USER MOD reduce.3.24.130724 H: found=0, std=0, add=1220, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1218 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 74 CYS SG : rot 159:sc= -2.67 USER MOD Set 1.2: A 75 SER OG : rot 99:sc= 0.0356 USER MOD Set 2.1: A 67 SER OG : rot 164:sc= 1.25 USER MOD Set 2.2: A 70 THR OG1 : rot 164:sc= -0.242 USER MOD Set 3.1: A 28 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 61 TYR OH : rot -170:sc= 0.926 USER MOD Set 3.3: A 63 HIS : no HD1:sc= 0.518 K(o=1.4,f=-3.8!) USER MOD Single : A 19 GLN : amide:sc= -0.256 X(o=-0.26,f=-0.26) USER MOD Single : A 21 THR OG1 : rot -27:sc= -0.0814 USER MOD Single : A 25 SER OG : rot 180:sc= -0.869 USER MOD Single : A 26 SER OG : rot -33:sc= 1.06 USER MOD Single : A 31 CYS SG : rot 180:sc= 0 USER MOD Single : A 32 HIS :FLIP+bothHN:sc= -1.75 F(o=-2.8,f=-1.7) USER MOD Single : A 39 SER OG : rot -119:sc= 1.19 USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.845) USER MOD Single : A 56 LYS NZ :NH3+ 145:sc= -1.11 (180deg=-3.19!) USER MOD Single : A 64 HIS : no HD1:sc= -3.27! C(o=-3.3!,f=-3.6!) USER MOD Single : A 71 ASN : amide:sc= -6.93! C(o=-6.9!,f=-12!) USER MOD Single : A 76 GLN : amide:sc= -0.373 K(o=-0.37,f=-3.4!) USER MOD Single : A 77 MET CE :methyl 171:sc= -3.61 (180deg=-3.96) USER MOD Single : A 79 CYS SG : rot -159:sc= -0.663 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot -118:sc= -0.113 USER MOD Single : A 89 GLN : amide:sc= -0.0286 X(o=-0.029,f=0) USER MOD Single : A 90 ASN :FLIP amide:sc= -1.18 F(o=-2!,f=-1.2) USER MOD Single : A 93 THR OG1 : rot -100:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0242 USER MOD Single : A 100 LYS NZ :NH3+ 163:sc= -0.0279 (180deg=-0.246) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.377 X(o=-0.38,f=0) USER MOD Single : A 109 THR OG1 : rot 59:sc= 1.09 USER MOD Single : A 110 MET CE :methyl -151:sc= -0.344 (180deg=-1.95!) USER MOD Single : A 111 CYS SG : rot -23:sc= -1.68! USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.00631 USER MOD Single : A 125 THR OG1 : rot -19:sc= 0.757 USER MOD Single : A 126 GLN : amide:sc= -0.0837 K(o=-0.084,f=-2.5!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.841 K(o=-0.84,f=-2.4!) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 148 ASN : amide:sc= -3.02! C(o=-3!,f=-3.9!) USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 153 ASN : amide:sc= -1.19 K(o=-1.2,f=-3.4!) USER MOD Single : A 154 THR OG1 : rot -156:sc= -1.34 USER MOD Single : A 155 THR OG1 : rot 180:sc= -0.733 USER MOD Single : A 160 MET CE :methyl 166:sc= -2.39! (180deg=-3.51!) USER MOD Single : A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 167 MET CE :methyl -149:sc= -0.104 (180deg=-1.28!) USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N GLU A 13 1.718 -13.474 7.359 1.00 0.00 N ATOM 70 CA GLU A 13 2.435 -12.494 6.552 1.00 0.00 C ATOM 71 C GLU A 13 3.099 -11.442 7.436 1.00 0.00 C ATOM 72 O GLU A 13 4.312 -11.244 7.381 1.00 0.00 O ATOM 73 CB GLU A 13 1.482 -11.818 5.564 1.00 0.00 C ATOM 74 CG GLU A 13 2.191 -11.092 4.434 1.00 0.00 C ATOM 75 CD GLU A 13 3.089 -9.976 4.930 1.00 0.00 C ATOM 76 OE1 GLU A 13 4.275 -10.249 5.212 1.00 0.00 O ATOM 77 OE2 GLU A 13 2.607 -8.829 5.038 1.00 0.00 O ATOM 0 HA GLU A 13 3.212 -13.019 5.995 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.818 -12.571 5.140 1.00 0.00 H new ATOM 0 HB3 GLU A 13 0.856 -11.108 6.104 1.00 0.00 H new ATOM 0 HG2 GLU A 13 2.786 -11.806 3.865 1.00 0.00 H new ATOM 0 HG3 GLU A 13 1.449 -10.679 3.750 1.00 0.00 H new ATOM 84 N GLY A 14 2.293 -10.768 8.251 1.00 0.00 N ATOM 85 CA GLY A 14 2.818 -9.744 9.135 1.00 0.00 C ATOM 86 C GLY A 14 4.175 -10.110 9.704 1.00 0.00 C ATOM 87 O GLY A 14 5.167 -9.427 9.450 1.00 0.00 O ATOM 0 H GLY A 14 1.285 -10.913 8.315 1.00 0.00 H new ATOM 0 HA2 GLY A 14 2.898 -8.804 8.590 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.117 -9.580 9.953 1.00 0.00 H new ATOM 91 N ASP A 15 4.218 -11.189 10.477 1.00 0.00 N ATOM 92 CA ASP A 15 5.463 -11.645 11.085 1.00 0.00 C ATOM 93 C ASP A 15 6.640 -11.434 10.136 1.00 0.00 C ATOM 94 O ASP A 15 7.618 -10.773 10.482 1.00 0.00 O ATOM 95 CB ASP A 15 5.359 -13.122 11.468 1.00 0.00 C ATOM 96 CG ASP A 15 6.380 -13.522 12.514 1.00 0.00 C ATOM 97 OD1 ASP A 15 6.118 -13.298 13.714 1.00 0.00 O ATOM 98 OD2 ASP A 15 7.442 -14.059 12.133 1.00 0.00 O ATOM 0 H ASP A 15 3.405 -11.765 10.698 1.00 0.00 H new ATOM 0 HA ASP A 15 5.635 -11.056 11.986 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.357 -13.327 11.845 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.496 -13.736 10.578 1.00 0.00 H new ATOM 103 N ALA A 16 6.537 -12.003 8.940 1.00 0.00 N ATOM 104 CA ALA A 16 7.592 -11.877 7.941 1.00 0.00 C ATOM 105 C ALA A 16 8.099 -10.442 7.857 1.00 0.00 C ATOM 106 O ALA A 16 9.304 -10.194 7.916 1.00 0.00 O ATOM 107 CB ALA A 16 7.090 -12.343 6.582 1.00 0.00 C ATOM 0 H ALA A 16 5.734 -12.556 8.639 1.00 0.00 H new ATOM 0 HA ALA A 16 8.425 -12.511 8.245 1.00 0.00 H new ATOM 0 HB1 ALA A 16 7.888 -12.243 5.846 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.783 -13.387 6.646 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.239 -11.733 6.280 1.00 0.00 H new ATOM 113 N LEU A 17 7.173 -9.499 7.717 1.00 0.00 N ATOM 114 CA LEU A 17 7.527 -8.087 7.623 1.00 0.00 C ATOM 115 C LEU A 17 8.263 -7.626 8.877 1.00 0.00 C ATOM 116 O LEU A 17 9.345 -7.043 8.796 1.00 