USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 952 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 133 GLN : amide:sc= 0.83 K(o=1.7,f=-0.034) USER MOD Set 1.2: A 137 THR OG1 : rot 140:sc= 0.913 USER MOD Set 2.1: A 131 ASN :FLIP amide:sc= 0.674 F(o=-2.9!,f=1.6) USER MOD Set 2.2: A 134 SER OG : rot -68:sc= 0.551 USER MOD Set 2.3: A 135 THR OG1 : rot 180:sc= 0.366 USER MOD Set 3.1: A 122 LYS NZ :NH3+ -111:sc= 1.24 (180deg=-1.32) USER MOD Set 3.2: A 139 ASN : amide:sc= 0.354 K(o=1.6,f=-7.7!) USER MOD Set 4.1: A 46 HIS : +bothHN:sc= -2.32 K(o=-7.2,f=-20!) USER MOD Set 4.2: A 48 HIS :FLIP no HD1:sc= -0.283 F(o=-7.8,f=-7.2) USER MOD Set 4.3: A 63 HIS : no HD1:sc= -2.89 K(o=-7.2,f=-10) USER MOD Set 4.4: A 65 ASN :FLIP amide:sc= 0.343 F(o=-11,f=-7.2) USER MOD Set 4.5: A 71 HIS : +bothHN:sc= -1.16! C(o=-7.2!,f=-15!) USER MOD Set 4.6: A 80 HIS : no HE2:sc= -1.06 K(o=-7.2,f=-11) USER MOD Set 4.7: A 120 HIS : no HE2:sc= 0.215 K(o=-7.2,f=-15!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -171:sc= 0.374 (180deg=0.335) USER MOD Single : A 15 GLN : amide:sc= -0.096 X(o=-0.096,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.0723 X(o=-0.072,f=0.067) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 37:sc= 0.0947 USER MOD Single : A 36 LYS NZ :NH3+ -163:sc= -0.655! (180deg=-1.28!) USER MOD Single : A 39 THR OG1 : rot 31:sc= 1.21 USER MOD Single : A 43 HIS : no HE2:sc= -2.19 K(o=-2.2,f=-6!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= -0.347 K(o=-0.35,f=-1.7) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 158:sc= 0.575 (180deg=0.323) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 32:sc= 1.27 USER MOD Single : A 110 HIS : no HE2:sc= 0.313 K(o=0.31,f=-2.5!) USER MOD Single : A 111 SER OG : rot -86:sc= 0.656 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 166:sc= -0.203 (180deg=-0.545) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 146 CYS SG : rot 180:sc= -0.297 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 27 N LYS A 3 13.088 5.842 11.336 1.00 0.00 N ATOM 28 CA LYS A 3 12.106 4.778 11.439 1.00 0.00 C ATOM 29 C LYS A 3 10.716 5.411 11.509 1.00 0.00 C ATOM 30 O LYS A 3 10.392 6.112 12.470 1.00 0.00 O ATOM 31 CB LYS A 3 12.390 3.894 12.655 1.00 0.00 C ATOM 32 CG LYS A 3 13.740 3.186 12.515 1.00 0.00 C ATOM 33 CD LYS A 3 13.791 1.984 13.471 1.00 0.00 C ATOM 34 CE LYS A 3 15.107 1.202 13.308 1.00 0.00 C ATOM 35 NZ LYS A 3 14.981 -0.191 13.776 1.00 0.00 N ATOM 0 HA LYS A 3 12.159 4.131 10.564 1.00 0.00 H new ATOM 0 HB2 LYS A 3 12.386 4.502 13.560 1.00 0.00 H new ATOM 0 HB3 LYS A 3 11.597 3.154 12.765 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.883 2.853 11.487 1.00 0.00 H new ATOM 0 HG3 LYS A 3 14.551 3.878 12.741 1.00 0.00 H new ATOM 0 HD2 LYS A 3 13.695 2.330 14.500 1.00 0.00 H new ATOM 0 HD3 LYS A 3 12.946 1.324 13.276 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.405 1.207 12.259 1.00 0.00 H new ATOM 0 HE3 LYS A 3 15.898 1.702 13.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.888 -0.683 13.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.722 -0.197 14.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 14.244 -0.677 13.226 1.00 0.00 H new ATOM 49 N ALA A 4 9.898 5.159 10.488 1.00 0.00 N ATOM 50 CA ALA A 4 8.493 5.519 10.449 1.00 0.00 C ATOM 51 C ALA A 4 7.680 4.228 10.479 1.00 0.00 C ATOM 52 O ALA A 4 8.201 3.169 10.127 1.00 0.00 O ATOM 53 CB ALA A 4 8.248 6.338 9.187 1.00 0.00 C ATOM 0 H ALA A 4 10.211 4.683 9.642 1.00 0.00 H new ATOM 0 HA ALA A 4 8.193 6.127 11.302 1.00 0.00 H new ATOM 0 HB1 ALA A 4 7.197 6.621 9.135 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.865 7.236 9.211 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.507 5.743 8.311 1.00 0.00 H new ATOM 59 N VAL A 5 6.426 4.309 10.917 1.00 0.00 N ATOM 60 CA VAL A 5 5.531 3.181 11.120 1.00 0.00 C ATOM 61 C VAL A 5 4.138 3.593 10.642 1.00 0.00 C ATOM 62 O VAL A 5 3.822 4.781 10.708 1.00 0.00 O ATOM 63 CB VAL A 5 5.553 2.776 12.612 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.983 3.874 13.519 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.825 1.460 12.911 1.00 0.00 C ATOM 0 H VAL A 5 5.991 5.202 11.149 1.00 0.00 H new ATOM 0 HA VAL A 5 5.845 2.308 10.548 1.00 0.00 H new ATOM 0 HB VAL A 5 6.611 2.629 12.832 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.019 3.544 14.557 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.575 4.783 13.406 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.949 4.077 13.239 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.885 1.245 13.978 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.779 1.548 12.617 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.293 0.650 12.351 1.00 0.00 H new ATOM 75 N ALA A 6 3.300 2.657 10.177 1.00 0.00 N ATOM 76 CA ALA A 6 1.881 2.926 9.995 1.00 0.00 C ATOM 77 C ALA A 6 1.094 1.776 10.590 1.00 0.00 C ATOM 78 O ALA A 6 1.197 0.650 10.107 1.00 0.00 O ATOM 79 CB ALA A 6 1.534 3.121 8.520 1.00 0.00 C ATOM 0 H ALA A 6 3.586 1.712 9.923 1.00 0.00 H new ATOM 0 HA ALA A 6 1.621 3.854 10.504 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.467 3.320 8.420 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.099 3.964 8.122 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.788 2.219 7.964 1.00 0.00 H new ATOM 85 N VAL A 7 0.327 2.050 11.645 1.00 0.00 N ATOM 86 CA VAL A 7 -0.582 1.086 12.207 1.00 0.00 C ATOM 87 C VAL A 7 -1.873 1.097 11.379 1.00 0.00 C ATOM 88 O VAL A 7 -2.701 1.999 11.476 1.00 0.00 O ATOM 89 CB VAL A 7 -0.749 1.297 13.721 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.599 1.582 14.400 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.755 2.380 14.138 1.00 0.00 C ATOM 0 H VAL A 7 0.328 2.950 12.125 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.185 0.073 12.140 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.166 0.349 14.062 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.444 1.726 15.469 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.272 0.739 14.241 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.039 2.483 13.972 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.792 2.443 15.226 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.445 3.342 13.729 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.743 2.125 13.756 1.00 0.00 H new ATOM 101 N LEU A 8 -2.012 0.105 10.508 1.00 0.00 N ATOM 102 CA LEU A 8 -3.254 -0.236 9.851 1.00 0.00 C ATOM 103 C LEU A 8 -4.241 -0.733 10.901 1.00 0.00 C ATOM 104 O LEU A 8 -3.848 -1.524 11.759 1.00 0.00 O ATOM 105 CB LEU A 8 -2.982 -1.302 8.770 1.00 0.00 C ATOM 106 CG LEU A 8 -2.872 -0.633 7.394 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.627 0.249 7.296 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.795 -1.721 6.327 1.00 0.00 C ATOM 0 H LEU A 8 -1.236 -0.499 10.236 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.686 0.635 9.358 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.061 -1.837 8.999 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.785 -2.039 8.763 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.748 -0.001 7.246 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.582 0.706 6.308 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.673 1.030 8.055 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.737 -0.359 7.455 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.716 -1.260 5.342 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.920 -2.345 6.506 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.694 -2.336 6.369 1.00 0.00 H new ATOM 120 N LYS A 9 -5.506 -0.303 10.819 1.00 0.00 N ATOM 121 CA LYS A 9 -6.610 -0.885 11.569 1.00 0.00 C ATOM 122 C LYS A 9 -7.898 -0.709 10.757 1.00 0.00 C ATOM 123 O LYS A 9 -7.988 0.233 9.970 1.00 0.00 O ATOM 124 CB LYS A 9 -6.693 -0.266 12.974 1.00 0.00 C ATOM 125 CG LYS A 9 -7.438 -1.186 13.955 1.00 0.00 C ATOM 126 CD LYS A 9 -8.807 -0.619 14.353 1.00 0.00 C ATOM 127 CE LYS A 9 -9.656 -1.728 14.998 1.00 0.00 C ATOM 128 NZ LYS A 9 -11.036 -1.285 15.268 1.00 0.00 N ATOM 0 H LYS A 9 -5.789 0.471 10.218 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.452 -1.953 11.722 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.687 -0.074 13.347 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.202 0.696 12.919 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.571 -2.168 13.500 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.831 -1.328 14.849 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.680 0.209 15.051 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.316 -0.221 13.475 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.677 -2.597 14.340 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.189 -2.045 15.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -11.526 -2.004 15.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -11.016 -0.385 15.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -11.540 -1.152 14.368 1.00 0.00 H new ATOM 142 N GLY A 10 -8.875 -1.611 10.892 1.00 0.00 N ATOM 143 CA GLY A 10 -10.136 -1.511 10.178 1.00 0.00 C ATOM 144 C GLY A 10 -11.331 -1.550 11.121 1.00 0.00 C ATOM 145 O GLY A 10 -11.215 -1.368 12.340 1.00 0.00 O ATOM 0 H GLY A 10 -8.807 -2.427 11.500 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.156 -0.583 9.606 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.213 -2.329 9.462 1.00 0.00 H new ATOM 149 N ASP A 11 -12.494 -1.809 10.524 1.00 0.00 N ATOM 150 CA ASP A 11 -13.727 -2.067 11.246 1.00 0.00 C ATOM 151 C ASP A 11 -13.532 -3.271 12.169 1.00 0.00 C ATOM 152 O ASP A 11 -13.824 -3.211 13.364 1.00 0.00 O ATOM 153 CB ASP A 11 -14.848 -2.326 10.234 1.00 0.00 C ATOM 154 CG ASP A 11 -16.139 -2.671 10.955 1.00 0.00 C ATOM 155 OD1 ASP A 11 -16.683 -1.752 11.601 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.542 -3.849 10.854 1.00 0.00 O ATOM 0 H ASP A 11 -12.601 -1.845 9.510 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.998 -1.207 11.858 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.996 -1.444 9.611 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.566 -3.142 9.569 1.00 0.00 H new ATOM 161 N GLY A 12 -12.974 -4.351 11.612 1.00 0.00 N ATOM 162 CA GLY A 12 -12.772 -5.590 12.322 1.00 0.00 C ATOM 163 C GLY A 12 -11.399 -5.565 12.982 1.00 0.00 C ATOM 164 O GLY A 12 -10.798 -4.502 13.151 1.00 0.00 O ATOM 0 H GLY A 12 -12.651 -4.376 10.645 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.549 -5.724 13.075 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.844 -6.434 11.635 1.00 0.00 H new ATOM 168 N PRO A 13 -10.866 -6.739 13.329 1.00 0.00 N ATOM 169 CA PRO A 13 -9.578 -6.856 13.977 1.00 0.00 C ATOM 170 C PRO A 13 -8.432 -6.776 12.966 1.00 0.00 C ATOM 171 O PRO A 13 -7.275 -6.823 13.375 1.00 0.00 O ATOM 172 CB PRO A 13 -9.628 -8.205 14.693 1.00 0.00 C ATOM 173 CG PRO A 13 -10.515 -9.050 13.774 1.00 0.00 C ATOM 174 CD PRO A 13 -11.485 -8.040 13.152 1.00 0.00 C ATOM 0 HA PRO A 13 -9.388 -6.040 14.674 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.635 -8.639 14.806 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -10.052 -8.116 15.693 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.926 -9.559 13.010 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -11.047 -9.820 14.332 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.650 -8.255 12.096 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.458 -8.080 13.641 1.00 0.00 H new ATOM 182 N VAL A 14 -8.738 -6.640 11.666 1.00 0.00 N ATOM 183 CA VAL A 14 -7.746 -6.388 10.634 1.00 0.00 C ATOM 184 C VAL A 14 -6.889 -5.215 11.072 1.00 0.00 C ATOM 185 O VAL A 14 -7.382 -4.089 11.168 1.00 0.00 O ATOM 186 CB VAL A 14 -8.398 -6.106 9.267 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.301 -6.155 8.192 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.516 -7.098 8.924 1.00 0.00 C ATOM 0 H VAL A 14 -9.691 -6.704 11.309 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.131 -7.279 10.507 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.864 -5.122 9.308 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.741 -5.958 7.214 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.545 -5.400 8.409 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.838 -7.142 8.189 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.937 -6.849 7.950 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.109 -8.109 8.896 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.297 -7.042 9.682 1.00 0.00 H new ATOM 198 N GLN A 15 -5.622 -5.505 11.354 1.00 0.00 N ATOM 199 CA GLN A 15 -4.669 -4.511 11.804 1.00 0.00 C ATOM 200 C GLN A 15 -3.319 -4.836 11.192 1.00 0.00 C ATOM 201 O GLN A 15 -3.107 -5.982 10.813 1.00 0.00 O ATOM 202 CB GLN A 15 -4.649 -4.482 13.341 1.00 0.00 C ATOM 203 CG GLN A 15 -3.976 -5.728 13.948 1.00 0.00 C ATOM 204 CD GLN A 15 -4.572 -6.147 15.291 1.00 0.00 C ATOM 205 OE1 GLN A 15 -4.681 -7.332 15.587 1.00 0.00 O ATOM 206 NE2 GLN A 15 -4.938 -5.188 16.137 1.00 0.00 N ATOM 0 H GLN A 15 -5.231 -6.444 11.274 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.947 -3.509 11.479 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.122 -3.589 13.677 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.671 -4.408 13.713 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -4.063 -6.557 13.246 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.912 -5.530 14.077 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -4.839 -4.208 15.871 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -5.318 -5.432 17.052 1.00 0.00 H new ATOM 215 N GLY A 16 -2.408 -3.876 11.060 1.00 0.00 N ATOM 216 CA GLY A 16 -1.067 -4.206 10.602 1.00 0.00 C ATOM 217 C GLY A 16 -0.054 -3.160 10.998 1.00 0.00 C ATOM 218 O GLY A 16 -0.328 -1.977 10.875 1.00 0.00 O ATOM 0 H GLY A 16 -2.569 -2.889 11.258 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.771 -5.170 11.015 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.072 -4.312 9.517 1.00 0.00 H new ATOM 222 N ILE A 17 1.125 -3.575 11.444 1.00 0.00 N ATOM 223 CA ILE A 17 2.220 -2.662 11.686 1.00 0.00 C ATOM 224 C ILE A 17 3.050 -2.628 10.405 1.00 0.00 C ATOM 225 O ILE A 17 3.678 -3.622 10.041 1.00 0.00 O ATOM 226 CB ILE A 17 2.995 -3.101 12.940 1.00 0.00 C ATOM 227 CG1 ILE A 17 2.073 -3.043 14.177 1.00 0.00 C ATOM 228 CG2 ILE A 17 4.188 -2.168 13.164 1.00 0.00 C ATOM 229 CD1 ILE A 17 1.687 -4.440 14.669 1.00 0.00 C ATOM 0 H ILE A 17 1.342 -4.551 11.646 1.00 0.00 H new ATOM 0 HA ILE A 17 1.890 -1.646 11.903 1.00 0.00 H new ATOM 0 HB ILE A 17 3.347 -4.122 12.795 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.575 -2.502 14.979 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.171 -2.483 13.931 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.734 -2.483 14.053 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.849 -2.209 12.299 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.831 -1.147 13.300 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.038 -4.352 15.540 1.00 0.00 H new ATOM 0 HD12 ILE A 17 1.161 -4.972 13.877 