H new ATOM 0 HE2 TYR A 121 4.815 -3.576 10.942 1.00 0.00 H new ATOM 0 HH TYR A 121 4.663 -3.095 13.091 1.00 0.00 H new ATOM 1803 N GLU A 122 3.494 -8.306 7.522 1.00 0.00 N ATOM 1804 CA GLU A 122 4.169 -8.728 6.289 1.00 0.00 C ATOM 1805 C GLU A 122 4.270 -10.248 6.177 1.00 0.00 C ATOM 1806 O GLU A 122 4.523 -10.783 5.099 1.00 0.00 O ATOM 1807 CB GLU A 122 5.568 -8.117 6.163 1.00 0.00 C ATOM 1808 CG GLU A 122 5.964 -7.197 7.300 1.00 0.00 C ATOM 1809 CD GLU A 122 5.160 -5.912 7.321 1.00 0.00 C ATOM 1810 OE1 GLU A 122 4.039 -5.903 6.770 1.00 0.00 O ATOM 1811 OE2 GLU A 122 5.653 -4.914 7.885 1.00 0.00 O ATOM 0 H GLU A 122 4.108 -8.202 8.330 1.00 0.00 H new ATOM 0 HA GLU A 122 3.549 -8.359 5.472 1.00 0.00 H new ATOM 0 HB2 GLU A 122 6.297 -8.924 6.097 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.623 -7.560 5.228 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.831 -7.719 8.247 1.00 0.00 H new ATOM 0 HG3 GLU A 122 7.024 -6.956 7.215 1.00 0.00 H new ATOM 1818 N ILE A 123 4.075 -10.935 7.286 1.00 0.00 N ATOM 1819 CA ILE A 123 4.146 -12.393 7.302 1.00 0.00 C ATOM 1820 C ILE A 123 2.765 -13.011 7.116 1.00 0.00 C ATOM 1821 O ILE A 123 2.633 -14.114 6.590 1.00 0.00 O ATOM 1822 CB ILE A 123 4.751 -12.923 8.618 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.861 -11.994 9.119 1.00 0.00 C ATOM 1824 CG2 ILE A 123 5.279 -14.338 8.427 1.00 0.00 C ATOM 1825 CD1 ILE A 123 7.105 -12.012 8.257 1.00 0.00 C ATOM 0 H ILE A 123 3.866 -10.512 8.190 1.00 0.00 H new ATOM 0 HA ILE A 123 4.793 -12.680 6.473 1.00 0.00 H new ATOM 0 HB ILE A 123 3.965 -12.947 9.372 1.00 0.00 H new ATOM 0 HG12 ILE A 123 5.477 -10.975 9.165 1.00 0.00 H new ATOM 0 HG13 ILE A 123 6.130 -12.280 10.136 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.703 -14.698 9.365 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.463 -14.993 8.123 1.00 0.00 H new ATOM 0 HG23 ILE A 123 6.050 -14.338 7.657 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.846 -11.330 8.674 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.515 -13.022 8.231 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.851 -11.697 7.245 1.00 0.00 H new ATOM 1837 N SER A 124 1.740 -12.292 7.561 1.00 0.00 N ATOM 1838 CA SER A 124 0.356 -12.758 7.467 1.00 0.00 C ATOM 1839 C SER A 124 0.058 -13.452 6.135 1.00 0.00 C ATOM 1840 O SER A 124 -0.782 -14.350 6.074 1.00 0.00 O ATOM 1841 CB SER A 124 -0.608 -11.586 7.662 1.00 0.00 C ATOM 1842 OG SER A 124 0.023 -10.516 8.345 1.00 0.00 O ATOM 0 H SER A 124 1.841 -11.375 7.995 1.00 0.00 H new ATOM 0 HA SER A 124 0.215 -13.494 8.258 1.00 0.00 H new ATOM 0 HB2 SER A 124 -0.968 -11.241 6.692 1.00 0.00 H new ATOM 0 HB3 SER A 124 -1.480 -11.918 8.226 1.00 0.00 H new ATOM 0 HG SER A 124 -0.573 -10.178 9.045 1.00 0.00 H new ATOM 1848 N PHE A 125 0.734 -13.029 5.071 1.00 0.00 N ATOM 1849 CA PHE A 125 0.512 -13.617 3.752 1.00 0.00 C ATOM 1850 C PHE A 125 1.483 -14.762 3.471 1.00 0.00 C ATOM 1851 O PHE A 125 1.099 -15.931 3.499 1.00 0.00 O ATOM 1852 CB PHE A 125 0.638 -12.548 2.667 1.00 0.00 C ATOM 1853 CG PHE A 125 0.303 -13.048 1.289 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -0.919 -13.650 1.035 1.00 0.00 C ATOM 1855 CD2 PHE A 125 1.210 -12.916 0.251 