0.00 O ATOM 117 CB LEU A 17 6.271 -7.239 7.414 1.00 0.00 C ATOM 118 CG LEU A 17 5.575 -7.393 6.061 1.00 0.00 C ATOM 119 CD1 LEU A 17 4.350 -6.495 5.985 1.00 0.00 C ATOM 120 CD2 LEU A 17 6.539 -7.080 4.926 1.00 0.00 C ATOM 0 H LEU A 17 6.172 -9.687 7.666 1.00 0.00 H new ATOM 0 HA LEU A 17 8.190 -7.960 6.767 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.555 -7.486 8.198 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.539 -6.191 7.545 1.00 0.00 H new ATOM 0 HG LEU A 17 5.248 -8.428 5.958 1.00 0.00 H new ATOM 0 HD11 LEU A 17 3.868 -6.618 5.015 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.650 -6.767 6.775 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.653 -5.455 6.110 1.00 0.00 H new ATOM 0 HD21 LEU A 17 6.026 -7.195 3.971 1.00 0.00 H new ATOM 0 HD22 LEU A 17 6.897 -6.055 5.025 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.385 -7.765 4.968 1.00 0.00 H new ATOM 132 N LEU A 18 7.670 -7.891 10.036 1.00 0.00 N ATOM 133 CA LEU A 18 8.270 -7.506 11.308 1.00 0.00 C ATOM 134 C LEU A 18 9.745 -7.892 11.354 1.00 0.00 C ATOM 135 O LEU A 18 10.580 -7.129 11.839 1.00 0.00 O ATOM 136 CB LEU A 18 7.522 -8.165 12.468 1.00 0.00 C ATOM 137 CG LEU A 18 6.198 -7.515 12.870 1.00 0.00 C ATOM 138 CD1 LEU A 18 5.433 -8.411 13.831 1.00 0.00 C ATOM 139 CD2 LEU A 18 6.443 -6.148 13.492 1.00 0.00 C ATOM 0 H LEU A 18 6.774 -8.371 10.121 1.00 0.00 H new ATOM 0 HA LEU A 18 8.194 -6.423 11.404 1.00 0.00 H new ATOM 0 HB2 LEU A 18 7.328 -9.205 12.205 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.178 -8.174 13.338 1.00 0.00 H new ATOM 0 HG LEU A 18 5.594 -7.381 11.973 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.494 -7.931 14.106 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.225 -9.367 13.350 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.031 -8.578 14.727 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.490 -5.700 13.772 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.067 -6.258 14.379 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.948 -5.505 12.771 1.00 0.00 H new ATOM 151 N GLN A 19 10.057 -9.079 10.844 1.00 0.00 N ATOM 152 CA GLN A 19 11.432 -9.564 10.826 1.00 0.00 C ATOM 153 C GLN A 19 12.297 -8.715 9.901 1.00 0.00 C ATOM 154 O GLN A 19 13.390 -8.288 10.275 1.00 0.00 O ATOM 155 CB GLN A 19 11.472 -11.027 10.380 1.00 0.00 C ATOM 156 CG GLN A 19 10.790 -11.978 11.350 1.00 0.00 C ATOM 157 CD GLN A 19 11.266 -11.794 12.778 1.00 0.00 C ATOM 158 OE1 GLN A 19 10.512 -11.344 13.642 1.00 0.00 O ATOM 159 NE2 GLN A 19 12.521 -12.143 13.034 1.00 0.00 N ATOM 0 H GLN A 19 9.377 -9.722 10.438 1.00 0.00 H new ATOM 0 HA GLN A 19 11.831 -9.488 11.837 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.995 -11.114 9.404 1.00 0.00 H new ATOM 0 HB3 GLN A 19 12.511 -11.332 10.255 1.00 0.00 H new ATOM 0 HG2 GLN A 19 9.712 -11.823 11.307 1.00 0.00 H new ATOM 0 HG3 GLN A 19 10.977 -13.005 11.038 1.00 0.00 H new ATOM 0 HE21 GLN A 19 13.110 -12.512 12.287 1.00 0.00 H new ATOM 0 HE22 GLN A 19 12.896 -12.043 13.977 1.00 0.00 H new ATOM 168 N PHE A 20 11.801 -8.472 8.692 1.00 0.00 N ATOM 169 CA PHE A 20 12.530 -7.674 7.713 1.00 0.00 C ATOM 170 C PHE A 20 12.783 -6.265 8.240 1.00 0.00 C ATOM 171 O PHE A 20 13.920 -5.794 8.268 1.00 0.00 O ATOM 172 CB PHE A 20 11.751 -7.606 6.398 1.00 0.00 C ATOM 173 CG PHE A 20 12.133 -6.438 5.534 1.00 0.00 C ATOM 174 CD1 PHE A 20 13.163 -6.548 4.614 1.00 0.00 C ATOM 175 CD2 PHE A 20 11.463 -5.231 5.643 1.00 0.00 C ATOM 176 CE1 PHE A 20 13.517 -5.475 3.817 1.00 0.00 C ATOM 177 CE2 PHE A 20 11.811 -4.155 4.849 1.00 0.00 C ATOM 178 CZ PHE A 20 12.841 -4.276 3.936 1.00 0.00 C ATOM 0 H PHE A 20 10.898 -8.816 8.367 1.00 0.00 H new ATOM 0 HA PHE A 20 13.492 -8.154 7.534 1.00 0.00 H new ATOM 0 HB2 PHE A 20 11.914 -8.528 5.841 1.00 0.00 H new ATOM 0 HB3 PHE A 20 10.685 -7.551 6.619 1.00 0.00 H new ATOM 0 HD1 PHE A 20 13.696 -7.483 4.518 1.00 0.00 H new ATOM 0 HD2 PHE A 20 10.659 -5.129 6.357 1.00 0.00 H new ATOM 0 HE1 PHE A 20 14.321 -5.574 3.102 1.00 0.00 H new ATOM 0 HE2 PHE A 20 11.278 -3.220 4.942 1.00 0.00 H new ATOM 0 HZ PHE A 20 13.117 -3.435 3.317 1.00 0.00 H new ATOM 188 N THR A 21 11.713 -5.594 8.657 1.00 0.00 N ATOM 189 CA THR A 21 11.817 -4.238 9.182 1.00 0.00 C ATOM 190 C THR A 21 13.061 -4.078 10.049 1.00 0.00 C ATOM 191 O THR A 21 13.918 -3.241 9.772 1.00 0.00 O ATOM 192 CB THR A 21 10.575 -3.860 10.010 1.00 0.00 C ATOM 193 OG1 THR A 21 10.348 -4.840 11.029 1.00 0.00 O ATOM 194 CG2 THR A 21 9.345 -3.750 9.122 1.00 0.00 C ATOM 0 H THR A 21 10.764 -5.968 8.641 1.00 0.00 H new ATOM 0 HA THR A 21 11.888 -3.571 8.323 1.00 0.00 H new ATOM 0 HB THR A 21 10.757 -2.890 10.473 1.00 0.00 H new ATOM 0 HG1 THR A 21 10.706 -5.704 10.737 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.480 -3.482 9.729 1.00 0.00 H new ATOM 0 HG22 THR A 21 9.509 -2.982 8.366 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.162 -4.707 8.633 1.00 0.00 H new ATOM 202 N ALA A 22 13.152 -4.888 11.099 1.00 0.00 N ATOM 203 CA ALA A 22 14.293 -4.837 12.005 1.00 0.00 C ATOM 204 C ALA A 22 15.605 -4.999 11.245 1.00 0.00 C ATOM 205 O ALA A 22 16.497 -4.156 11.343 1.00 0.00 O ATOM 206 CB ALA A 22 14.165 -5.911 13.075 1.00 0.00 C ATOM 0 H ALA A 22 12.450 -5.587 11.343 1.00 0.00 H new ATOM 0 HA ALA A 22 14.300 -3.859 12.486 1.00 0.00 H new ATOM 0 HB1 ALA A 22 15.024 -5.862 13.745 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.250 -5.749 13.645 1.00 0.00 H new ATOM 0 HB3 ALA A 22 14.129 -6.893 12.603 1.00 0.00 H new ATOM 212 N GLU A 23 15.716 -6.087 10.489 1.00 0.00 N ATOM 213 CA GLU A 23 16.921 -6.358 9.714 1.00 0.00 C ATOM 214 C GLU A 23 17.340 -5.129 8.912 1.00 0.00 C ATOM 215 O GLU A 23 18.518 -4.775 8.867 1.00 0.00 O ATOM 216 CB GLU A 23 16.693 -7.542 8.773 1.00 0.00 C ATOM 217 CG GLU A 23 16.587 -8.878 9.490 1.00 0.00 C ATOM 218 CD GLU A 23 16.431 -10.043 8.532 1.00 0.00 C ATOM 219 OE1 GLU A 23 15.365 -10.146 7.890 1.00 0.00 O ATOM 220 OE2 GLU A 23 17.376 -10.853 8.425 1.00 0.00 O ATOM 0 H GLU A 23 14.987 -6.794 10.397 1.00 0.00 H new ATOM 0 HA GLU A 23 17.722 -6.606 10.410 1.00 0.00 H new ATOM 0 HB2 GLU A 23 15.780 -7.372 8.203 1.00 0.00 H new ATOM 0 HB3 GLU A 23 17.512 -7.588 8.056 1.00 0.00 H new ATOM 0 HG2 GLU A 23 17.477 -9.031 10.100 1.00 0.00 H new ATOM 0 HG3 GLU A 23 15.735 -8.855 10.170 1.00 0.00 H new ATOM 227 N PHE A 24 16.366 -4.484 8.278 1.00 0.00 N ATOM 228 CA PHE A 24 16.633 -3.296 7.476 1.00 0.00 C ATOM 229 C PHE A 24 17.286 -2.205 8.319 1.00 0.00 C ATOM 230 O PHE A 24 18.159 -1.478 7.845 1.00 0.00 O ATOM 231 CB PHE A 24 15.335 -2.770 6.858 1.00 0.00 C ATOM 232 CG PHE A 24 15.540 -1.596 5.944 1.00 0.00 C ATOM 233 CD1 PHE A 24 15.977 -0.380 6.443 1.00 0.00 C ATOM 234 CD2 PHE A 24 15.294 -1.709 4.585 1.00 0.00 C ATOM 235 CE1 PHE A 24 16.166 0.702 5.604 1.00 0.00 C ATOM 236 CE2 PHE A 24 15.481 -0.630 3.741 1.00 0.00 C ATOM 237 CZ PHE A 24 15.917 0.577 4.251 1.00 0.00 C ATOM 0 H PHE A 24 15.386 -4.764 8.304 1.00 0.00 H new ATOM 0 HA PHE A 24 17.321 -3.574 6.678 1.00 0.00 H new ATOM 0 HB2 PHE A 24 14.855 -3.575 6.301 1.00 0.00 H new ATOM 0 HB3 PHE A 24 14.651 -2.483 7.657 1.00 0.00 H new ATOM 0 HD1 PHE A 24 16.172 -0.276 7.500 1.00 0.00 H new ATOM 0 HD2 PHE A 24 14.952 -2.650 4.181 1.00 0.00 H new ATOM 0 HE1 PHE A 24 16.508 1.644 6.006 1.00 0.00 H new ATOM 0 HE2 PHE A 24 15.286 -0.731 2.684 1.00 0.00 H new ATOM 0 HZ PHE A 24 16.063 1.421 3.594 1.00 0.00 H new ATOM 247 N SER A 25 16.857 -2.097 9.572 1.00 0.00 N ATOM 248 CA SER A 25 17.396 -1.092 10.481 1.00 0.00 C ATOM 249 C SER A 25 18.807 -1.464 10.926 1.00 0.00 C ATOM 250 O SER A 25 19.684 -0.606 11.028 1.00 0.00 O ATOM 251 CB SER A 25 16.488 -0.940 11.703 1.00 0.00 C ATOM 252 OG SER A 25 15.357 -0.142 11.401 1.00 0.00 O ATOM 0 H SER A 25 16.138 -2.693 9.981 1.00 0.00 H new ATOM 0 HA SER A 25 17.439 -0.142 9.949 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.163 -1.923 12.043 1.00 0.00 H new ATOM 0 HB3 SER A 25 17.048 -0.488 12.522 1.00 0.00 H new ATOM 0 HG SER A 25 14.792 -0.061 12.197 1.00 0.00 H new ATOM 258 N SER A 26 19.019 -2.749 11.189 1.00 0.00 N ATOM 