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.587 -4.992 14.941 1.00 0.00 H new ATOM 241 N ILE A 18 3.005 -1.499 9.696 1.00 0.00 N ATOM 242 CA ILE A 18 3.888 -1.204 8.576 1.00 0.00 C ATOM 243 C ILE A 18 5.036 -0.366 9.103 1.00 0.00 C ATOM 244 O ILE A 18 4.862 0.341 10.088 1.00 0.00 O ATOM 245 CB ILE A 18 3.123 -0.475 7.462 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.832 -1.220 7.103 1.00 0.00 C ATOM 247 CG2 ILE A 18 3.972 -0.245 6.201 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.079 -2.668 6.707 1.00 0.00 C ATOM 0 H ILE A 18 2.339 -0.752 9.891 1.00 0.00 H new ATOM 0 HA ILE A 18 4.275 -2.125 8.140 1.00 0.00 H new ATOM 0 HB ILE A 18 2.871 0.508 7.860 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.152 -1.192 7.955 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.336 -0.703 6.282 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.376 0.274 5.451 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.843 0.359 6.454 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.300 -1.205 5.803 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.130 -3.146 6.464 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.735 -2.700 5.837 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.549 -3.197 7.536 1.00 0.00 H new ATOM 260 N ASN A 19 6.185 -0.444 8.443 1.00 0.00 N ATOM 261 CA ASN A 19 7.405 0.280 8.708 1.00 0.00 C ATOM 262 C ASN A 19 7.834 0.922 7.403 1.00 0.00 C ATOM 263 O ASN A 19 7.689 0.320 6.337 1.00 0.00 O ATOM 264 CB ASN A 19 8.521 -0.658 9.164 1.00 0.00 C ATOM 265 CG ASN A 19 8.067 -1.628 10.252 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.851 -2.808 10.003 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.917 -1.144 11.481 1.00 0.00 N ATOM 0 H ASN A 19 6.287 -1.070 7.644 1.00 0.00 H new ATOM 0 HA ASN A 19 7.227 1.012 9.496 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.887 -1.224 8.308 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.358 -0.067 9.536 1.00 0.00 H new ATOM 0 HD21 ASN A 19 7.617 -1.758 12.238 1.00 0.00 H new ATOM 0 HD22 ASN A 19 8.102 -0.158 11.667 1.00 0.00 H new ATOM 274 N PHE A 20 8.391 2.122 7.512 1.00 0.00 N ATOM 275 CA PHE A 20 9.033 2.808 6.420 1.00 0.00 C ATOM 276 C PHE A 20 10.377 3.325 6.907 1.00 0.00 C ATOM 277 O PHE A 20 10.485 3.848 8.019 1.00 0.00 O ATOM 278 CB PHE A 20 8.154 3.955 5.940 1.00 0.00 C ATOM 279 CG PHE A 20 6.843 3.519 5.333 1.00 0.00 C ATOM 280 CD1 PHE A 20 5.710 3.317 6.142 1.00 0.00 C ATOM 281 CD2 PHE A 20 6.747 3.382 3.941 1.00 0.00 C ATOM 282 CE1 PHE A 20 4.485 2.973 5.548 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.507 3.111 3.343 1.00 0.00 C ATOM 284 CZ PHE A 20 4.380 2.888 4.149 1.00 0.00 C ATOM 0 H PHE A 20 8.404 2.649 8.385 1.00 0.00 H new ATOM 0 HA PHE A 20 9.186 2.129 5.581 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.949 4.617 6.781 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.707 4.537 5.203 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.782 3.426 7.214 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.630 3.485 3.327 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.623 2.774 6.167 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.420 3.074 2.267 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.430 2.651 3.693 1.00 0.00 H new ATOM 294 N GLU A 21 11.384 3.179 6.052 1.00 0.00 N ATOM 295 CA GLU A 21 12.717 3.737 6.212 1.00 0.00 C ATOM 296 C GLU A 21 13.052 4.466 4.912 1.00 0.00 C ATOM 297 O GLU A 21 12.779 3.958 3.826 1.00 0.00 O ATOM 298 CB GLU A 21 13.710 2.610 6.534 1.00 0.00 C ATOM 299 CG GLU A 21 15.084 3.105 7.029 1.00 0.00 C ATOM 300 CD GLU A 21 16.230 2.948 6.033 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.203 1.983 5.243 1.00 0.00 O ATOM 302 OE2 GLU A 21 17.162 3.778 6.132 1.00 0.00 O ATOM 0 H GLU A 21 11.286 2.643 5.190 1.00 0.00 H new ATOM 0 HA GLU A 21 12.773 4.443 7.041 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.274 1.962 7.294 1.00 0.00 H new ATOM 0 HB3 GLU A 21 13.855 2.002 5.641 1.00 0.00 H new ATOM 0 HG2 GLU A 21 14.998 4.158 7.296 1.00 0.00 H new ATOM 0 HG3 GLU A 21 15.340 2.565 7.941 1.00 0.00 H new ATOM 395 N PRO A 28 15.824 5.685 -2.616 1.00 0.00 N ATOM 396 CA PRO A 28 15.036 4.477 -2.511 1.00 0.00 C ATOM 397 C PRO A 28 14.490 4.319 -1.086 1.00 0.00 C ATOM 398 O PRO A 28 15.245 4.035 -0.157 1.00 0.00 O ATOM 399 CB PRO A 28 15.974 3.340 -2.929 1.00 0.00 C ATOM 400 CG PRO A 28 17.364 3.880 -2.589 1.00 0.00 C ATOM 401 CD PRO A 28 17.227 5.382 -2.848 1.00 0.00 C ATOM 0 HA PRO A 28 14.155 4.488 -3.153 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.757 2.420 -2.386 1.00 0.00 H new ATOM 0 HB3 PRO A 28 15.881 3.113 -3.991 1.00 0.00 H new ATOM 0 HG2 PRO A 28 17.635 3.673 -1.554 1.00 0.00 H new ATOM 0 HG3 PRO A 28 18.135 3.432 -3.216 1.00 0.00 H new ATOM 0 HD2 PRO A 28 17.869 5.956 -2.180 1.00 0.00 H new ATOM 0 HD3 PRO A 28 17.520 5.634 -3.867 1.00 0.00 H new ATOM 409 N VAL A 29 13.176 4.488 -0.916 1.00 0.00 N ATOM 410 CA VAL A 29 12.473 4.150 0.307 1.00 0.00 C ATOM 411 C VAL A 29 12.464 2.637 0.440 1.00 0.00 C ATOM 412 O VAL A 29 12.336 1.947 -0.566 1.00 0.00 O ATOM 413 CB VAL A 29 11.027 4.673 0.202 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.087 4.038 1.232 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.047 6.180 0.419 1.00 0.00 C ATOM 0 H VAL A 29 12.568 4.870 -1.641 1.00 0.00 H new ATOM 0 HA VAL A 29 12.957 4.597 1.175 1.00 0.00 H new ATOM 0 HB VAL A 29 10.649 4.409 -0.786 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.084 4.446 1.109 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.061 2.958 1.084 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.447 4.258 2.237 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.032 6.571 0.349 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.453 6.400 1.406 1.00 0.00 H new ATOM 0 HG23 VAL A 29 11.670 6.649 -0.342 1.00 0.00 H new ATOM 425 N LYS A 30 12.517 2.141 1.674 1.00 0.00 N ATOM 426 CA LYS A 30 12.189 0.775 2.032 1.00 0.00 C ATOM 427 C LYS A 30 10.873 0.812 2.806 1.00 0.00 C ATOM 428 O LYS A 30 10.776 1.521 3.808 1.00 0.00 O ATOM 429 CB LYS A 30 13.327 0.188 2.881 1.00 0.00 C ATOM 430 CG LYS A 30 14.249 -0.669 2.008 1.00 0.00 C ATOM 431 CD LYS A 30 13.618 -2.037 1.681 1.00 0.00 C ATOM 432 CE LYS A 30 14.253 -3.192 2.469 1.00 0.00 C ATOM 433 NZ LYS A 30 14.069 -3.045 3.925 1.00 0.00 N ATOM 0 H LYS A 30 12.800 2.704 2.476 1.00 0.00 H new ATOM 0 HA LYS A 30 12.075 0.142 1.152 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.897 0.993 3.344 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.914 -0.416 3.689 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.468 -0.139 1.081 1.00 0.00 H new ATOM 0 HG3 LYS A 30 15.199 -0.820 2.521 1.00 0.00 H new ATOM 0 HD2 LYS A 30 12.550 -2.000 1.897 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.720 -2.233 0.614 1.00 0.00 H new ATOM 0 HE2 LYS A 30 13.815 -4.135 2.143 1.00 0.00 H new ATOM 0 HE3 LYS A 30 15.318 -3.241 2.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 14.514 -3.848 4.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 14.510 -2.158 4.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.053 -3.025 4.146 1.00 0.00 H new ATOM 447 N VAL A 31 9.873 0.058 2.341 1.00 0.00 N ATOM 448 CA VAL A 31 8.577 -0.100 2.973 1.00 0.00 C ATOM 449 C VAL A 31 8.429 -1.588 3.269 1.00 0.00 C ATOM 450 O VAL A 31 8.802 -2.422 2.450 1.00 0.00 O ATOM 451 CB VAL A 31 7.480 0.439 2.035 1.00 0.00 C ATOM 452 CG1 VAL A 31 7.756 0.126 0.570 1.00 0.00 C ATOM 453 CG2 VAL A 31 6.099 -0.135 2.367 1.00 0.00 C ATOM 0 H VAL A 31 9.956 -0.478 1.477 1.00 0.00 H new ATOM 0 HA VAL A 31 8.485 0.465 3.901 1.00 0.00 H new ATOM 0 HB VAL A 31 7.490 1.517 2.193 1.00 0.00 H new ATOM 0 HG11 VAL A 31 6.952 0.529 -0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.702 0.579 0.273 1.00 0.00 H new ATOM 0 HG13 VAL A 31 7.812 -0.954 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.360 0.275 1.679 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.123 -1.220 2.270 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.830 0.132 3.389 1.00 0.00 H new ATOM 463 N TRP A 32 7.906 -1.950 4.433 1.00 0.00 N ATOM 464 CA TRP A 32 7.738 -3.345 4.805 1.00 0.00 C ATOM 465 C TRP A 32 6.755 -3.381 5.959 1.00 0.00 C ATOM 466 O TRP A 32 6.468 -2.333 6.521 1.00 0.00 O ATOM 467 CB TRP A 32 9.094 -3.996 5.149 1.00 0.00 C ATOM 468 CG TRP A 32 9.675 -3.708 6.494 1.00 0.00 C ATOM 469 CD1 TRP A 32 9.402 -4.401 7.621 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.650 -2.694 6.873 1.00 0.00 C ATOM 471 NE1 TRP A 32 10.144 -3.894 8.665 1.00 0.00 N ATOM 472 CE2 TRP A 32 10.935 -2.841 8.262 1.00 0.00 C ATOM 473 CE3 TRP A 32 11.306 -1.650 6.188 1.00 0.00 C ATOM 474 CZ2 TRP A 32 11.820 -1.991 8.942 1.00 0.00 C ATOM 475 CZ3 TRP A 32 12.209 -0.803 6.855 1.00 0.00 C ATOM 476 CH2 TRP A 32 12.461 -0.965 8.229 1.00 0.00 C ATOM 0 H TRP A 32 7.589 -1.288 5.141 1.00 0.00 H new ATOM 0 HA TRP A 32 7.343 -3.931 3.975 1.00 0.00 H new ATOM 0 HB2 TRP A 32 8.982 -5.076 5.055 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.818 -3.684 4.396 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.709 -5.226 7.693 1.00 0.00 H new ATOM 0 HE1 TRP A 32 10.112 -4.254 9.619 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.112 -1.499 5.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.005 -2.124 9.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.714 -0.021 6.307 1.00 0.00 H new ATOM 0 HH2 TRP A 32 13.146 -0.301 8.735 1.00 0.00 H new ATOM 487 N GLY A 33 6.196 -4.531 6.313 1.00 0.00 N ATOM 488 CA GLY A 33 5.206 -4.545 7.380 1.00 0.00 C ATOM 489 C GLY A 33 4.570 -5.903 7.530 1.00 0.00 C ATOM 490 O GLY A 33 5.019 -6.835 6.874 1.00 0.00 O ATOM 0 H GLY A 33 6.402 -5.437 5.893 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.679 -4.258 8.319 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.435 -3.803 7.172 1.00 0.00 H new ATOM 494 N SER A 34 3.512 -6.006 8.338 1.00 0.00 N ATOM 495 CA SER A 34 2.856 -7.273 8.577 1.00 0.00 C ATOM 496 C SER A 34 1.432 -6.978 9.024 1.00 0.00 C ATOM 497 O SER A 34 1.216 -6.350 10.062 1.00 0.00 O ATOM 498 CB SER A 34 3.658 -8.117 9.576 1.00 0.00 C ATOM 499 OG SER A 34 3.928 -7.407 10.769 1.00 0.00 O ATOM 0 H SER A 34 3.097 -5.218 8.835 1.00 0.00 H new ATOM 0 HA SER A 34 2.809 -7.877 7.671 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.103 -9.025 9.812 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.597 -8.427 9.118 1.00 0.00 H new ATOM 0 HG SER A 34 3.160 -6.841 10.994 1.00 0.00 H new ATOM 505 N ILE A 35 0.456 -7.366 8.200 1.00 0.00 N ATOM 506 CA ILE A 35 -0.943 -7.291 8.598 1.00 0.00 C ATOM 507 C ILE A 35 -1.283 -8.470 9.504 1.00 0.00 C ATOM 508 O ILE A 35 -0.504 -9.405 9.645 1.00 0.00 O ATOM 509 CB ILE A 35 -1.855 -7.162 7.361 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.881 -6.018 7.496 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.592 -8.459 7.013 1.00 0.00 C ATOM 512 CD1 ILE A 35 -3.122 -5.336 6.150 1.00 0.00 C ATOM 0 H ILE A 35 0.611 -7.732 7.261 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.121 -6.389 9.184 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.171 -6.929 6.545 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.821 -6.412 7.882 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.522 -5.286 8.219 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.216 -8.298 6.134 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -1.866 -9.245 6.805 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.219 -8.758 7.853 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.849 -4.534 6.274 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.184 -4.922 5.779 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -3.504 -6.065 5.436 1.00 0.00 H new ATOM 524 N LYS A 36 -2.474 -8.435 10.086 1.00 0.00 N ATOM 525 CA LYS A 36 -3.087 -9.529 10.793 1.00 0.00 C ATOM 526 C LYS A 36 -4.587 -9.274 10.688 1.00 0.00 C ATOM 527 O LYS A 36 -5.152 -8.465 11.422 1.00 0.00 O ATOM 528 CB LYS A 36 -2.562 -9.594 12.232 1.00 0.00 C ATOM 529 CG LYS A 36 -2.749 -10.985 12.867 1.00 0.00 C ATOM 530 CD LYS A 36 -1.411 -11.534 13.397 1.00 0.00 C ATOM 531 CE LYS A 36 -1.505 -12.992 13.890 1.00 0.00 C ATOM 532 NZ LYS A 36 -1.683 -13.956 12.776 1.00 0.00 N ATOM 0 H LYS A 36 -3.059 -7.599 10.072 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.849 -10.507 10.374 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.504 -9.334 12.241 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -3.079 -8.849 12.838 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.469 -10.922 13.683 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -3.162 -11.673 12.129 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.662 -11.472 12.608 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.065 -10.902 14.215 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.601 -13.244 14.444 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.340 -13.085 14.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.025 -14.863 13.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.376 -13.579 12.