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -1.229 -14.111 -0.230 1.00 0.00 C ATOM 1857 CE2 PHE A 125 0.904 -13.374 -1.016 1.00 0.00 C ATOM 1858 CZ PHE A 125 -0.317 -13.973 -1.258 1.00 0.00 C ATOM 0 H PHE A 125 1.434 -12.288 5.094 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.498 -14.026 3.742 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -0.020 -11.714 2.912 1.00 0.00 H new ATOM 0 HB3 PHE A 125 1.657 -12.161 2.666 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.637 -13.760 1.834 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.167 -12.450 0.434 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -2.184 -14.579 -0.415 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.620 -13.264 -1.817 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.558 -14.332 -2.248 1.00 0.00 H new ATOM 1868 N ILE A 126 2.738 -14.415 3.184 1.00 0.00 N ATOM 1869 CA ILE A 126 3.770 -15.414 2.875 1.00 0.00 C ATOM 1870 C ILE A 126 3.658 -16.649 3.770 1.00 0.00 C ATOM 1871 O ILE A 126 3.579 -17.770 3.273 1.00 0.00 O ATOM 1872 CB ILE A 126 5.215 -14.848 2.978 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.237 -13.417 3.546 1.00 0.00 C ATOM 1874 CG2 ILE A 126 5.895 -14.894 1.615 1.00 0.00 C ATOM 1875 CD1 ILE A 126 5.030 -12.332 2.504 1.00 0.00 C ATOM 0 H ILE A 126 3.068 -13.450 3.158 1.00 0.00 H new ATOM 0 HA ILE A 126 3.586 -15.698 1.839 1.00 0.00 H new ATOM 0 HB ILE A 126 5.767 -15.479 3.675 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.461 -13.328 4.307 1.00 0.00 H new ATOM 0 HG13 ILE A 126 6.192 -13.250 4.044 1.00 0.00 H new ATOM 0 HG21 ILE A 126 6.906 -14.495 1.699 1.00 0.00 H new ATOM 0 HG22 ILE A 126 5.940 -15.925 1.265 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.326 -14.294 0.904 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.059 -11.355 2.986 1.00 0.00 H new ATOM 0 HD12 ILE A 126 5.820 -12.391 1.755 1.00 0.00 H new ATOM 0 HD13 ILE A 126 4.062 -12.470 2.022 1.00 0.00 H new ATOM 1887 N ASN A 127 3.647 -16.444 5.086 1.00 0.00 N ATOM 1888 CA ASN A 127 3.543 -17.558 6.031 1.00 0.00 C ATOM 1889 C ASN A 127 2.538 -18.602 5.549 1.00 0.00 C ATOM 1890 O ASN A 127 2.701 -19.797 5.798 1.00 0.00 O ATOM 1891 CB ASN A 127 3.138 -17.052 7.419 1.00 0.00 C ATOM 1892 CG ASN A 127 4.200 -17.317 8.468 1.00 0.00 C ATOM 1893 OD1 ASN A 127 5.129 -18.092 8.246 1.00 0.00 O ATOM 1894 ND2 ASN A 127 4.064 -16.670 9.620 1.00 0.00 N ATOM 0 H ASN A 127 3.708 -15.524 5.522 1.00 0.00 H new ATOM 0 HA ASN A 127 4.525 -18.028 6.094 1.00 0.00 H new ATOM 0 HB2 ASN A 127 2.942 -15.981 7.368 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.207 -17.533 7.720 1.00 0.00 H new ATOM 0 HD21 ASN A 127 4.747 -16.807 10.365 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.277 -16.037 9.759 1.00 0.00 H new ATOM 1901 N HIS A 128 1.498 -18.143 4.859 1.00 0.00 N ATOM 1902 CA HIS A 128 0.470 -19.038 4.346 1.00 0.00 C ATOM 1903 C HIS A 128 0.765 -19.465 2.911 1.00 0.00 C ATOM 1904 O HIS A 128 0.711 -20.651 2.586 1.00 0.00 O ATOM 1905 CB HIS A 128 -0.906 -18.375 4.428 1.00 0.00 C ATOM 1906 CG HIS A 128 -1.892 -19.140 5.256 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -1.525 -19.934 6.322 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -3.241 -19.229 5.170 