259 CA SER A 26 20.323 -3.236 11.626 1.00 0.00 C ATOM 260 C SER A 26 21.341 -3.153 10.493 1.00 0.00 C ATOM 261 O SER A 26 22.497 -2.787 10.709 1.00 0.00 O ATOM 262 CB SER A 26 20.212 -4.678 12.123 1.00 0.00 C ATOM 263 OG SER A 26 19.936 -5.566 11.054 1.00 0.00 O ATOM 0 H SER A 26 18.305 -3.472 11.107 1.00 0.00 H new ATOM 0 HA SER A 26 20.664 -2.603 12.445 1.00 0.00 H new ATOM 0 HB2 SER A 26 21.141 -4.970 12.612 1.00 0.00 H new ATOM 0 HB3 SER A 26 19.423 -4.748 12.871 1.00 0.00 H new ATOM 0 HG SER A 26 19.377 -5.113 10.389 1.00 0.00 H new ATOM 269 N ARG A 27 20.904 -3.496 9.286 1.00 0.00 N ATOM 270 CA ARG A 27 21.777 -3.462 8.119 1.00 0.00 C ATOM 271 C ARG A 27 21.946 -2.034 7.608 1.00 0.00 C ATOM 272 O ARG A 27 23.050 -1.490 7.611 1.00 0.00 O ATOM 273 CB ARG A 27 21.213 -4.350 7.008 1.00 0.00 C ATOM 274 CG ARG A 27 20.907 -5.769 7.458 1.00 0.00 C ATOM 275 CD ARG A 27 19.989 -6.479 6.476 1.00 0.00 C ATOM 276 NE ARG A 27 20.738 -7.201 5.451 1.00 0.00 N ATOM 277 CZ ARG A 27 21.386 -8.339 5.678 1.00 0.00 C ATOM 278 NH1 ARG A 27 21.375 -8.881 6.888 1.00 0.00 N ATOM 279 NH2 ARG A 27 22.045 -8.936 4.694 1.00 0.00 N ATOM 0 H ARG A 27 19.950 -3.801 9.091 1.00 0.00 H new ATOM 0 HA ARG A 27 22.755 -3.841 8.416 1.00 0.00 H new ATOM 0 HB2 ARG A 27 20.301 -3.896 6.620 1.00 0.00 H new ATOM 0 HB3 ARG A 27 21.927 -4.385 6.185 1.00 0.00 H new ATOM 0 HG2 ARG A 27 21.837 -6.329 7.558 1.00 0.00 H new ATOM 0 HG3 ARG A 27 20.441 -5.747 8.443 1.00 0.00 H new ATOM 0 HD2 ARG A 27 19.350 -7.177 7.017 1.00 0.00 H new ATOM 0 HD3 ARG A 27 19.334 -5.750 6.000 1.00 0.00 H new ATOM 0 HE ARG A 27 20.765 -6.810 4.509 1.00 0.00 H new ATOM 0 HH11 ARG A 27 20.869 -8.425 7.647 1.00 0.00 H new ATOM 0 HH12 ARG A 27 21.873 -9.754 7.060 1.00 0.00 H new ATOM 0 HH21 ARG A 27 22.055 -8.522 3.762 1.00 0.00 H new ATOM 0 HH22 ARG A 27 22.542 -9.809 4.869 1.00 0.00 H new ATOM 293 N TYR A 28 20.845 -1.435 7.169 1.00 0.00 N ATOM 294 CA TYR A 28 20.872 -0.072 6.652 1.00 0.00 C ATOM 295 C TYR A 28 20.921 0.942 7.791 1.00 0.00 C ATOM 296 O TYR A 28 21.926 1.625 7.986 1.00 0.00 O ATOM 297 CB TYR A 28 19.645 0.188 5.776 1.00 0.00 C ATOM 298 CG TYR A 28 19.482 -0.809 4.651 1.00 0.00 C ATOM 299 CD1 TYR A 28 18.965 -2.076 4.889 1.00 0.00 C ATOM 300 CD2 TYR A 28 19.847 -0.484 3.350 1.00 0.00 C ATOM 301 CE1 TYR A 28 18.815 -2.991 3.864 1.00 0.00 C ATOM 302 CE2 TYR A 28 19.699 -1.391 2.319 1.00 0.00 C ATOM 303 CZ TYR A 28 19.183 -2.644 2.581 1.00 0.00 C ATOM 304 OH TYR A 28 19.036 -3.551 1.557 1.00 0.00 O ATOM 0 H TYR A 28 19.923 -1.871 7.161 1.00 0.00 H new ATOM 0 HA TYR A 28 21.772 0.043 6.048 1.00 0.00 H new ATOM 0 HB2 TYR A 28 18.752 0.167 6.401 1.00 0.00 H new ATOM 0 HB3 TYR A 28 