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.773 -14.102 12.295 1.00 0.00 H new ATOM 546 N GLY A 37 -5.194 -9.920 9.698 1.00 0.00 N ATOM 547 CA GLY A 37 -6.629 -9.990 9.481 1.00 0.00 C ATOM 548 C GLY A 37 -7.041 -10.088 8.009 1.00 0.00 C ATOM 549 O GLY A 37 -8.231 -10.029 7.709 1.00 0.00 O ATOM 0 H GLY A 37 -4.669 -10.434 8.991 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.023 -10.855 10.015 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -7.094 -9.106 9.918 1.00 0.00 H new ATOM 553 N LEU A 38 -6.091 -10.209 7.077 1.00 0.00 N ATOM 554 CA LEU A 38 -6.404 -10.470 5.680 1.00 0.00 C ATOM 555 C LEU A 38 -6.855 -11.928 5.514 1.00 0.00 C ATOM 556 O LEU A 38 -7.107 -12.625 6.492 1.00 0.00 O ATOM 557 CB LEU A 38 -5.176 -10.078 4.828 1.00 0.00 C ATOM 558 CG LEU A 38 -5.328 -8.666 4.244 1.00 0.00 C ATOM 559 CD1 LEU A 38 -5.677 -7.582 5.274 1.00 0.00 C ATOM 560 CD2 LEU A 38 -4.125 -8.254 3.384 1.00 0.00 C ATOM 0 H LEU A 38 -5.093 -10.129 7.273 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.241 -9.866 5.329 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.276 -10.125 5.441 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.048 -10.797 4.018 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.198 -8.739 3.592 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.765 -6.618 4.772 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.624 -7.828 5.755 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.891 -7.529 6.027 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.283 -7.248 2.995 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.220 -8.270 3.992 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.016 -8.951 2.553 1.00 0.00 H new ATOM 572 N THR A 39 -6.966 -12.394 4.270 1.00 0.00 N ATOM 573 CA THR A 39 -7.172 -13.790 3.928 1.00 0.00 C ATOM 574 C THR A 39 -6.179 -14.086 2.816 1.00 0.00 C ATOM 575 O THR A 39 -5.746 -13.160 2.120 1.00 0.00 O ATOM 576 CB THR A 39 -8.631 -14.040 3.510 1.00 0.00 C ATOM 577 OG1 THR A 39 -8.871 -15.375 3.108 1.00 0.00 O ATOM 578 CG2 THR A 39 -9.036 -13.155 2.328 1.00 0.00 C ATOM 0 H THR A 39 -6.913 -11.787 3.452 1.00 0.00 H new ATOM 0 HA THR A 39 -7.003 -14.456 4.774 1.00 0.00 H new ATOM 0 HB THR A 39 -9.215 -13.809 4.401 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.279 -15.978 3.605 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.073 -13.358 2.060 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.932 -12.106 2.606 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.392 -13.370 1.475 1.00 0.00 H new ATOM 586 N GLU A 40 -5.819 -15.357 2.698 1.00 0.00 N ATOM 587 CA GLU A 40 -4.845 -15.898 1.783 1.00 0.00 C ATOM 588 C GLU A 40 -5.090 -15.406 0.363 1.00 0.00 C ATOM 589 O GLU A 40 -6.229 -15.342 -0.100 1.00 0.00 O ATOM 590 CB GLU A 40 -4.854 -17.431 1.857 1.00 0.00 C ATOM 591 CG GLU A 40 -6.257 -18.068 1.881 1.00 0.00 C ATOM 592 CD GLU A 40 -6.783 -18.288 3.297 1.00 0.00 C ATOM 593 OE1 GLU A 40 -7.243 -17.285 3.895 1.00 0.00 O ATOM 594 OE2 GLU A 40 -6.686 -19.439 3.766 1.00 0.00 O ATOM 0 H GLU A 40 -6.234 -16.081 3.284 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.856 -15.545 2.076 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.306 -17.825 1.001 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.314 -17.741 2.752 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.951 -17.428 1.336 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.226 -19.023 1.357 1.00 0.00 H new ATOM 601 N GLY A 41 -4.010 -15.051 -0.331 1.00 0.00 N ATOM 602 CA GLY A 41 -4.094 -14.528 -1.680 1.00 0.00 C ATOM 603 C GLY A 41 -3.456 -13.160 -1.628 1.00 0.00 C ATOM 604 O GLY A 41 -2.452 -13.011 -0.937 1.00 0.00 O ATOM 0 H GLY A 41 -3.059 -15.120 0.030 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.573 -15.176 -2.385 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.130 -14.464 -2.012 1.00 0.00 H new ATOM 608 N LEU A 42 -4.029 -12.164 -2.307 1.00 0.00 N ATOM 609 CA LEU A 42 -3.410 -10.856 -2.430 1.00 0.00 C ATOM 610 C LEU A 42 -4.415 -9.718 -2.278 1.00 0.00 C ATOM 611 O LEU A 42 -5.597 -9.888 -2.566 1.00 0.00 O ATOM 612 CB LEU A 42 -2.567 -10.764 -3.716 1.00 0.00 C ATOM 613 CG LEU A 42 -3.386 -10.568 -5.002 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.447 -10.423 -6.202 1.00 0.00 C ATOM 615 CD2 LEU A 42 -4.348 -11.730 -5.287 1.00 0.00 C ATOM 0 H LEU A 42 -4.928 -12.247 -2.781 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.720 -10.734 -1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.866 -9.936 -3.617 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.974 -11.674 -3.813 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.979 -9.666 -4.850 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.035 -10.285 -7.109 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.799 -9.559 -6.054 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -1.838 -11.322 -6.298 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -4.896 -11.531 -6.208 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -3.780 -12.654 -5.395 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.051 -11.831 -4.460 1.00 0.00 H new ATOM 627 N HIS A 43 -3.939 -8.583 -1.761 1.00 0.00 N ATOM 628 CA HIS A 43 -4.736 -7.426 -1.377 1.00 0.00 C ATOM 629 C HIS A 43 -4.039 -6.152 -1.856 1.00 0.00 C ATOM 630 O HIS A 43 -2.825 -6.046 -1.693 1.00 0.00 O ATOM 631 CB HIS A 43 -4.822 -7.414 0.150 1.00 0.00 C ATOM 632 CG HIS A 43 -5.880 -8.334 0.705 1.00 0.00 C ATOM 633 ND1 HIS A 43 -7.078 -7.907 1.231 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.877 -9.703 0.723 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.808 -8.986 1.552 1.00 0.00 C ATOM 636 NE2 HIS A 43 -7.100 -10.082 1.242 1.00 0.00 N ATOM 0 H HIS A 43 -2.943 -8.444 -1.593 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.731 -7.475 -1.820 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.854 -7.698 0.562 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -5.025 -6.397 0.486 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.363 -6.935 1.356 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -5.080 -10.355 0.397 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.797 -8.974 1.986 1.00 0.00 H new ATOM 645 N GLY A 44 -4.780 -5.194 -2.425 1.00 0.00 N ATOM 646 CA GLY A 44 -4.210 -3.939 -2.899 1.00 0.00 C ATOM 647 C GLY A 44 -3.674 -3.103 -1.741 1.00 0.00 C ATOM 648 O GLY A 44 -4.265 -3.138 -0.662 1.00 0.00 O ATOM 0 H GLY A 44 -5.787 -5.271 -2.567 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.405 -4.146 -3.604 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.969 -3.373 -3.439 1.00 0.00 H new ATOM 652 N PHE A 45 -2.591 -2.349 -1.958 1.00 0.00 N ATOM 653 CA PHE A 45 -1.958 -1.513 -0.939 1.00 0.00 C ATOM 654 C PHE A 45 -1.560 -0.181 -1.552 1.00 0.00 C ATOM 655 O PHE A 45 -0.766 -0.176 -2.492 1.00 0.00 O ATOM 656 CB PHE A 45 -0.700 -2.206 -0.403 1.00 0.00 C ATOM 657 CG PHE A 45 -0.785 -2.525 1.070 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.377 -3.727 1.485 1.00 0.00 C ATOM 659 CD2 PHE A 45 -0.330 -1.599 2.027 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.380 -4.075 2.845 1.00 0.00 C ATOM 661 CE2 PHE A 45 -0.359 -1.937 3.390 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.831 -3.195 3.792 1.00 0.00 C ATOM 0 H PHE A 45 -2.124 -2.304 -2.863 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.664 -1.353 -0.124 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.535 -3.128 -0.960 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.164 -1.566 -0.581 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.830 -4.385 0.758 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.040 -0.633 1.715 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.803 -5.017 3.162 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -0.018 -1.227 4.129 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.772 -3.487 4.830 1.00 0.00 H new ATOM 672 N HIS A 46 -2.079 0.944 -1.042 1.00 0.00 N ATOM 673 CA HIS A 46 -1.734 2.238 -1.622 1.00 0.00 C ATOM 674 C HIS A 46 -1.661 3.337 -0.583 1.00 0.00 C ATOM 675 O HIS A 46 -2.311 3.270 0.463 1.00 0.00 O ATOM 676 CB HIS A 46 -2.729 2.664 -2.710 1.00 0.00 C ATOM 677 CG HIS A 46 -3.362 1.518 -3.430 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.660 1.053 -3.240 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.773 0.707 -4.350 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.828 -0.031 -4.024 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.698 -0.219 -4.699 1.00 0.00 N ATOM 0 H HIS A 46 -2.721 0.981 -0.251 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.747 2.100 -2.064 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.511 3.272 -2.256 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.214 3.296 -3.434 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -5.359 1.460 -2.619 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -1.765 0.786 -4.728 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.719 -0.637 -4.092 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.548 -0.959 -5.385 1.00 0.00 H new ATOM 689 N VAL A 47 -0.916 4.384 -0.938 1.00 0.00 N ATOM 690 CA VAL A 47 -0.956 5.653 -0.242 1.00 0.00 C ATOM 691 C VAL A 47 -2.145 6.444 -0.790 1.00 0.00 C ATOM 692 O VAL A 47 -2.086 6.976 -1.901 1.00 0.00 O ATOM 693 CB VAL A 47 0.377 6.402 -0.414 1.00 0.00 C ATOM 694 CG1 VAL A 47 0.312 7.737 0.322 1.00 0.00 C ATOM 695 CG2 VAL A 47 1.560 5.565 0.091 1.00 0.00 C ATOM 0 H VAL A 47 -0.266 4.367 -1.724 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.088 5.509 0.830 1.00 0.00 H new ATOM 0 HB VAL A 47 0.536 6.583 -1.477 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.257 8.266 0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.498 8.340 -0.089 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.130 7.560 1.382 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.486 6.124 -0.045 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.423 5.343 1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.613 4.633 -0.472 1.00 0.00 H new ATOM 705 N HIS A 48 -3.242 6.490 -0.036 1.00 0.00 N ATOM 706 CA HIS A 48 -4.358 7.370 -0.319 1.00 0.00 C ATOM 707 C HIS A 48 -3.971 8.805 0.004 1.00 0.00 C ATOM 708 O HIS A 48 -3.080 9.053 0.819 1.00 0.00 O ATOM 709 CB HIS A 48 -5.576 6.944 0.502 1.00 0.00 C ATOM 710 CG HIS A 48 -6.210 5.708 -0.068 1.00 0.00 C ATOM 711 ND1 HIS A 48 -5.549 4.552 -0.362 1.00 0.00 N flip ATOM 712 CD2 HIS A 48 -7.460 5.668 -0.596 1.00 0.00 C flip ATOM 713 CE1 HIS A 48 -6.456 3.816 -1.118 1.00 0.00 C flip ATOM 714 NE2 HIS A 48 -7.626 4.474 -1.169 1.00 0.00 N flip ATOM 0 H HIS A 48 -3.375 5.911 0.793 1.00 0.00 H new ATOM 0 HA HIS A 48 -4.614 7.305 -1.377 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.276 6.759 1.533 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.305 7.754 0.522 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -8.191 6.462 -0.559 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -6.252 2.866 -1.589 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -8.492 4.122 -1.576 1.00 0.00 H new ATOM 722 N GLU A 49 -4.650 9.744 -0.647 1.00 0.00 N ATOM 723 CA GLU A 49 -4.446 11.154 -0.409 1.00 0.00 C ATOM 724 C GLU A 49 -5.324 11.555 0.776 1.00 0.00 C ATOM 725 O GLU A 49 -6.544 11.417 0.716 1.00 0.00 O ATOM 726 CB GLU A 49 -4.642 11.912 -1.727 1.00 0.00 C ATOM 727 CG GLU A 49 -6.067 11.953 -2.298 1.00 0.00 C ATOM 728 CD GLU A 49 -6.843 13.207 -1.907 1.00 0.00 C ATOM 729 OE1 GLU A 49 -6.285 14.027 -1.146 1.00 0.00 O ATOM 730 OE2 GLU A 49 -7.974 13.337 -2.423 1.00 0.00 O ATOM 0 H GLU A 49 -5.356 9.540 -1.354 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.432 11.418 -0.109 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.305 12.938 -1.582 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.989 11.465 -2.476 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.016 11.891 -3.385 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.613 11.075 -1.954 1.00 0.00 H new ATOM 876 N PRO A 62 -9.067 9.319 -2.831 1.00 0.00 N ATOM 877 CA PRO A 62 -8.751 8.235 -3.741 1.00 0.00 C ATOM 878 C PRO A 62 -7.235 7.993 -3.836 1.00 0.00 C ATOM 879 O PRO A 62 -6.452 8.502 -3.031 1.00 0.00 O ATOM 880 CB PRO A 62 -9.419 8.637 -5.064 1.00 0.00 C ATOM 881 CG PRO A 62 -9.459 10.168 -5.003 1.00 0.00 C ATOM 882 CD PRO A 62 -9.660 10.451 -3.518 1.00 0.00 C ATOM 0 HA PRO A 62 -9.128 7.269 -3.406 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -8.848 8.286 -5.923 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.420 8.214 -5.152 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -8.535 10.610 -5.376 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.272 10.574 -5.604 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -9.179 11.385 -3.226 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -10.718 10.548 -3.275 1.00 0.00 H new ATOM 890 N HIS A 63 -6.809 7.173 -4.807 1.00 0.00 N ATOM 891 CA HIS A 63 -5.389 6.948 -5.064 1.00 0.00 C ATOM 892 C HIS A 63 -4.679 8.285 -5.275 1.00 0.00 C ATOM 893 O HIS A 63 -5.101 9.090 -6.103 1.00 0.00 O ATOM 894 CB HIS A 63 -5.171 6.069 -6.304 1.00 0.00 C ATOM 895 CG HIS A 63 -5.268 4.583 -6.062 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.531 3.569 -6.692 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.101 3.974 -5.172 1.00 0.00 C ATOM 898 CE1 HIS A 63 -4.941 2.382 -6.184 1.00 0.00 C ATOM 899 NE2 HIS A 63 -5.893 2.636 -5.271 1.00 0.00 N ATOM 0 H HIS A 63 -7.433 6.656 -5.426 1.00 0.00 H new ATOM 0 HA HIS A 63 -4.977 6.433 -4.196 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -5.905 6.347 -7.060 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -4.187 6.290 -6.718 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.798 4.465 -4.510 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.569 1.407 -6.463 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.388 1.927 -4.730 1.00 0.00 H new ATOM 907 N PHE A 64 -3.588 8.504 -4.539 1.00 0.00 N ATOM 908 CA PHE A 64 -2.837 9.744 -4.607 1.00 0.00 C ATOM 909 C PHE A 64 -2.207 9.886 -5.998 1.00 0.00 C ATOM 910 O PHE A 64 -1.356 9.091 -6.396 1.00 0.00 O ATOM 911 CB PHE A 64 -1.828 9.763 -3.448 1.00 0.00 C ATOM 912 CG PHE A 64 -1.296 11.110 -2.985 1.00 0.00 C ATOM 913 CD1 PHE A 64 -1.076 12.179 -3.878 1.00 0.00 C ATOM 914 CD2 PHE A 64 -1.112 11.322 -1.606 1.00 0.00 C ATOM 915 CE1 PHE A 64 -0.697 13.442 -3.396 1.00 0.00 C ATOM 916 CE2 PHE A 64 -0.810 12.606 -1.120 1.00 0.00 C ATOM 917 CZ PHE A 64 -0.579 13.662 -2.015 1.00 0.00 C ATOM 0 H PHE A 64 -3.206 7.823 -3.882 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.478 10.617 -4.484 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.294 9.276 -2.592 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.975 9.149 -3.738 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.200 12.025 -4.940 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -1.203 10.495 -0.918 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.496 14.246 -4.089 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.756 12.780 -0.056 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.312 14.640 -1.643 1.00 0.00 H new ATOM 927 N ASN A 65 -2.643 10.909 -6.736 1.00 0.00 N ATOM 928 CA ASN A 65 -2.207 11.260 -8.081 1.00 0.00 C ATOM 929 C ASN A 65 -1.720 12.716 -8.103 1.00 0.00 C ATOM 930 O ASN A 65 -2.515 13.615 -8.354 1.00 0.00 O ATOM 931 CB ASN A 65 -3.392 11.123 -9.053 1.00 0.00 C ATOM 932 CG ASN A 65 -3.420 9.839 -9.851 1.00 0.00 C ATOM 933 OD1 ASN A 65 -2.397 9.649 -10.677 1.00 0.00 O flip ATOM 934 ND2 ASN A 65 -4.379 9.079 -9.804 1.00 0.00 N flip ATOM 0 H ASN A 65 -3.353 11.551 -6.385 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.397 10.594 -8.379 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.319 11.200 -8.485 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.372 11.964 -9.747 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.144 9.262 -9.154 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.413 8.263 -10.414 1.00 0.00 H new ATOM 941 N PRO A 66 -0.423 12.979 -7.890 1.00 0.00 N ATOM 942 CA PRO A 66 0.141 14.308 -8.065 1.00 0.00 C ATOM 943 C PRO A 66 0.411 14.567 -9.555 1.00 0.00 C ATOM 944 O PRO A 66 0.091 15.629 -10.079 1.00 0.00 O ATOM 945 CB PRO A 66 1.418 14.301 -7.222 1.00 0.00 C ATOM 946 CG PRO A 66 1.873 12.840 -7.237 1.00 0.00 C ATOM 947 CD PRO A 66 0.587 12.034 -7.454 1.00 0.00 C ATOM 0 HA PRO A 66 -0.525 15.110 -7.746 1.00 0.00 H new ATOM 0 HB2 PRO A 66 2.177 14.959 -7.645 1.00 0.00 H new ATOM 0 HB3 PRO A 66 1.226 14.647 -6.206 1.00 0.00 H new ATOM 0 HG2 PRO A 66 2.594 12.658 -8.034 1.00 0.00 H new ATOM 0 HG3 PRO A 66 2.358 12.567 -6.300 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.739 11.256 -8.202 1.00 0.00 H new ATOM 0 HD3 PRO A 66 0.281 11.536 -6.534 1.00 0.00 H new ATOM 955 N LEU A 67 0.972 13.573 -10.254 1.00 0.00 N ATOM 956 CA LEU A 67 1.357 13.664 -11.661 1.00 0.00 C ATOM 957 C LEU A 67 0.171 13.431 -12.597 1.00 0.00 C ATOM 958 O LEU A 67 0.315 13.566 -13.808 1.00 0.00 