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -2.603 -20.480 6.855 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -3.657 -20.068 6.175 1.00 0.00 N ATOM 0 H HIS A 128 1.346 -17.158 4.643 1.00 0.00 H new ATOM 0 HA HIS A 128 0.470 -19.933 4.969 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -0.793 -17.374 4.845 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -1.304 -18.258 3.420 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -3.871 -18.733 4.447 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -2.620 -21.149 7.702 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -4.624 -20.330 6.365 1.00 0.00 H new ATOM 1919 N ARG A 129 1.075 -18.495 2.055 1.00 0.00 N ATOM 1920 CA ARG A 129 1.377 -18.777 0.653 1.00 0.00 C ATOM 1921 C ARG A 129 2.347 -19.951 0.527 1.00 0.00 C ATOM 1922 O ARG A 129 2.330 -20.682 -0.463 1.00 0.00 O ATOM 1923 CB ARG A 129 1.968 -17.538 -0.022 1.00 0.00 C ATOM 1924 CG ARG A 129 0.924 -16.636 -0.660 1.00 0.00 C ATOM 1925 CD ARG A 129 0.087 -17.389 -1.682 1.00 0.00 C ATOM 1926 NE ARG A 129 -1.170 -17.870 -1.113 1.00 0.00 N ATOM 1927 CZ ARG A 129 -2.093 -18.530 -1.809 1.00 0.00 C ATOM 1928 NH1 ARG A 129 -1.904 -18.791 -3.097 1.00 0.00 N ATOM 1929 NH2 ARG A 129 -3.209 -18.932 -1.215 1.00 0.00 N ATOM 0 H ARG A 129 1.124 -17.508 2.306 1.00 0.00 H new ATOM 0 HA ARG A 129 0.445 -19.045 0.155 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.529 -16.965 0.716 1.00 0.00 H new ATOM 0 HB3 ARG A 129 2.678 -17.855 -0.786 1.00 0.00 H new ATOM 0 HG2 ARG A 129 0.274 -16.226 0.113 1.00 0.00 H new ATOM 0 HG3 ARG A 129 1.417 -15.792 -1.143 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.125 -16.736 -2.529 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.658 -18.234 -2.066 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.351 -17.690 -0.125 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.048 -18.485 -3.559 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -2.615 -19.297 -3.625 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -3.359 -18.735 -0.226 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -3.917 -19.438 -1.748 1.00 0.00 H new ATOM 1943 N ILE A 130 3.187 -20.121 1.542 1.00 0.00 N ATOM 1944 CA ILE A 130 4.165 -21.200 1.558 1.00 0.00 C ATOM 1945 C ILE A 130 3.611 -22.427 2.278 1.00 0.00 C ATOM 1946 O ILE A 130 3.843 -23.562 1.862 1.00 0.00 O ATOM 1947 CB ILE A 130 5.473 -20.745 2.239 1.00 0.00 C ATOM 1948 CG1 ILE A 130 6.158 -19.671 1.396 1.00 0.00 C ATOM 1949 CG2 ILE A 130 6.412 -21.924 2.464 1.00 0.00 C ATOM 1950 CD1 ILE A 130 5.588 -18.288 1.612 1.00 0.00 C ATOM 0 H ILE A 130 3.209 -19.522 2.367 1.00 0.00 H new ATOM 0 HA ILE A 130 4.379 -21.466 0.523 1.00 0.00 H new ATOM 0 HB ILE A 130 5.223 -20.324 3.213 1.00 0.00 H new ATOM 0 HG12 ILE A 130 7.222 -19.659 1.631 1.00 0.00 H new ATOM 0 HG13 ILE A 130 6.067 -19.933 0.342 1.00 0.00 H new ATOM 0 HG21 ILE A 130 7.326 -21.575 2.945 1.00 0.00 H new ATOM 0 HG22 ILE A 130 5.924 -22.661 3.102 1.00 0.00 H new ATOM 0 HG23 ILE A 130 6.659 -22.381 1.506 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.119 -17.573 0.983 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.530 -18.286 1.350 1.00 0.00 H new ATOM 0 HD13 ILE A 130 5.703 -18.006 2.659 1.00 0.00 H new