O ATOM 959 CB LEU A 67 2.459 12.629 -11.942 1.00 0.00 C ATOM 960 CG LEU A 67 3.846 13.125 -11.498 1.00 0.00 C ATOM 961 CD1 LEU A 67 4.602 12.024 -10.748 1.00 0.00 C ATOM 962 CD2 LEU A 67 4.657 13.561 -12.727 1.00 0.00 C ATOM 0 H LEU A 67 1.174 12.662 -9.843 1.00 0.00 H new ATOM 0 HA LEU A 67 1.724 14.673 -11.851 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.224 11.700 -11.423 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.480 12.403 -13.008 1.00 0.00 H new ATOM 0 HG LEU A 67 3.711 13.973 -10.827 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.580 12.397 -10.443 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.035 11.730 -9.865 1.00 0.00 H new ATOM 0 HD13 LEU A 67 4.730 11.161 -11.401 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.639 13.912 -12.409 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.776 12.715 -13.404 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.133 14.366 -13.242 1.00 0.00 H new ATOM 974 N SER A 68 -0.991 13.054 -12.053 1.00 0.00 N ATOM 975 CA SER A 68 -2.204 12.804 -12.815 1.00 0.00 C ATOM 976 C SER A 68 -1.980 11.805 -13.959 1.00 0.00 C ATOM 977 O SER A 68 -2.124 12.141 -15.132 1.00 0.00 O ATOM 978 CB SER A 68 -2.788 14.130 -13.311 1.00 0.00 C ATOM 979 OG SER A 68 -2.960 15.007 -12.216 1.00 0.00 O ATOM 0 H SER A 68 -1.110 12.913 -11.050 1.00 0.00 H new ATOM 0 HA SER A 68 -2.931 12.334 -12.153 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.124 14.579 -14.049 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.744 13.957 -13.806 1.00 0.00 H new ATOM 0 HG SER A 68 -3.332 15.857 -12.533 1.00 0.00 H new ATOM 985 N ARG A 69 -1.639 10.563 -13.600 1.00 0.00 N ATOM 986 CA ARG A 69 -1.466 9.440 -14.514 1.00 0.00 C ATOM 987 C ARG A 69 -2.484 8.361 -14.145 1.00 0.00 C ATOM 988 O ARG A 69 -3.111 8.443 -13.089 1.00 0.00 O ATOM 989 CB ARG A 69 -0.029 8.889 -14.451 1.00 0.00 C ATOM 990 CG ARG A 69 1.013 9.917 -13.977 1.00 0.00 C ATOM 991 CD ARG A 69 2.406 9.564 -14.503 1.00 0.00 C ATOM 992 NE ARG A 69 2.540 10.009 -15.899 1.00 0.00 N ATOM 993 CZ ARG A 69 3.600 9.791 -16.692 1.00 0.00 C ATOM 994 NH1 ARG A 69 4.607 9.025 -16.262 1.00 0.00 N ATOM 995 NH2 ARG A 69 3.649 10.354 -17.905 1.00 0.00 N ATOM 0 H ARG A 69 -1.471 10.308 -12.627 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.633 9.771 -15.539 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.009 8.030 -13.780 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.255 8.528 -15.440 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.731 10.912 -14.321 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.029 9.949 -12.888 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.169 10.039 -13.886 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.567 8.488 -14.438 1.00 0.00 H new ATOM 0 HE ARG A 69 1.759 10.529 -16.299 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.569 8.607 -15.332 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.414 8.858 -16.864 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.882 10.946 -18.224 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.453 10.191 -18.511 1.00 0.00 H new ATOM 1009 N LYS A 70 -2.652 7.348 -14.992 1.00 0.00 N ATOM 1010 CA LYS A 70 -3.586 6.268 -14.769 1.00 0.00 C ATOM 1011 C LYS A 70 -2.968 5.213 -13.837 1.00 0.00 C ATOM 1012 O LYS A 70 -1.759 5.204 -13.607 1.00 0.00 O ATOM 1013 CB LYS A 70 -3.953 5.720 -16.147 1.00 0.00 C ATOM 1014 CG LYS A 70 -4.772 6.740 -16.955 1.00 0.00 C ATOM 1015 CD LYS A 70 -4.628 6.571 -18.476 1.00 0.00 C ATOM 1016 CE LYS A 70 -5.263 5.274 -19.003 1.00 0.00 C ATOM 1017 NZ LYS A 70 -5.907 5.468 -20.319 1.00 0.00 N ATOM 0 H LYS A 70 -2.130 7.261 -15.864 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.492 6.602 -14.264 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.045 5.466 -16.693 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.525 4.799 -16.034 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.824 6.646 -16.684 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.460 7.747 -16.678 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.089 7.423 -18.975 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.570 6.583 -18.738 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.497 4.502 -19.084 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.002 4.915 -18.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.322 4.570 -20.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.655 6.186 -20.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.197 5.786 -21.009 1.00 0.00 H new ATOM 1031 N HIS A 71 -3.823 4.380 -13.237 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.433 3.400 -12.232 1.00 0.00 C ATOM 1033 C HIS A 71 -2.676 2.254 -12.882 1.00 0.00 C ATOM 1034 O HIS A 71 -3.035 1.818 -13.973 1.00 0.00 O ATOM 1035 CB HIS A 71 -4.671 2.825 -11.532 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.340 1.906 -10.388 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.591 2.181 -9.240 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -4.686 0.590 -10.306 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.329 1.016 -8.631 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.110 0.097 -9.182 1.00 0.00 N ATOM 0 H HIS A 71 -4.822 4.371 -13.443 1.00 0.00 H new ATOM 0 HA HIS A 71 -2.798 3.903 -11.503 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.284 3.647 -11.162 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.272 2.282 -12.262 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -3.296 3.104 -8.922 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.302 0.043 -11.004 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.614 0.856 -7.838 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.256 -0.843 -8.814 1.00 0.00 H new ATOM 1048 N GLY A 72 -1.691 1.727 -12.165 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.042 0.482 -12.496 1.00 0.00 C ATOM 1050 C GLY A 72 0.105 0.286 -11.508 1.00 0.00 C ATOM 1051 O GLY A 72 0.164 0.978 -10.490 1.00 0.00 O ATOM 0 H GLY A 72 -1.320 2.168 -11.323 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.747 -0.347 -12.434 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.667 0.505 -13.519 1.00 0.00 H new ATOM 1055 N GLY A 73 0.948 -0.712 -11.737 1.00 0.00 N ATOM 1056 CA GLY A 73 1.897 -1.245 -10.777 1.00 0.00 C ATOM 1057 C GLY A 73 3.294 -0.685 -10.987 1.00 0.00 C ATOM 1058 O GLY A 73 3.583 -0.102 -12.029 1.00 0.00 O ATOM 0 H GLY A 73 0.988 -1.191 -12.637 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.561 -1.011 -9.767 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.926 -2.331 -10.860 1.00 0.00 H new ATOM 1062 N PRO A 74 4.215 -0.947 -10.048 1.00 0.00 N ATOM 1063 CA PRO A 74 5.617 -0.613 -10.228 1.00 0.00 C ATOM 1064 C PRO A 74 6.212 -1.319 -11.452 1.00 0.00 C ATOM 1065 O PRO A 74 7.206 -0.850 -11.999 1.00 0.00 O ATOM 1066 CB PRO A 74 6.305 -1.020 -8.921 1.00 0.00 C ATOM 1067 CG PRO A 74 5.408 -2.130 -8.371 1.00 0.00 C ATOM 1068 CD PRO A 74 4.011 -1.707 -8.824 1.00 0.00 C ATOM 0 HA PRO A 74 5.759 0.449 -10.427 1.00 0.00 H new ATOM 0 HB2 PRO A 74 7.320 -1.375 -9.097 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.376 -0.182 -8.228 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.683 -3.106 -8.772 1.00 0.00 H new ATOM 0 HG3 PRO A 74 5.475 -2.201 -7.285 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.376 -2.575 -9.002 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.518 -1.102 -8.063 1.00 0.00 H new ATOM 1076 N LYS A 75 5.608 -2.430 -11.887 1.00 0.00 N ATOM 1077 CA LYS A 75 6.005 -3.132 -13.084 1.00 0.00 C ATOM 1078 C LYS A 75 5.407 -2.486 -14.347 1.00 0.00 C ATOM 1079 O LYS A 75 5.977 -2.645 -15.426 1.00 0.00 O ATOM 1080 CB LYS A 75 5.605 -4.608 -12.911 1.00 0.00 C ATOM 1081 CG LYS A 75 5.791 -5.345 -14.233 1.00 0.00 C ATOM 1082 CD LYS A 75 5.945 -6.868 -14.107 1.00 0.00 C ATOM 1083 CE LYS A 75 7.061 -7.332 -15.059 1.00 0.00 C ATOM 1084 NZ LYS A 75 7.260 -8.795 -15.038 1.00 0.00 N ATOM 0 H LYS A 75 4.821 -2.862 -11.402 1.00 0.00 H new ATOM 0 HA LYS A 75 7.084 -3.070 -13.226 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.214 -5.072 -12.135 1.00 0.00 H new ATOM 0 HB3 LYS A 75 4.567 -4.679 -12.586 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.936 -5.133 -14.874 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.672 -4.945 -14.734 1.00 0.00 H new ATOM 0 HD2 LYS A 75 6.188 -7.139 -13.080 1.00 0.00 H new ATOM 0 HD3 LYS A 75 5.007 -7.364 -14.355 1.00 0.00 H new ATOM 0 HE2 LYS A 75 6.820 -7.017 -16.074 1.00 0.00 H new ATOM 0 HE3 LYS A 75 7.994 -6.839 -14.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 8.023 -9.051 -15.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.517 -9.097 -14.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 6.380 -9.269 -15.326 1.00 0.00 H new ATOM 1098 N ASP A 76 4.258 -1.814 -14.246 1.00 0.00 N ATOM 1099 CA ASP A 76 3.544 -1.323 -15.413 1.00 0.00 C ATOM 1100 C ASP A 76 4.070 0.059 -15.781 1.00 0.00 C ATOM 1101 O ASP A 76 4.705 0.751 -14.984 1.00 0.00 O ATOM 1102 CB ASP A 76 2.033 -1.303 -15.151 1.00 0.00 C ATOM 1103 CG ASP A 76 1.498 -2.649 -14.691 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.388 -3.559 -15.540 1.00 0.00 O ATOM 1105 OD2 ASP A 76 1.222 -2.739 -13.475 1.00 0.00 O ATOM 0 H ASP A 76 3.804 -1.599 -13.358 1.00 0.00 H new ATOM 0 HA ASP A 76 3.715 -1.993 -16.256 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.810 -0.551 -14.395 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.515 -1.003 -16.062 1.00 0.00 H new ATOM 1110 N GLU A 77 3.784 0.462 -17.016 1.00 0.00 N ATOM 1111 CA GLU A 77 4.052 1.808 -17.496 1.00 0.00 C ATOM 1112 C GLU A 77 3.238 2.806 -16.667 1.00 0.00 C ATOM 1113 O GLU A 77 3.756 3.839 -16.238 1.00 0.00 O ATOM 1114 CB GLU A 77 3.726 1.866 -18.997 1.00 0.00 C ATOM 1115 CG GLU A 77 4.833 1.153 -19.793 1.00 0.00 C ATOM 1116 CD GLU A 77 4.386 0.714 -21.182 1.00 0.00 C ATOM 1117 OE1 GLU A 77 3.644 1.488 -21.820 1.00 0.00 O ATOM 1118 OE2 GLU A 77 4.810 -0.391 -21.583 1.00 0.00 O ATOM 0 H GLU A 77 3.356 -0.145 -17.715 1.00 0.00 H new ATOM 0 HA GLU A 77 5.102 2.076 -17.377 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.763 1.392 -19.189 1.00 0.00 H new ATOM 0 HB3 GLU A 77 3.641 2.903 -19.321 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.690 1.820 -19.888 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.169 0.280 -19.234 1.00 0.00 H new ATOM 1125 N GLU A 78 1.979 2.454 -16.404 1.00 0.00 N ATOM 1126 CA GLU A 78 1.062 3.258 -15.614 1.00 0.00 C ATOM 1127 C GLU A 78 1.229 2.915 -14.138 1.00 0.00 C ATOM 1128 O GLU A 78 1.410 1.758 -13.778 1.00 0.00 O ATOM 1129 CB GLU A 78 -0.380 3.027 -16.084 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.805 4.081 -17.114 1.00 0.00 C ATOM 1131 CD GLU A 78 0.161 4.216 -18.279 1.00 0.00 C ATOM 1132 OE1 GLU A 78 0.261 3.236 -19.043 1.00 0.00 O ATOM 1133 OE2 GLU A 78 0.750 5.313 -18.389 1.00 0.00 O ATOM 0 H GLU A 78 1.566 1.585 -16.743 1.00 0.00 H new ATOM 0 HA GLU A 78 1.289 4.316 -15.749 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.468 2.032 -16.521 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.054 3.060 -15.228 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.792 3.824 -17.499 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.899 5.046 -16.616 1.00 0.00 H new ATOM 1140 N ARG A 79 1.183 3.935 -13.285 1.00 0.00 N ATOM 1141 CA ARG A 79 1.338 3.829 -11.845 1.00 0.00 C ATOM 1142 C ARG A 79 1.155 5.244 -11.282 1.00 0.00 C ATOM 1143 O ARG A 79 1.685 6.201 -11.850 1.00 0.00 O ATOM 1144 CB ARG A 79 2.713 3.260 -11.455 1.00 0.00 C ATOM 1145 CG ARG A 79 3.843 3.647 -12.417 1.00 0.00 C ATOM 1146 CD ARG A 79 5.203 3.462 -11.745 1.00 0.00 C ATOM 1147 NE ARG A 79 6.286 3.668 -12.716 1.00 0.00 N ATOM 1148 CZ ARG A 79 7.563 3.934 -12.401 1.00 0.00 C ATOM 1149 NH1 ARG A 79 7.946 3.957 -11.118 1.00 0.00 N ATOM 1150 NH2 ARG A 79 8.448 4.189 -13.372 1.00 0.00 N ATOM 0 H ARG A 79 1.030 4.895 -13.595 1.00 0.00 H new ATOM 0 HA ARG A 79 0.601 3.138 -11.435 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.968 3.607 -10.453 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.645 2.173 -11.409 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.789 3.034 -13.317 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.723 4.684 -12.730 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.307 4.167 -10.920 1.00 0.00 H new ATOM 0 HD3 ARG A 79 5.273 2.461 -11.320 1.00 0.00 H new ATOM 0 HE ARG A 79 6.049 3.604 -13.706 1.00 0.00 H new ATOM 0 HH11 ARG A 79 7.267 3.772 -10.380 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.917 4.159 -10.879 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.151 4.181 -14.348 1.00 0.00 H new ATOM 0 HH22 ARG A 79 9.419 4.392 -13.136 1.00 0.00 H new ATOM 1164 N HIS A 80 0.403 5.401 -10.193 1.00 0.00 N ATOM 1165 CA HIS A 80 0.305 6.658 -9.453 1.00 0.00 C ATOM 1166 C HIS A 80 1.484 6.776 -8.476 1.00 0.00 C ATOM 1167 O HIS A 80 2.334 5.889 -8.421 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.015 6.698 -8.689 1.00 0.00 C ATOM 1169 CG HIS A 80 -2.241 6.357 -9.491 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.349 5.637 -9.061 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -2.483 6.680 -10.789 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.331 5.845 -9.953 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -3.796 6.412 -11.039 1.00 0.00 N ATOM 0 H HIS A 80 -0.162 4.650 -9.796 1.00 0.00 H new ATOM 0 HA HIS A 80 0.339 7.495 -10.151 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -0.949 6.007 -7.849 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.142 7.697 -8.271 1.00 0.00 H new ATOM 0 HD1 HIS A 80 -3.406 5.058 -8.223 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -1.766 7.076 -11.493 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.373 5.597 -9.817 1.00 0.00 H new ATOM 1181 N VAL A 81 1.529 7.849 -7.671 1.00 0.00 N ATOM 1182 CA VAL A 81 2.637 8.072 -6.742 1.00 0.00 C ATOM 1183 C VAL A 81 2.704 6.942 -5.713 1.00 0.00 C ATOM 1184 O VAL A 81 3.779 6.439 -5.405 1.00 0.00 O ATOM 1185 CB VAL A 81 2.536 9.469 -6.090 1.00 0.00 C ATOM 1186 CG1 VAL A 81 1.609 9.544 -4.872 1.00 0.00 C ATOM 1187 CG2 VAL A 81 3.897 10.026 -5.672 1.00 0.00 C ATOM 0 H VAL A 81 0.810 8.572 -7.648 1.00 0.00 H new ATOM 0 HA VAL A 81 3.576 8.056 -7.296 1.00 0.00 H new ATOM 0 HB VAL A 81 2.104 10.074 -6.887 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.602 10.562 -4.482 1.00 0.00 H new ATOM 0 HG12 VAL A 81 0.598 9.261 -5.166 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.967 8.862 -4.100 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.765 11.009 -5.220 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.359 9.354 -4.949 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.539 10.113 -6.548 1.00 0.00 H new ATOM 1197 N GLY A 82 1.542 6.557 -5.173 1.00 0.00 N ATOM 1198 CA GLY A 82 1.457 5.620 -4.070 1.00 0.00 C ATOM 1199 C GLY A 82 0.976 4.232 -4.468 1.00 0.00 C ATOM 1200 O GLY A 82 0.337 3.575 -3.646 1.00 0.00 O ATOM 0 H GLY A 82 0.635 6.894 -5.497 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.439 5.533 -3.605 1.00 0.00 H new ATOM 0 HA3 GLY A 82 0.782 6.024 -3.316 1.00 0.00 H new ATOM 1204 N ASP A 83 1.236 3.786 -5.701 1.00 0.00 N ATOM 1205 CA ASP A 83 0.728 2.509 -6.189 1.00 0.00 C ATOM 1206 C ASP A 83 1.707 1.381 -5.897 1.00 0.00 C ATOM 1207 O ASP A 83 2.350 0.832 -6.791 1.00 0.00 O ATOM 1208 CB ASP A 83 0.359 2.615 -7.669 1.00 0.00 C ATOM 1209 CG ASP A 83 -0.933 3.382 -7.866 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -1.606 3.726 -6.872 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.298 3.607 -9.035 1.00 0.00 O ATOM 0 H ASP A 83 1.800 4.298 -6.380 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.187 2.261 -5.651 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.164 3.111 -8.211 1.00 0.00 H new ATOM 0 HB3 ASP A 83 0.258 1.616 -8.092 1.00 0.00 H new ATOM 1216 N LEU A 84 1.752 0.985 -4.627 1.00 0.00 N ATOM 1217 CA LEU A 84 2.601 -0.088 -4.135 1.00 0.00 C ATOM 1218 C LEU A 84 1.909 -1.426 -4.410 1.00 0.00 C ATOM 1219 O LEU A 84 1.707 -2.220 -3.494 1.00 0.00 O ATOM 1220 CB LEU A 84 2.839 0.137 -2.634 1.00 0.00 C ATOM 1221 CG LEU A 84 3.305 1.564 -2.285 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.364 1.711 -0.764 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.665 1.884 -2.912 1.00 0.00 C ATOM 0 H LEU A 84 1.184 1.414 -3.897 1.00 0.00 H new ATOM 0 HA LEU A 84 3.568 -0.100 -4.639 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.917 -0.076 -2.093 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.586 -0.575 -2.283 1.00 0.00 H new ATOM 0 HG LEU A 84 2.589 2.276 -2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.693 2.718 -0.508 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.374 1.535 -0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.067 0.985 -0.355 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.960 2.898 -2.643 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.411 1.180 -2.543 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.594 1.802 -3.997 1.00 0.00 H new ATOM 1235 N GLY A 85 1.519 -1.640 -5.675 1.00 0.00 N ATOM 1236 CA GLY A 85 0.489 -2.575 -6.111 1.00 0.00 C ATOM 1237 C GLY A 85 -0.318 -3.261 -5.010 1.00 0.00 C ATOM 1238 O GLY A 85 -1.306 -2.725 -4.502 1.00 0.00 O ATOM 0 H GLY A 85 1.939 -1.137 -6.456 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.205 -2.040 -6.760 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.963 -3.346 -6.718 1.00 0.00 H new ATOM 1242 N ASN A 86 0.084 -4.488 -4.693 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.625 -5.380 -3.793 1.00 0.00 C ATOM 1244 C ASN A 86 0.371 -6.176 -2.960 1.00 0.00 C ATOM 1245 O ASN A 86 1.564 -6.188 -3.261 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.571 -6.298 -4.587 1.00 0.00 C ATOM 1247 CG ASN A 86 -0.866 -7.054 -5.707 1.00 0.00 C ATOM 1248 OD1 ASN A 86 0.051 -7.827 -5.454 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -1.289 -6.864 -6.957 1.00 0.00 N ATOM 0 H ASN A 86 0.939 -4.898 -5.069 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.238 -4.793 -3.109 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.030 -7.014 -3.906 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.377 -5.700 -5.011 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -0.848 -7.367 -7.727 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.054 -6.216 -7.144 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.131 -6.817 -1.902 1.00 0.00 N ATOM 1257 CA VAL A 87 0.635 -7.665 -1.003 1.00 0.00 C ATOM 1258 C VAL A 87 -0.040 -9.019 -0.966 1.00 0.00 C ATOM 1259 O VAL A 87 -1.208 -9.118 -1.332 1.00 0.00 O ATOM 1260 CB VAL A 87 0.705 -7.063 0.408 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.274 -5.645 0.351 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.660 -7.089 1.109 1.00 0.00 C ATOM 0 H VAL A 87 -1.116 -6.754 -1.644 1.00 0.00 H new ATOM 0 HA VAL A 87 1.660 -7.754 -1.362 1.00 0.00 H new ATOM 0 HB VAL A 87 1.376 -7.681 1.004 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.318 -5.230 1.358 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.277 -5.672 -0.075 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.633 -5.020 -0.271 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.566 -6.654 2.104 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.379 -6.512 0.527 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.006 -8.119 1.194 1.00 0.00 H new ATOM 1272 N THR A 88 0.679 -10.029 -0.490 1.00 0.00 N ATOM 1273 CA THR A 88 0.258 -11.425 -0.473 1.00 0.00 C ATOM 1274 C THR A 88 0.035 -11.850 0.975 1.00 0.00 C ATOM 1275 O THR A 88 1.001 -11.939 1.728 1.00 0.00 O ATOM 1276 CB THR A 88 1.338 -12.273 -1.166 1.00 0.00 C ATOM 1277 OG1 THR A 88 1.769 -11.617 -2.345 1.00 0.00 O ATOM 1278 CG2 THR A 88 0.809 -13.659 -1.541 1.00 0.00 C ATOM 0 H THR A 88 1.607 -9.893 -0.090 1.00 0.00 H new ATOM 0 HA THR A 88 -0.678 -11.566 -1.013 1.00 0.00 H new ATOM 0 HB THR A 88 2.166 -12.394 -0.468 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.458 -12.156 -2.786 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.599 -14.230 -2.029 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.486 -14.181 -0.640 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.036 -13.554 -2.222 1.00 0.00 H new ATOM 1286 N ALA A 89 -1.218 -12.077 1.377 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.517 -12.605 2.693 1.00 0.00 C ATOM 1288 C ALA A 89 -1.360 -14.121 2.714 1.00 0.00 C ATOM 1289 O ALA A 89 -1.644 -14.801 1.726 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.912 -12.174 3.137 1.00 0.00 C ATOM 0 H ALA A 89 -2.040 -11.899 0.800 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.802 -12.194 3.406 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.120 -12.579 4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.963 -11.086 3.172 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.651 -12.549 2.429 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.907 -14.623 3.865 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.730 -16.029 4.185 1.00 0.00 C ATOM 1298 C ASP A 90 -2.074 -16.638 4.605 1.00 0.00 C ATOM 1299 O ASP A 90 -3.069 -15.931 4.793 1.00 0.00 O ATOM 1300 CB ASP A 90 0.333 -16.167 5.291 1.00 0.00 C ATOM 1301 CG ASP A 90 1.139 -17.445 5.147 1.00 0.00 C ATOM 1302 OD1 ASP A 90 0.499 -18.514 5.093 1.00 0.00 O ATOM 1303 OD2 ASP A 90 2.377 -17.343 5.085 1.00 0.00 O ATOM 0 H ASP A 90 -0.640 -14.017 4.641 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.381 -16.575 3.309 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.004 -15.309 5.258 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -0.154 -16.153 6.266 1.00 0.00 H new ATOM 1308 N LYS A 91 -2.071 -17.943 4.870 1.00 0.00 N ATOM 1309 CA LYS A 91 -3.173 -18.730 5.387 1.00 0.00 C ATOM 1310 C LYS A 91 -3.493 -18.400 6.845 1.00 0.00 C ATOM 1311 O LYS A 91 -4.338 -19.057 7.458 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.788 -20.205 5.247 1.00 0.00 C ATOM 1313 CG LYS A 91 -1.527 -20.623 6.038 1.00 0.00 C ATOM 1314 CD LYS A 91 -1.781 -21.588 7.210 1.00 0.00 C ATOM 1315 CE LYS A 91 -1.967 -20.855 8.557 1.00 0.00 C ATOM 1316 NZ LYS A 91 -3.270 -21.115 9.195 1.00 0.00 N ATOM 0 H LYS A 91 -1.238 -18.511 4.716 1.00 0.00 H new ATOM 0 HA LYS A 91 -4.074 -18.500 4.819 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.627 -20.818 5.577 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.628 -20.426 4.192 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.823 -21.090 5.349 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.046 -19.725 6.425 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -2.670 -22.183 6.999 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.945 -22.282 7.291 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -1.172 -21.157 9.238 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -1.858 -19.783 8.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -3.201 -20.924 10.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -3.992 -20.496 8.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -3.537 -22.109 9.047 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.753 -17.455 7.435 1.00 0.00 N ATOM 1331 CA ASP A 92 -3.041 -16.880 8.746 1.00 0.00 C ATOM 1332 C ASP A 92 -3.571 -15.450 8.597 1.00 0.00 C ATOM 1333 O ASP A 92 -3.767 -14.750 9.592 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.777 -16.906 9.621 1.00 0.00 C ATOM 1335 CG ASP A 92 -2.123 -17.215 11.072 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -2.558 -18.369 11.290 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.936 -16.313 11.926 1.00 0.00 O ATOM 0 H ASP A 92 -1.918 -17.062 7.001 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.811 -17.478 9.233 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.083 -17.656 9.241 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.270 -15.943 9.562 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.763 -14.987 7.355 1.00 0.00 N ATOM 1343 CA GLY A 93 -4.264 -13.645 7.101 1.00 0.00 C ATOM 1344 C GLY A 93 -3.241 -12.573 7.473 1.00 0.00 C ATOM 1345 O GLY A 93 -3.619 -11.448 7.822 1.00 0.00 O ATOM 0 H GLY A 93 -3.576 -15.530 6.512 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.524 -13.548 6.047 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.180 -13.486 7.671 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.954 -12.928 7.383 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.809 -12.054 7.602 1.00 0.00 C ATOM 1351 C VAL A 94 -0.158 -11.803 6.248 1.00 0.00 C ATOM 1352 O VAL A 94 0.224 -12.764 5.590 1.00 0.00 O ATOM 1353 CB VAL A 94 0.177 -12.725 8.575 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.483 -11.924 8.719 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.483 -12.893 9.945 1.00 0.00 C ATOM 0 H VAL A 94 -1.676 -13.880 7.144 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.116 -11.106 8.045 1.00 0.00 H new ATOM 0 HB VAL A 94 0.434 -13.701 8.164 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.148 -12.435 9.415 1.00 0.00 H new ATOM 0 HG12 VAL A 94 1.969 -11.842 7.747 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.258 -10.927 9.098 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.218 -13.368 10.631 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.766 -11.915 10.335 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.372 -13.515 9.847 1.00 0.00 H new ATOM 1365 N ALA A 95 -0.050 -10.545 5.816 1.00 0.00 N ATOM 1366 CA ALA A 95 0.672 -10.170 4.613 1.00 0.00 C ATOM 1367 C ALA A 95 1.923 -9.439 5.059 1.00 0.00 C ATOM 1368 O ALA A 95 1.830 -8.293 5.501 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.176 -9.283 3.697 1.00 0.00 C ATOM 0 H ALA A 95 -0.469 -9.753 6.303 1.00 0.00 H new ATOM 0 HA ALA A 95 0.922 -11.058 4.033 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.399 -9.024 2.808 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.077 -9.821 3.402 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.454 -8.372 4.228 1.00 0.00 H new ATOM 1375 N ASP A 96 3.063 -10.124 4.969 1.00 0.00 N ATOM 1376 CA ASP A 96 4.362 -9.552 5.261 1.00 0.00 C ATOM 1377 C ASP A 96 4.793 -8.729 4.051 1.00 0.00 C ATOM 1378 O ASP A 96 5.167 -9.277 3.017 1.00 0.00 O ATOM 1379 CB ASP A 96 5.375 -10.642 5.628 1.00 0.00 C ATOM 1380 CG ASP A 96 5.115 -11.171 7.032 1.00 0.00 C ATOM 1381 OD1 ASP A 96 5.442 -10.434 7.987 1.00 0.00 O ATOM 1382 OD2 ASP A 96 4.571 -12.290 7.126 1.00 0.00 O ATOM 0 H ASP A 96 3.103 -11.103 4.687 1.00 0.00 H new ATOM 0 HA ASP A 96 4.308 -8.899 6.132 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.313 -11.459 4.909 1.00 0.00 H new ATOM 0 HB3 ASP A 96 6.386 -10.240 5.567 1.00 0.00 H new ATOM 1387 N VAL A 97 4.701 -7.406 4.161 1.00 0.00 N ATOM 1388 CA VAL A 97 5.104 -6.497 3.105 1.00 0.00 C ATOM 1389 C VAL A 97 6.616 -6.362 3.195 1.00 0.00 C ATOM 1390 O VAL A 97 7.146 -6.329 4.304 1.00 0.00 O ATOM 1391 CB VAL A 97 4.422 -5.128 3.278 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.582 -4.271 2.016 1.00 0.00 C ATOM 1393 CG2 VAL A 97 2.945 -5.301 3.640 1.00 0.00 C ATOM 0 H VAL A 97 4.342 -6.937 4.993 1.00 0.00 H new ATOM 0 HA VAL A 97 4.807 -6.879 2.128 1.00 0.00 H new ATOM 0 HB VAL A 97 4.913 -4.606 4.099 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.091 -3.309 2.165 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.642 -4.111 1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.127 -4.783 1.168 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.482 -4.321 3.758 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.438 -5.849 2.846 1.00 0.00 H new ATOM 0 HG23 VAL A 97 2.862 -5.856 4.574 1.00 0.00 H new ATOM 1403 N SER A 98 7.296 -6.242 2.055 1.00 0.00 N ATOM 1404 CA SER A 98 8.700 -5.860 1.980 1.00 0.00 C ATOM 1405 C SER A 98 8.994 -5.464 0.537 1.00 0.00 C ATOM 1406 O SER A 98 9.087 -6.337 -0.324 1.00 0.00 O ATOM 1407 CB SER A 98 9.614 -6.992 2.472 1.00 0.00 C ATOM 1408 OG SER A 98 10.876 -6.467 2.846 1.00 0.00 O ATOM 0 H SER A 98 6.875 -6.412 1.142 1.00 0.00 H new ATOM 0 HA SER A 98 8.901 -5.014 2.637 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.155 -7.498 3.321 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.739 -7.737 1.686 1.00 0.00 H new ATOM 0 HG SER A 98 11.453 -7.194 3.160 1.00 0.00 H new ATOM 1414 N ILE A 99 9.070 -4.162 0.262 1.00 0.00 N ATOM 1415 CA ILE A 99 9.372 -3.623 -1.050 1.00 0.00 C ATOM 1416 C ILE A 99 10.077 -2.272 -0.868 1.00 0.00 C ATOM 1417 O ILE A 99 10.318 -1.831 0.257 1.00 0.00 O ATOM 1418 CB ILE A 99 8.071 -3.589 -1.888 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.345 -3.496 -3.397 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.073 -2.506 -1.463 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.172 -3.985 -4.254 1.00 0.00 C ATOM 0 H ILE A 99 8.918 -3.441 0.967 1.00 0.00 H new ATOM 0 HA ILE A 99 10.064 -4.246 -1.616 1.00 0.00 H new ATOM 0 HB ILE A 99 7.598 -4.548 -1.678 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.569 -2.461 -3.656 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.231 -4.084 -3.636 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.191 -2.553 -2.102 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.779 -2.669 -0.426 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.538 -1.525 -1.558 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.429 -3.893 -5.309 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.962 -5.029 -4.021 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.290 -3.381 -4.042 1.00 0.00 H new ATOM 1433 N GLU A 100 10.415 -1.607 -1.965 1.00 0.00 N ATOM 1434 CA GLU A 100 11.093 -0.331 -1.992 1.00 0.00 C ATOM 1435 C GLU A 100 10.531 0.487 -3.150 1.00 0.00 C ATOM 1436 O GLU A 100 10.162 -0.084 -4.176 1.00 0.00 O ATOM 1437 CB GLU A 100 12.617 -0.535 -2.093 1.00 0.00 C ATOM 1438 CG GLU A 100 13.076 -1.636 -3.067 1.00 0.00 C ATOM 1439 CD GLU A 100 12.852 -3.042 -2.524 1.00 0.00 C ATOM 1440 OE1 GLU A 100 13.518 -3.378 -1.521 1.00 0.00 O ATOM 1441 OE2 GLU A 100 11.989 -3.739 -3.102 1.00 0.00 O ATOM 0 H GLU A 100 10.212 -1.964 -2.899 1.00 0.00 H new ATOM 0 HA GLU A 100 10.919 0.219 -1.067 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.073 0.407 -2.397 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.001 -0.769 -1.100 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.539 -1.527 -4.009 1.00 0.00 H new ATOM 0 HG3 GLU A 100 14.135 -1.501 -3.286 1.00 0.00 H new ATOM 1448 N ASP A 101 10.441 1.809 -2.978 1.00 0.00 N ATOM 1449 CA ASP A 101 9.979 2.724 -4.014 1.00 0.00 C ATOM 1450 C ASP A 101 11.015 3.838 -4.160 1.00 0.00 C ATOM 1451 O ASP A 101 11.928 3.946 -3.343 1.00 0.00 O ATOM 1452 CB ASP A 101 8.595 3.273 -3.655 1.00 0.00 C ATOM 1453 CG ASP A 101 7.859 3.765 -4.886 1.00 0.00 C ATOM 1454 OD1 ASP A 101 8.296 4.813 -5.409 1.00 0.00 O ATOM 1455 OD2 ASP A 101 6.900 3.088 -5.301 1.00 0.00 O ATOM 0 H ASP A 101 10.690 2.274 -2.105 1.00 0.00 H new ATOM 0 HA ASP A 101 9.876 2.208 -4.969 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.009 2.495 -3.165 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.700 4.090 -2.941 1.00 0.00 H new ATOM 1460 N SER A 102 10.897 4.660 -5.201 1.00 0.00 N ATOM 1461 CA SER A 102 11.760 5.806 -5.455 1.00 0.00 C ATOM 1462 C SER A 102 10.955 7.035 -5.893 1.00 0.00 C ATOM 1463 O SER A 102 11.516 7.923 -6.532 1.00 0.00 O ATOM 1464 CB SER A 102 12.823 5.422 -6.486 1.00 0.00 C ATOM 1465 OG SER A 102 13.636 4.387 -5.974 1.00 0.00 O ATOM 0 H SER A 102 10.175 4.541 -5.911 1.00 0.00 H new ATOM 0 HA SER A 102 12.259 6.085 -4.527 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.345 5.098 -7.411 1.00 0.00 H new ATOM 0 HB3 SER A 102 13.435 6.290 -6.731 1.00 0.00 H new ATOM 0 HG SER A 102 14.314 4.144 -6.639 1.00 0.00 H new ATOM 1471 N VAL A 103 9.660 7.101 -5.562 1.00 0.00 N ATOM 1472 CA VAL A 103 8.816 8.255 -5.816 1.00 0.00 C ATOM 1473 C VAL A 103 8.494 8.929 -4.479 1.00 0.00 C ATOM 1474 O VAL A 103 8.944 10.046 -4.223 1.00 0.00 O ATOM 1475 CB VAL A 103 7.569 7.825 -6.606 1.00 0.00 C ATOM 1476 CG1 VAL A 103 6.788 9.069 -7.028 1.00 0.00 C ATOM 1477 CG2 VAL A 103 7.936 7.048 -7.879 1.00 0.00 C ATOM 0 H VAL A 103 9.168 6.335 -5.102 1.00 0.00 H new ATOM 0 HA VAL A 103 9.327 8.991 -6.436 1.00 0.00 H new ATOM 0 HB VAL A 103 6.977 7.180 -5.957 1.00 0.00 H new ATOM 0 HG11 VAL A 103 5.902 8.770 -7.589 1.00 0.00 H new ATOM 0 HG12 VAL A 103 6.485 9.626 -6.142 1.00 0.00 H new ATOM 0 HG13 VAL A 103 7.419 9.699 -7.655 1.00 0.00 H new ATOM 0 HG21 VAL A 103 7.026 6.763 -8.407 1.00 0.00 H new ATOM 0 HG22 VAL A 103 8.549 7.677 -8.525 1.00 0.00 H new ATOM 0 HG23 VAL A 103 8.495 6.152 -7.610 1.00 0.00 H new ATOM 1487 N ILE A 104 7.711 8.269 -3.621 1.00 0.00 N ATOM 1488 CA ILE A 104 7.399 8.763 -2.293 1.00 0.00 C ATOM 1489 C ILE A 104 8.670 8.873 -1.435 1.00 0.00 C ATOM 1490 O ILE A 104 9.692 8.280 -1.771 1.00 0.00 O ATOM 1491 CB ILE A 104 6.304 7.888 -1.654 1.00 0.00 C ATOM 1492 CG1 ILE A 104 6.463 6.357 -1.767 1.00 0.00 C ATOM 1493 CG2 ILE A 104 4.923 8.277 -2.195 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.760 5.819 -1.158 1.00 0.00 C ATOM 0 H ILE A 104 7.277 7.372 -3.838 1.00 0.00 H new ATOM 0 HA ILE A 104 6.999 9.775 -2.363 1.00 0.00 H new ATOM 0 HB ILE A 104 6.414 8.103 -0.591 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.617 5.877 -1.276 1.00 0.00 H new ATOM 0 HG13 ILE A 104 6.423 6.075 -2.819 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.161 7.649 -1.733 1.00 0.00 H new ATOM 0 HG22 ILE A 104 4.722 9.323 -1.961 1.00 0.00 H new ATOM 0 HG23 ILE A 104 4.903 8.136 -3.276 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.796 4.736 -1.278 1.00 0.00 H new ATOM 0 HD12 ILE A 104 8.614 6.269 -1.665 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.795 6.068 -0.097 1.00 0.00 H new ATOM 1506 N SER A 105 8.638 9.667 -0.355 1.00 0.00 N ATOM 1507 CA SER A 105 9.801 10.005 0.460 1.00 0.00 C ATOM 1508 C SER A 105 9.340 10.776 1.698 1.00 0.00 C ATOM 1509 O SER A 105 8.163 11.096 1.815 1.00 0.00 O ATOM 1510 CB SER A 105 10.803 10.821 -0.371 1.00 0.00 C ATOM 1511 OG SER A 105 11.640 9.973 -1.124 1.00 0.00 O ATOM 0 H SER A 105 7.777 10.100 -0.020 1.00 0.00 H new ATOM 0 HA SER A 105 10.305 9.096 0.788 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.265 11.494 -1.039 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.408 11.443 0.289 1.00 0.00 H new ATOM 0 HG SER A 105 11.145 9.166 -1.377 1.00 0.00 H new ATOM 1517 N LEU A 106 10.278 11.066 2.603 1.00 0.00 N ATOM 1518 CA LEU A 106 10.157 11.897 3.798 1.00 0.00 C ATOM 1519 C LEU A 106 10.497 13.353 3.467 1.00 0.00 C ATOM 1520 O LEU A 106 10.591 14.187 4.362 1.00 0.00 O ATOM 1521 CB LEU A 106 11.105 11.345 4.885 1.00 0.00 C ATOM 1522 CG LEU A 106 10.402 10.357 5.830 1.00 0.00 C ATOM 1523 CD1 LEU A 106 9.723 9.215 5.081 1.00 0.00 C ATOM 1524 CD2 LEU A 106 11.382 9.769 6.841 1.00 0.00 C ATOM 0 H LEU A 106 11.222 10.692 2.508 1.00 0.00 H new ATOM 0 HA LEU A 106 9.132 11.870 4.167 1.00 0.00 H new ATOM 0 HB2 LEU A 106 11.950 10.848 4.408 1.00 0.00 H new ATOM 0 HB3 LEU A 106 11.509 12.174 5.466 1.00 0.00 H new ATOM 0 HG LEU A 106 9.636 10.933 6.349 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.242 8.547 5.795 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.973 9.620 4.402 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.468 8.661 4.510 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.856 9.074 7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 106 12.176 9.240 6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 106 11.815 10.572 7.437 1.00 0.00 H new ATOM 1566 N HIS A 110 6.756 15.172 -0.758 1.00 0.00 N ATOM 1567 CA HIS A 110 6.053 13.898 -0.736 1.00 0.00 C ATOM 1568 C HIS A 110 5.732 13.416 0.680 1.00 0.00 C ATOM 1569 O HIS A 110 4.769 12.660 0.822 1.00 0.00 O ATOM 1570 CB HIS A 110 6.826 12.838 -1.539 1.00 0.00 C ATOM 1571 CG HIS A 110 6.733 12.971 -3.047 1.00 0.00 C ATOM 1572 ND1 HIS A 110 7.576 12.370 -3.957 1.00 0.00 N ATOM 1573 CD2 HIS A 110 5.702 13.525 -3.767 1.00 0.00 C ATOM 1574 CE1 HIS A 110 7.075 12.578 -5.186 1.00 0.00 C ATOM 1575 NE2 HIS A 110 5.928 13.268 -5.122 1.00 0.00 N ATOM 0 HA HIS A 110 5.089 14.058 -1.219 1.00 0.00 H new ATOM 0 HB2 HIS A 110 7.876 12.883 -1.251 1.00 0.00 H new ATOM 0 HB3 HIS A 110 6.459 11.852 -1.255 1.00 0.00 H new ATOM 0 HD1 HIS A 110 8.430 11.858 -3.736 1.00 0.00 H new ATOM 0 HD2 HIS A 110 4.862 14.066 -3.357 1.00 0.00 H new ATOM 0 HE1 HIS A 110 7.534 12.236 -6.101 1.00 0.00 H new ATOM 1583 N SER A 111 6.514 13.839 1.690 1.00 0.00 N ATOM 1584 CA SER A 111 6.522 13.344 3.076 1.00 0.00 C ATOM 1585 C SER A 111 5.481 12.257 3.356 1.00 0.00 C ATOM 1586 O SER A 111 4.324 12.571 3.638 1.00 0.00 O ATOM 1587 CB SER A 111 6.307 14.489 4.080 1.00 0.00 C ATOM 1588 OG SER A 111 6.206 13.987 5.403 1.00 0.00 O ATOM 0 H SER A 111 7.199 14.582 1.550 1.00 0.00 H new ATOM 0 HA SER A 111 7.509 12.900 3.203 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.135 15.195 4.016 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.400 15.037 3.824 1.00 0.00 H new ATOM 0 HG SER A 111 5.279 13.726 5.584 1.00 0.00 H new ATOM 1594 N ILE A 112 5.888 10.986 3.353 1.00 0.00 N ATOM 1595 CA ILE A 112 4.982 9.918 3.744 1.00 0.00 C ATOM 1596 C ILE A 112 4.573 10.029 5.214 1.00 0.00 C ATOM 1597 O ILE A 112 3.529 9.516 5.599 1.00 0.00 O ATOM 1598 CB ILE A 112 5.498 8.524 3.377 1.00 0.00 C ATOM 1599 CG1 ILE A 112 6.740 8.105 4.165 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.779 8.436 1.881 1.00 0.00 C ATOM 1601 CD1 ILE A 112 6.770 6.603 4.422 1.00 0.00 C ATOM 0 H ILE A 112 6.824 10.680 3.088 1.00 0.00 H new ATOM 0 HA ILE A 112 4.076 10.053 3.153 1.00 0.00 H new ATOM 0 HB ILE A 112 4.705 7.828 3.649 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.635 8.397 3.615 1.00 0.00 H new ATOM 0 HG13 ILE A 112 6.763 8.637 5.116 1.00 0.00 H new ATOM 0 HG21 ILE A 112 6.145 7.439 1.638 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.861 8.631 1.326 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.532 9.175 1.608 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.668 6.348 4.984 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.889 6.314 4.995 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.774 6.071 3.471 1.00 0.00 H new ATOM 1613 N ILE A 113 5.371 10.713 6.037 1.00 0.00 N ATOM 1614 CA ILE A 113 4.956 11.049 7.388 1.00 0.00 C ATOM 1615 C ILE A 113 3.722 11.928 7.237 1.00 0.00 C ATOM 1616 O ILE A 113 3.795 12.989 6.616 1.00 0.00 O ATOM 1617 CB ILE A 113 6.081 11.749 8.168 1.00 0.00 C ATOM 1618 CG1 ILE A 113 7.291 10.828 8.395 1.00 0.00 C ATOM 1619 CG2 ILE A 113 5.566 12.292 9.511 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.973 9.545 9.164 1.00 0.00 C ATOM 0 H ILE A 113 6.304 11.041 5.787 1.00 0.00 H new ATOM 0 HA ILE A 113 4.726 10.156 7.969 1.00 0.00 H new ATOM 0 HB ILE A 113 6.415 12.586 7.555 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.716 10.561 7.427 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.057 11.382 8.938 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.382 12.782 10.042 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.767 13.011 9.330 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.184 11.468 10.114 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.882 8.955 9.279 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.578 9.799 10.148 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.232 8.965 8.614 1.00 0.00 H new ATOM 1632 N GLY A 114 2.593 11.441 7.750 1.00 0.00 N ATOM 1633 CA GLY A 114 1.302 12.060 7.548 1.00 0.00 C ATOM 1634 C GLY A 114 0.679 11.714 6.192 1.00 0.00 C ATOM 1635 O GLY A 114 -0.022 12.536 5.604 1.00 0.00 O ATOM 0 H GLY A 114 2.558 10.597 8.322 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.626 11.746 8.343 1.00 0.00 H new ATOM 0 HA3 GLY A 114 1.407 13.142 7.628 1.00 0.00 H new ATOM 1639 N ARG A 115 0.900 10.493 5.691 1.00 0.00 N ATOM 1640 CA ARG A 115 0.094 9.908 4.628 1.00 0.00 C ATOM 1641 C ARG A 115 -0.800 8.792 5.157 1.00 0.00 C ATOM 1642 O ARG A 115 -0.470 8.136 6.147 1.00 0.00 O ATOM 1643 CB ARG A 115 1.006 9.356 3.537 1.00 0.00 C ATOM 1644 CG ARG A 115 1.602 10.443 2.648 1.00 0.00 C ATOM 1645 CD ARG A 115 0.545 11.208 1.848 1.00 0.00 C ATOM 1646 NE ARG A 115 0.215 12.485 2.500 1.00 0.00 N ATOM 1647 CZ ARG A 115 0.972 13.594 2.433 1.00 0.00 C ATOM 1648 NH1 ARG A 115 2.156 13.571 1.804 1.00 0.00 N ATOM 1649 NH2 ARG A 115 0.531 14.728 2.988 1.00 0.00 N ATOM 0 H ARG A 115 1.650 9.884 6.018 1.00 0.00 H new ATOM 0 HA ARG A 115 -0.545 10.691 4.219 1.00 0.00 H new ATOM 0 HB2 ARG A 115 1.814 8.790 4.000 1.00 0.00 H new ATOM 0 HB3 ARG A 115 0.441 8.658 2.919 1.00 0.00 H new ATOM 0 HG2 ARG A 115 2.160 11.146 3.267 1.00 0.00 H new ATOM 0 HG3 ARG A 115 2.314 9.990 1.958 1.00 0.00 H new ATOM 0 HD2 ARG A 115 0.912 11.395 0.839 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -0.355 10.600 1.753 1.00 0.00 H new ATOM 0 HE ARG A 115 -0.649 12.532 3.041 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.488 12.708 1.372 1.00 0.00 H new ATOM 0 HH12 ARG A 115 2.725 14.416 1.757 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -0.374 14.747 3.458 1.00 0.00 H new ATOM 0 HH22 ARG A 115 1.100 15.573 2.941 1.00 0.00 H new ATOM 1663 N THR A 116 -1.913 8.564 4.454 1.00 0.00 N ATOM 1664 CA THR A 116 -2.884 7.531 4.744 1.00 0.00 C ATOM 1665 C THR A 116 -2.579 6.295 3.892 1.00 0.00 C ATOM 1666 O THR A 116 -2.913 6.257 2.706 1.00 0.00 O ATOM 1667 CB THR A 116 -4.293 8.071 4.477 1.00 0.00 C ATOM 1668 OG1 THR A 116 -4.431 9.320 5.115 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.368 7.137 5.041 1.00 0.00 C ATOM 0 H THR A 116 -2.163 9.122 3.637 1.00 0.00 H new ATOM 0 HA THR A 116 -2.828 7.239 5.793 1.00 0.00 H new ATOM 0 HB THR A 116 -4.423 8.153 3.398 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.329 9.675 4.949 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.355 7.551 4.834 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.280 6.157 4.573 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.235 7.038 6.118 1.00 0.00 H new ATOM 1677 N LEU A 117 -1.950 5.278 4.481 1.00 0.00 N ATOM 1678 CA LEU A 117 -1.712 4.008 3.813 1.00 0.00 C ATOM 1679 C LEU A 117 -2.926 3.119 4.059 1.00 0.00 C ATOM 1680 O LEU A 117 -3.304 2.898 5.209 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.432 3.375 4.361 1.00 0.00 C ATOM 1682 CG LEU A 117 0.015 2.151 3.546 1.00 0.00 C ATOM 1683 CD1 LEU A 117 0.736 2.548 2.253 1.00 0.00 C ATOM 1684 CD2 LEU A 117 0.954 1.331 4.427 1.00 0.00 C ATOM 0 H LEU A 117 -1.593 5.316 5.436 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.577 4.144 2.740 1.00 0.00 H new ATOM 0 HB2 LEU A 117 0.365 4.118 4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.592 3.078 5.398 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.865 1.577 3.254 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.033 1.650 1.711 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.067 3.142 1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.622 3.135 2.496 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.292 0.452 3.879 1.00 0.00 H new ATOM 0 HD22 LEU A 117 1.815 1.938 4.705 1.00 0.00 H new ATOM 0 HD23 LEU A 117 0.426 1.017 5.327 1.00 0.00 H new ATOM 1696 N VAL A 118 -3.568 2.633 2.996 1.00 0.00 N ATOM 1697 CA VAL A 118 -4.803 1.870 3.115 1.00 0.00 C ATOM 1698 C VAL A 118 -4.660 0.570 2.326 1.00 0.00 C ATOM 1699 O VAL A 118 -4.087 0.572 1.232 1.00 0.00 O ATOM 1700 CB VAL A 118 -5.993 2.736 2.658 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.333 2.081 2.975 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -5.985 4.113 3.338 1.00 0.00 C ATOM 0 H VAL A 118 -3.246 2.758 2.036 1.00 0.00 H new ATOM 0 HA VAL A 118 -4.999 1.598 4.152 1.00 0.00 H new ATOM 0 HB VAL A 118 -5.878 2.844 1.580 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.143 2.727 2.635 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.397 1.119 2.466 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.418 1.928 4.051 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -6.839 4.695 2.991 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.048 3.985 4.419 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.063 4.637 3.088 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.157 -0.535 2.901 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.200 -1.831 2.243 1.00 0.00 C ATOM 1714 C VAL A 119 -6.601 -2.020 1.662 1.00 0.00 C ATOM 1715 O VAL A 119 -7.572 -1.477 2.188 1.00 0.00 O ATOM 1716 CB VAL A 119 -4.814 -2.958 3.218 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.823 -3.132 4.350 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.707 -4.308 2.509 1.00 0.00 C ATOM 0 H VAL A 119 -5.542 -0.545 3.845 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.471 -1.872 1.434 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.850 -2.654 3.625 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.499 -3.940 5.005 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -5.892 -2.206 4.922 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.800 -3.374 3.932 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.433 -5.077 3.231 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.667 -4.559 2.058 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.945 -4.251 1.732 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.713 -2.813 0.601 1.00 0.00 N ATOM 1729 CA HIS A 120 -7.980 -3.155 -0.031 1.00 0.00 C ATOM 1730 C HIS A 120 -8.298 -4.618 0.148 1.00 0.00 C ATOM 1731 O HIS A 120 -7.396 -5.434 0.304 1.00 0.00 O ATOM 1732 CB HIS A 120 -7.968 -2.804 -1.508 1.00 0.00 C ATOM 1733 CG HIS A 120 -7.984 -1.328 -1.712 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.069 -0.524 -1.926 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -6.844 -0.600 -1.709 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.614 0.711 -2.126 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.272 0.691 -2.012 1.00 0.00 N ATOM 0 H HIS A 120 -5.907 -3.244 0.148 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.757 -2.568 0.459 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.081 -3.229 -1.978 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.833 -3.251 -1.998 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.046 -0.816 -1.931 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -5.837 -0.940 -1.517 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.218 1.580 -2.343 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.591 -4.933 0.142 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.082 -6.279 0.310 1.00 0.00 C ATOM 1747 C GLU A 121 -9.715 -7.128 -0.902 1.00 0.00 C ATOM 1748 O GLU A 121 -9.065 -8.161 -0.754 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.579 -6.213 0.638 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.173 -7.573 1.020 1.00 0.00 C ATOM 1751 CD GLU A 121 -12.847 -8.224 -0.178 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -12.118 -8.873 -0.955 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -14.067 -8.008 -0.328 1.00 0.00 O ATOM 0 H GLU A 121 -10.331 -4.242 0.018 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.606 -6.784 1.151 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -11.734 -5.512 1.459 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.116 -5.818 -0.224 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.386 -8.225 1.399 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.897 -7.446 1.825 1.00 0.00 H new ATOM 1760 N LYS A 122 -10.046 -6.669 -2.103 1.00 0.00 N ATOM 1761 CA LYS A 122 -9.726 -7.433 -3.289 1.00 0.00 C ATOM 1762 C LYS A 122 -8.297 -7.108 -3.738 1.00 0.00 C ATOM 1763 O LYS A 122 -7.666 -6.148 -3.279 1.00 0.00 O ATOM 1764 CB LYS A 122 -10.773 -7.206 -4.389 1.00 0.00 C ATOM 1765 CG LYS A 122 -12.212 -7.212 -3.845 1.00 0.00 C ATOM 1766 CD LYS A 122 -13.273 -6.889 -4.905 1.00 0.00 C ATOM 1767 CE LYS A 122 -13.306 -7.900 -6.060 1.00 0.00 C ATOM 1768 NZ LYS A 122 -12.328 -7.575 -7.122 1.00 0.00 N ATOM 0 H LYS A 122 -10.528 -5.786 -2.274 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.761 -8.498 -3.062 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.578 -6.253 -4.880 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -10.672 -7.982 -5.148 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.425 -8.192 -3.417 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.288 -6.487 -3.035 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -14.254 -6.859 -4.430 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -13.083 -5.894 -5.308 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -13.099 -8.897 -5.672 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -14.308 -7.926 -6.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.834 -7.273 -7.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.706 -6.807 -6.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -11.755 -8.416 -7.336 1.00 0.00 H new ATOM 1782 N ALA A 123 -7.793 -7.929 -4.657 1.00 0.00 N ATOM 1783 CA ALA A 123 -6.517 -7.713 -5.305 1.00 0.00 C ATOM 1784 C ALA A 123 -6.581 -6.431 -6.127 1.00 0.00 C ATOM 1785 O ALA A 123 -7.572 -6.195 -6.815 1.00 0.00 O ATOM 1786 CB ALA A 123 -6.228 -8.899 -6.225 1.00 0.00 C ATOM 0 H ALA A 123 -8.272 -8.773 -4.971 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.727 -7.623 -4.559 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -5.269 -8.750 -6.720 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -6.194 -9.816 -5.637 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -7.015 -8.978 -6.975 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.520 -5.627 -6.080 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.316 -4.554 -7.029 1.00 0.00 C ATOM 1794 C ASP A 124 -4.943 -5.174 -8.379 1.00 0.00 C ATOM 1795 O ASP A 124 -3.909 -5.839 -8.478 1.00 0.00 O ATOM 1796 CB ASP A 124 -4.199 -3.660 -6.491 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.942 -2.477 -7.388 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -4.416 -2.478 -8.537 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.290 -1.527 -6.920 1.00 0.00 O ATOM 0 H ASP A 124 -4.783 -5.708 -5.380 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.213 -3.950 -7.165 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.465 -3.308 -5.494 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.284 -4.244 -6.390 1.00 0.00 H new ATOM 1804 N ASP A 125 -5.791 -4.960 -9.391 1.00 0.00 N ATOM 1805 CA ASP A 125 -5.599 -5.397 -10.768 1.00 0.00 C ATOM 1806 C ASP A 125 -4.560 -4.580 -11.537 1.00 0.00 C ATOM 1807 O ASP A 125 -4.330 -4.869 -12.706 1.00 0.00 O ATOM 1808 CB ASP A 125 -6.949 -5.480 -11.513 1.00 0.00 C ATOM 1809 CG ASP A 125 -7.557 -4.143 -11.940 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -6.797 -3.233 -12.329 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -8.800 -4.033 -11.918 1.00 0.00 O ATOM 0 H ASP A 125 -6.667 -4.454 -9.261 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.179 -6.401 -10.716 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -6.815 -6.097 -12.402 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.665 -5.995 -10.872 1.00 0.00 H new ATOM 1816 N LEU A 126 -3.943 -3.566 -10.928 1.00 0.00 N ATOM 1817 CA LEU A 126 -2.995 -2.664 -11.566 1.00 0.00 C ATOM 1818 C LEU A 126 -3.485 -2.159 -12.925 1.00 0.00 C ATOM 1819 O LEU A 126 -2.762 -2.132 -13.918 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.593 -3.275 -11.646 1.00 0.00 C ATOM 1821 CG LEU A 126 -0.827 -3.376 -10.319 1.00 0.00 C ATOM 1822 CD1 LEU A 126 -0.971 -2.145 -9.425 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -1.118 -4.626 -9.494 1.00 0.00 C ATOM 0 H LEU A 126 -4.098 -3.347 -9.944 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.924 -1.785 -10.925 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.678 -4.275 -12.071 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.999 -2.682 -12.342 1.00 0.00 H new ATOM 0 HG LEU A 126 0.205 -3.444 -10.663 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.402 -2.293 -8.507 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.592 -1.268 -9.950 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.022 -1.995 -9.179 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.529 -4.602 -8.577 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.178 -4.658 -9.243 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.855 -5.512 -10.071 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.734 -1.719 -12.944 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.373 -1.121 -14.099 1.00 0.00 C ATOM 1837 C GLY A 127 -5.669 -2.141 -15.195 1.00 0.00 C ATOM 1838 O GLY A 127 -6.153 -1.748 -16.256 1.00 0.00 O ATOM 0 H GLY A 127 -5.346 -1.771 -12.130 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.303 -0.644 -13.790 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -4.731 -0.337 -14.500 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.425 -3.437 -14.964 1.00 0.00 N ATOM 1843 CA LYS A 128 -5.606 -4.455 -15.989 1.00 0.00 C ATOM 1844 C LYS A 128 -7.093 -4.701 -16.276 1.00 0.00 C ATOM 1845 O LYS A 128 -7.413 -5.333 -17.279 1.00 0.00 O ATOM 1846 CB LYS A 128 -4.841 -5.740 -15.632 1.00 0.00 C ATOM 1847 CG LYS A 128 -3.326 -5.474 -15.476 1.00 0.00 C ATOM 1848 CD LYS A 128 -2.424 -6.342 -16.366 1.00 0.00 C ATOM 1849 CE LYS A 128 -2.173 -7.737 -15.774 1.00 0.00 C ATOM 1850 NZ LYS A 128 -3.421 -8.499 -15.575 1.00 0.00 N ATOM 0 H LYS A 128 -5.100 -3.800 -14.068 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.175 -4.086 -16.920 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -5.236 -6.154 -14.704 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -5.002 -6.488 -16.408 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.131 -4.425 -15.699 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -3.048 -5.636 -14.434 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -2.883 -6.446 -17.349 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -1.469 -5.836 -16.512 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -1.512 -8.296 -16.436 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -1.657 -7.636 -14.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -3.193 -9.499 -15.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -3.935 -8.115 -14.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -4.015 -8.420 -16.425 1.00 0.00 H new ATOM 1864 N GLY A 129 -8.003 -4.193 -15.433 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.421 -4.139 -15.768 1.00 0.00 C ATOM 1866 C GLY A 129 -9.647 -3.202 -16.956 1.00 0.00 C ATOM 1867 O GLY A 129 -10.269 -3.580 -17.945 1.00 0.00 O ATOM 0 H GLY A 129 -7.775 -3.814 -14.514 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -9.784 -5.138 -16.009 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -9.993 -3.792 -14.907 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.125 -1.976 -16.862 1.00 0.00 N ATOM 1872 CA GLY A 130 -9.230 -0.968 -17.906 1.00 0.00 C ATOM 1873 C GLY A 130 -10.642 -0.390 -17.939 1.00 0.00 C ATOM 1874 O GLY A 130 -11.339 -0.506 -18.944 1.00 0.00 O ATOM 0 H GLY A 130 -8.610 -1.656 -16.042 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -8.507 -0.172 -17.727 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -8.987 -1.408 -18.873 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.074 0.230 -16.833 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.465 0.653 -16.672 1.00 0.00 C ATOM 1880 C ASN A 131 -12.705 1.730 -15.619 1.00 0.00 C ATOM 1881 O ASN A 131 -13.601 1.569 -14.792 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.405 -0.555 -16.502 1.00 0.00 C ATOM 1883 CG ASN A 131 -12.891 -1.455 -15.396 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -12.596 -0.889 -14.232 1.00 0.00 O flip ATOM 1885 ND2 ASN A 131 -12.628 -2.632 -15.604 1.00 0.00 N flip ATOM 0 H ASN A 131 -10.476 0.449 -16.036 1.00 0.00 H new ATOM 0 HA ASN A 131 -12.714 1.151 -17.609 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.413 -0.213 -16.266 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -13.468 -1.112 -17.437 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -12.860 -3.055 -16.503 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -12.177 -3.190 -14.879 1.00 0.00 H new ATOM 1892 N GLU A 132 -11.914 2.805 -15.623 1.00 0.00 N ATOM 1893 CA GLU A 132 -11.943 3.858 -14.609 1.00 0.00 C ATOM 1894 C GLU A 132 -11.678 3.301 -13.215 1.00 0.00 C ATOM 1895 O GLU A 132 -10.609 3.531 -12.679 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.228 4.697 -14.615 1.00 0.00 C ATOM 1897 CG GLU A 132 -13.314 5.681 -15.785 1.00 0.00 C ATOM 1898 CD GLU A 132 -14.286 6.805 -15.444 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -15.363 6.474 -14.903 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -13.906 7.972 -15.670 1.00 0.00 O ATOM 0 H GLU A 132 -11.218 2.970 -16.350 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.134 4.535 -14.882 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.088 4.028 -14.650 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.294 5.252 -13.679 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.328 6.093 -15.999 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.645 5.162 -16.685 1.00 0.00 H new ATOM 1907 N GLN A 133 -12.624 2.584 -12.613 1.00 0.00 N ATOM 1908 CA GLN A 133 -12.501 2.034 -11.276 1.00 0.00 C ATOM 1909 C GLN A 133 -11.165 1.295 -11.109 1.00 0.00 C ATOM 1910 O GLN A 133 -10.370 1.643 -10.257 1.00 0.00 O ATOM 1911 CB GLN A 133 -13.722 1.155 -10.944 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.347 1.575 -9.607 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.308 1.665 -8.500 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.113 2.719 -7.900 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -12.582 0.576 -8.300 1.00 0.00 N ATOM 0 H GLN A 133 -13.517 2.367 -13.057 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.492 2.849 -10.552 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -14.463 1.238 -11.739 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.421 0.109 -10.897 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -14.838 2.541 -9.723 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.117 0.857 -9.325 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -12.784 -0.275 -8.824 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -11.820 0.588 -7.622 1.00 0.00 H new ATOM 1924 N SER A 134 -10.891 0.297 -11.943 1.00 0.00 N ATOM 1925 CA SER A 134 -9.576 -0.323 -12.093 1.00 0.00 C ATOM 1926 C SER A 134 -8.505 0.733 -12.353 1.00 0.00 C ATOM 1927 O SER A 134 -7.550 0.860 -11.597 1.00 0.00 O ATOM 1928 CB SER A 134 -9.540 -1.378 -13.202 1.00 0.00 C ATOM 1929 OG SER A 134 -9.830 -0.787 -14.457 1.00 0.00 O ATOM 0 H SER A 134 -11.598 -0.116 -12.552 1.00 0.00 H new ATOM 0 HA SER A 134 -9.368 -0.831 -11.151 1.00 0.00 H new ATOM 0 HB2 SER A 134 -8.557 -1.848 -13.233 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.263 -2.165 -12.988 1.00 0.00 H new ATOM 0 HG SER A 134 -10.766 -0.498 -14.474 1.00 0.00 H new ATOM 1935 N THR A 135 -8.693 1.519 -13.411 1.00 0.00 N ATOM 1936 CA THR A 135 -7.736 2.477 -13.939 1.00 0.00 C ATOM 1937 C THR A 135 -7.450 3.635 -12.969 1.00 0.00 C ATOM 1938 O THR A 135 -6.585 4.468 -13.231 1.00 0.00 O ATOM 1939 CB THR A 135 -8.304 2.955 -15.283 1.00 0.00 C ATOM 1940 OG1 THR A 135 -8.982 1.869 -15.897 1.00 0.00 O ATOM 1941 CG2 THR A 135 -7.219 3.462 -16.231 1.00 0.00 C ATOM 0 H THR A 135 -9.561 1.501 -13.946 1.00 0.00 H new ATOM 0 HA THR A 135 -6.762 2.008 -14.076 1.00 0.00 H new ATOM 0 HB THR A 135 -8.979 3.788 -15.084 1.00 0.00 H new ATOM 0 HG1 THR A 135 -9.353 2.159 -16.757 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.676 3.787 -17.166 1.00 0.00 H new ATOM 0 HG22 THR A 135 -6.697 4.301 -15.771 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.509 2.660 -16.434 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.156 3.663 -11.842 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.044 4.583 -10.739 1.00 0.00 C ATOM 1951 C LYS A 136 -7.694 3.811 -9.464 1.00 0.00 C ATOM 1952 O LYS A 136 -7.063 4.407 -8.593 1.00 0.00 O ATOM 1953 CB LYS A 136 -9.408 5.263 -10.587 1.00 0.00 C ATOM 1954 CG LYS A 136 -9.497 6.295 -9.457 1.00 0.00 C ATOM 1955 CD LYS A 136 -10.869 6.988 -9.468 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.041 6.025 -9.185 1.00 0.00 C ATOM 1957 NZ LYS A 136 -13.348 6.705 -9.296 1.00 0.00 N ATOM 0 H LYS A 136 -8.887 2.972 -11.673 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.262 5.322 -10.915 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -9.659 5.754 -11.527 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.163 4.495 -10.417 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -9.338 5.806 -8.496 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -8.707 7.037 -9.571 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -10.873 7.783 -8.722 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.022 7.460 -10.438 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.004 5.191 -9.886 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -11.933 5.605 -8.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.111 6.026 -9.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.393 7.485 -8.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -13.462 7.084 -10.258 1.00 0.00 H new ATOM 1971 N THR A 137 -8.121 2.542 -9.305 1.00 0.00 N ATOM 1972 CA THR A 137 -7.917 1.857 -8.011 1.00 0.00 C ATOM 1973 C THR A 137 -7.371 0.441 -8.121 1.00 0.00 C ATOM 1974 O THR A 137 -6.558 0.023 -7.299 1.00 0.00 O ATOM 1975 CB THR A 137 -9.156 1.880 -7.095 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.024 0.790 -7.329 1.00 0.00 O ATOM 1977 CG2 THR A 137 -9.939 3.192 -7.149 1.00 0.00 C ATOM 0 H THR A 137 -8.590 1.989 -10.022 1.00 0.00 H new ATOM 0 HA THR A 137 -7.140 2.460 -7.540 1.00 0.00 H new ATOM 0 HB THR A 137 -8.748 1.789 -6.088 1.00 0.00 H new ATOM 0 HG1 THR A 137 -10.366 0.455 -6.474 1.00 0.00 H new ATOM 0 HG21 THR A 137 -10.796 3.132 -6.478 1.00 0.00 H new ATOM 0 HG22 THR A 137 -9.293 4.014 -6.840 1.00 0.00 H new ATOM 0 HG23 THR A 137 -10.287 3.367 -8.167 1.00 0.00 H new ATOM 1985 N GLY A 138 -7.916 -0.314 -9.068 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.509 -1.662 -9.410 1.00 0.00 C ATOM 1987 C GLY A 138 -8.609 -2.684 -9.150 1.00 0.00 C ATOM 1988 O GLY A 138 -8.300 -3.833 -8.860 1.00 0.00 O ATOM 0 H GLY A 138 -8.690 0.018 -9.643 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.225 -1.697 -10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.624 -1.929 -8.832 1.00 0.00 H new ATOM 1992 N ASN A 139 -9.888 -2.270 -9.131 1.00 0.00 N ATOM 1993 CA ASN A 139 -10.995 -3.167 -8.788 1.00 0.00 C ATOM 1994 C ASN A 139 -10.785 -3.801 -7.399 1.00 0.00 C ATOM 1995 O ASN A 139 -11.368 -4.834 -7.062 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.195 -4.230 -9.882 1.00 0.00 C ATOM 1997 CG ASN A 139 -12.540 -4.942 -9.762 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -12.640 -6.042 -9.222 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -13.606 -4.325 -10.261 1.00 0.00 N ATOM 0 H ASN A 139 -10.177 -1.317 -9.350 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.910 -2.578 -8.735 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -11.123 -3.757 -10.862 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -10.392 -4.964 -9.823 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -14.525 -4.764 -10.199 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -13.505 -3.413 -10.706 1.00 0.00 H new ATOM 2006 N ALA A 140 -9.954 -3.147 -6.578 1.00 0.00 N ATOM 2007 CA ALA A 140 -9.513 -3.632 -5.285 1.00 0.00 C ATOM 2008 C ALA A 140 -10.658 -3.557 -4.267 1.00 0.00 C ATOM 2009 O ALA A 140 -10.633 -4.215 -3.231 1.00 0.00 O ATOM 2010 CB ALA A 140 -8.280 -2.831 -4.860 1.00 0.00 C ATOM 0 H ALA A 140 -9.562 -2.235 -6.813 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.229 -4.683 -5.342 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -7.935 -3.183 -3.888 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -7.488 -2.964 -5.597 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.538 -1.774 -4.792 1.00 0.00 H new ATOM 2016 N GLY A 141 -11.687 -2.762 -4.574 1.00 0.00 N ATOM 2017 CA GLY A 141 -12.903 -2.722 -3.793 1.00 0.00 C ATOM 2018 C GLY A 141 -12.692 -1.991 -2.472 1.00 0.00 C ATOM 2019 O GLY A 141 -11.788 -1.160 -2.327 1.00 0.00 O ATOM 0 H GLY A 141 -11.689 -2.131 -5.375 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -13.688 -2.226 -4.364 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.245 -3.738 -3.598 1.00 0.00 H new ATOM 2023 N SER A 142 -13.569 -2.295 -1.513 1.00 0.00 N ATOM 2024 CA SER A 142 -13.569 -1.662 -0.207 1.00 0.00 C ATOM 2025 C SER A 142 -12.274 -1.953 0.551 1.00 0.00 C ATOM 2026 O SER A 142 -11.525 -2.881 0.237 1.00 0.00 O ATOM 2027 CB SER A 142 -14.807 -2.089 0.584 1.00 0.00 C ATOM 2028 OG SER A 142 -15.954 -1.559 -0.048 1.00 0.00 O ATOM 0 H SER A 142 -14.302 -2.994 -1.629 1.00 0.00 H new ATOM 0 HA SER A 142 -13.614 -0.581 -0.342 1.00 0.00 H new ATOM 0 HB2 SER A 142 -14.869 -3.176 0.630 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.742 -1.730 1.611 1.00 0.00 H new ATOM 0 HG SER A 142 -16.755 -1.827 0.449 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.003 -1.103 1.537 1.00 0.00 N ATOM 2035 CA ARG A 143 -10.763 -1.090 2.283 1.00 0.00 C ATOM 2036 C ARG A 143 -10.925 -1.935 3.543 1.00 0.00 C ATOM 2037 O ARG A 143 -11.651 -1.527 4.444 1.00 0.00 O ATOM 2038 CB ARG A 143 -10.389 0.364 2.586 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.314 1.186 1.281 1.00 0.00 C ATOM 2040 CD ARG A 143 -11.330 2.339 1.291 1.00 0.00 C ATOM 2041 NE ARG A 143 -11.628 2.804 -0.070 1.00 0.00 N ATOM 2042 CZ ARG A 143 -12.495 3.787 -0.369 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -13.025 4.544 0.600 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -12.831 3.994 -1.648 1.00 0.00 N ATOM 0 H ARG A 143 -12.662 -0.387 1.842 1.00 0.00 H new ATOM 0 HA ARG A 143 -9.948 -1.528 1.707 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.127 0.803 3.258 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -9.429 0.399 3.101 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -9.308 1.586 1.157 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -10.506 0.536 0.427 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -12.250 2.011 1.774 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -10.937 3.167 1.882 1.00 0.00 H new ATOM 0 HE ARG A 143 -11.143 2.349 -0.843 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -12.772 4.377 1.574 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -13.682 5.288 0.364 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -12.430 3.409 -2.382 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -13.488 4.736 -1.889 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.276 -3.108 3.615 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.333 -3.925 4.826 1.00 0.00 C ATOM 2060 C LEU A 144 -9.836 -3.117 6.036 1.00 0.00 C ATOM 2061 O LEU A 144 -10.388 -3.250 7.126 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.501 -5.225 4.722 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.142 -6.530 4.192 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -9.283 -7.721 4.626 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.575 -6.746 4.692 1.00 0.00 C ATOM 0 H LEU A 144 -9.716 -3.503 2.859 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.378 -4.208 4.952 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.643 -5.007 4.086 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.113 -5.439 5.718 1.00 0.00 H new ATOM 0 HG LEU A 144 -10.188 -6.444 3.106 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -9.728 -8.645 4.256 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -8.278 -7.613 4.217 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.230 -7.754 5.714 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.966 -7.678 4.284 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -11.577 -6.798 5.781 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -12.203 -5.916 4.367 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.775 -2.318 5.861 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.165 -1.559 6.942 1.00 0.00 C ATOM 2079 C ALA A 145 -7.415 -0.349 6.388 1.00 0.00 C ATOM 2080 O ALA A 145 -7.103 -0.288 5.195 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.245 -2.461 7.771 1.00 0.00 C ATOM 0 H ALA A 145 -8.319 -2.185 4.958 1.00 0.00 H new ATOM 0 HA ALA A 145 -8.950 -1.187 7.601 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.795 -1.880 8.576 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.825 -3.281 8.195 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.459 -2.865 7.132 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.166 0.624 7.265 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.755 1.977 6.932 1.00 0.00 C ATOM 2089 C CYS A 146 -5.756 2.376 8.016 1.00 0.00 C ATOM 2090 O CYS A 146 -5.952 2.014 9.174 1.00 0.00 O ATOM 2091 CB CYS A 146 -7.994 2.907 6.882 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.593 2.096 6.539 1.00 0.00 S ATOM 0 H CYS A 146 -7.251 0.478 8.271 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.291 2.053 5.949 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -8.071 3.428 7.837 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -7.823 3.666 6.118 1.00 0.00 H new ATOM 0 HG CYS A 146 -10.539 2.988 6.528 1.00 0.00 H new ATOM 2097 N GLY A 147 -4.653 3.039 7.664 1.00 0.00 N ATOM 2098 CA GLY A 147 -3.644 3.430 8.635 1.00 0.00 C ATOM 2099 C GLY A 147 -2.973 4.734 8.233 1.00 0.00 C ATOM 2100 O GLY A 147 -2.910 5.072 7.052 1.00 0.00 O ATOM 0 H GLY A 147 -4.440 3.315 6.706 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.104 3.542 9.617 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -2.894 2.643 8.722 1.00 0.00 H new ATOM 2104 N VAL A 148 -2.463 5.463 9.227 1.00 0.00 N ATOM 2105 CA VAL A 148 -1.748 6.713 9.034 1.00 0.00 C ATOM 2106 C VAL A 148 -0.277 6.479 9.363 1.00 0.00 C ATOM 2107 O VAL A 148 0.038 5.795 10.336 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.396 7.826 9.877 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -2.270 7.594 11.389 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -1.806 9.191 9.505 1.00 0.00 C ATOM 0 H VAL A 148 -2.540 5.190 10.207 1.00 0.00 H new ATOM 0 HA VAL A 148 -1.807 7.049 7.999 1.00 0.00 H new ATOM 0 HB VAL A 148 -3.461 7.807 9.644 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -2.747 8.415 11.924 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -2.757 6.656 11.655 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -1.216 7.546 11.663 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.275 9.967 10.110 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -0.732 9.186 9.690 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.991 9.392 8.450 1.00 0.00 H new ATOM 2120 N ILE A 149 0.617 7.006 8.531 1.00 0.00 N ATOM 2121 CA ILE A 149 2.053 6.866 8.698 1.00 0.00 C ATOM 2122 C ILE A 149 2.558 7.951 9.655 1.00 0.00 C ATOM 2123 O ILE A 149 2.304 9.136 9.430 1.00 0.00 O ATOM 2124 CB ILE A 149 2.719 6.977 7.318 1.00 0.00 C ATOM 2125 CG1 ILE A 149 2.328 5.803 6.400 1.00 0.00 C ATOM 2126 CG2 ILE A 149 4.249 7.022 7.445 1.00 0.00 C ATOM 2127 CD1 ILE A 149 2.310 6.187 4.924 1.00 0.00 C ATOM 0 H ILE A 149 0.355 7.551 7.709 1.00 0.00 H new ATOM 0 HA ILE A 149 2.303 5.896 9.128 1.00 0.00 H new ATOM 0 HB ILE A 149 2.362 7.906 6.873 1.00 0.00 H new ATOM 0 HG12 ILE A 149 3.030 4.982 6.549 1.00 0.00 H new ATOM 0 HG13 ILE A 149 1.343 5.436 6.687 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.694 7.101 6.453 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.539 7.886 8.043 1.00 0.00 H new ATOM 0 HG23 ILE A 149 4.601 6.111 7.929 1.00 0.00 H new ATOM 0 HD11 ILE A 149 2.028 5.320 4.326 1.00 0.00 H new ATOM 0 HD12 ILE A 149 1.588 6.988 4.765 1.00 0.00 H new ATOM 0 HD13 ILE A 149 3.301 6.527 4.624 1.00 0.00 H new ATOM 2139 N GLY A 150 3.307 7.556 10.691 1.00 0.00 N ATOM 2140 CA GLY A 150 3.911 8.440 11.675 1.00 0.00 C ATOM 2141 C GLY A 150 5.308 7.937 12.039 1.00 0.00 C ATOM 2142 O GLY A 150 5.798 6.968 11.465 1.00 0.00 O ATOM 0 H GLY A 150 3.512 6.573 10.867 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.972 9.453 11.277 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.287 8.485 12.568 1.00 0.00 H new ATOM 2146 N ILE A 151 5.958 8.611 12.985 1.00 0.00 N ATOM 2147 CA ILE A 151 7.271 8.275 13.503 1.00 0.00 C ATOM 2148 C ILE A 151 7.169 7.006 14.349 1.00 0.00 C ATOM 2149 O ILE A 151 6.208 6.829 15.092 1.00 0.00 O ATOM 2150 CB ILE A 151 7.791 9.462 14.333 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.703 10.773 13.520 1.00 0.00 C ATOM 2152 CG2 ILE A 151 9.238 9.218 14.787 1.00 0.00 C ATOM 2153 CD1 ILE A 151 6.578 11.701 13.995 1.00 0.00 C ATOM 0 H ILE A 151 5.562 9.441 13.427 1.00 0.00 H new ATOM 0 HA ILE A 151 7.971 8.084 12.690 1.00 0.00 H new ATOM 0 HB ILE A 151 7.162 9.556 15.218 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.654 11.301 13.589 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.547 10.532 12.469 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.584 10.070 15.372 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.280 8.317 15.399 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.877 9.094 13.913 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.569 12.604 13.384 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.620 11.189 13.901 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.744 11.970 15.038 1.00 0.00 H new ATOM 2165 N ALA A 152 8.160 6.123 14.236 1.00 0.00 N ATOM 2166 CA ALA A 152 8.214 4.883 15.001 1.00 0.00 C ATOM 2167 C ALA A 152 8.897 5.098 16.356 1.00 0.00 C ATOM 2168 O ALA A 152 9.880 4.422 16.665 1.00 0.00 O ATOM 2169 CB ALA A 152 8.925 3.804 14.182 1.00 0.00 C ATOM 0 H ALA A 152 8.952 6.251 13.606 1.00 0.00 H new ATOM 0 HA ALA A 152 7.196 4.550 15.206 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.964 2.878 14.756 1.00 0.00 H new ATOM 0 HB2 ALA A 152 8.379 3.633 13.254 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.939 4.131 13.952 1.00 0.00 H new ATOM 2175 N GLN A 153 8.375 6.013 17.172 1.00 0.00 N ATOM 2176 CA GLN A 153 8.728 6.143 18.574 1.00 0.00 C ATOM 2177 C GLN A 153 7.550 6.853 19.236 1.00 0.00 C ATOM 2178 O GLN A 153 7.438 6.754 20.476 1.00 0.00 O ATOM 2179 CB GLN A 153 10.036 6.931 18.759 1.00 0.00 C ATOM 2180 CG GLN A 153 10.710 6.521 20.078 1.00 0.00 C ATOM 2181 CD GLN A 153 11.504 7.657 20.716 1.00 0.00 C ATOM 2182 OE1 GLN A 153 10.943 8.660 21.143 1.00 0.00 O ATOM 2183 NE2 GLN A 153 12.824 7.518 20.819 1.00 0.00 N ATOM 2184 OXT GLN A 153 6.778 7.471 18.467 1.00 0.00 O ATOM 0 H GLN A 153 7.682 6.695 16.865 1.00 0.00 H new ATOM 0 HA GLN A 153 8.909 5.168 19.026 1.00 0.00 H new ATOM 0 HB2 GLN A 153 10.708 6.740 17.922 1.00 0.00 H new ATOM 0 HB3 GLN A 153 9.829 8.001 18.763 1.00 0.00 H new ATOM 0 HG2 GLN A 153 9.948 6.178 20.778 1.00 0.00 H new ATOM 0 HG3 GLN A 153 11.376 5.678 19.894 1.00 0.00 H new ATOM 0 HE21 GLN A 153 13.278 6.678 20.460 1.00 0.00 H new ATOM 0 HE22 GLN A 153 13.381 8.251 21.257 1.00 0.00 H new