19.716 1.191 5.354 1.00 0.00 H new ATOM 0 HD1 TYR A 28 18.675 -2.351 5.892 1.00 0.00 H new ATOM 0 HD2 TYR A 28 20.253 0.495 3.142 1.00 0.00 H new ATOM 0 HE1 TYR A 28 18.412 -3.972 4.067 1.00 0.00 H new ATOM 0 HE2 TYR A 28 19.985 -1.121 1.313 1.00 0.00 H new ATOM 0 HH TYR A 28 19.341 -3.148 0.717 1.00 0.00 H new ATOM 314 N GLY A 29 19.827 1.034 8.541 1.00 0.00 N ATOM 315 CA GLY A 29 19.765 1.966 9.652 1.00 0.00 C ATOM 316 C GLY A 29 18.355 2.150 10.176 1.00 0.00 C ATOM 317 O GLY A 29 17.385 2.002 9.433 1.00 0.00 O ATOM 0 H GLY A 29 18.983 0.480 8.399 1.00 0.00 H new ATOM 0 HA2 GLY A 29 20.405 1.608 10.458 1.00 0.00 H new ATOM 0 HA3 GLY A 29 20.160 2.931 9.335 1.00 0.00 H new ATOM 321 N ASP A 30 18.240 2.472 11.460 1.00 0.00 N ATOM 322 CA ASP A 30 16.938 2.675 12.084 1.00 0.00 C ATOM 323 C ASP A 30 16.097 3.660 11.277 1.00 0.00 C ATOM 324 O ASP A 30 14.928 3.401 10.988 1.00 0.00 O ATOM 325 CB ASP A 30 17.109 3.185 13.516 1.00 0.00 C ATOM 326 CG ASP A 30 18.209 4.222 13.634 1.00 0.00 C ATOM 327 OD1 ASP A 30 17.921 5.419 13.427 1.00 0.00 O ATOM 328 OD2 ASP A 30 19.358 3.835 13.934 1.00 0.00 O ATOM 0 H ASP A 30 19.033 2.598 12.089 1.00 0.00 H new ATOM 0 HA ASP A 30 16.420 1.716 12.108 1.00 0.00 H new ATOM 0 HB2 ASP A 30 16.169 3.616 13.860 1.00 0.00 H new ATOM 0 HB3 ASP A 30 17.334 2.345 14.173 1.00 0.00 H new ATOM 333 N CYS A 31 16.699 4.788 10.917 1.00 0.00 N ATOM 334 CA CYS A 31 16.005 5.812 10.145 1.00 0.00 C ATOM 335 C CYS A 31 15.419 5.225 8.865 1.00 0.00 C ATOM 336 O CYS A 31 16.137 4.984 7.894 1.00 0.00 O ATOM 337 CB CYS A 31 16.959 6.958 9.805 1.00 0.00 C ATOM 338 SG CYS A 31 17.178 8.157 11.140 1.00 0.00 S ATOM 0 H CYS A 31 17.666 5.016 11.147 1.00 0.00 H new ATOM 0 HA CYS A 31 15.187 6.198 10.753 1.00 0.00 H new ATOM 0 HB2 CYS A 31 17.931 6.541 9.542 1.00 0.00 H new ATOM 0 HB3 CYS A 31 16.586 7.477 8.922 1.00 0.00 H new ATOM 0 HG CYS A 31 18.003 9.086 10.758 1.00 0.00 H new ATOM 344 N HIS A 32 14.110 4.994 8.871 1.00 0.00 N ATOM 345 CA HIS A 32 13.427 4.433 7.711 1.00 0.00 C ATOM 346 C HIS A 32 11.913 4.553 7.861 1.00 0.00 C ATOM 347 O HIS A 32 11.382 4.676 8.965 1.00 0.00 O ATOM 348 CB HIS A 32 13.818 2.967 7.522 1.00 0.00 C ATOM 349 CG HIS A 32 12.905 2.009 8.222 1.00 0.00 C ATOM 350 ND1 HIS A 32 12.673 1.810 9.541 1.00 0.00 N flip ATOM 351 CD2 HIS A 32 12.101 1.110 7.553 1.00 0.00 C flip ATOM 352 CE1 HIS A 32 11.742 0.807 9.644 1.00 0.00 C flip ATOM 353 NE2 HIS A 32 11.412 0.402 8.430 1.00 0.00 N flip ATOM 0 H HIS A 32 13.501 5.187 9.666 1.00 0.00 H new ATOM 0 HA HIS A 32 13.733 4.999 6.831 1.00 0.00 H new ATOM 0 HB2 HIS A 32 13.826 2.736 6.457 1.00 0.00 H new ATOM 0 HB3 HIS A 32 14.834 2.821 7.888 1.00 0.00 H new ATOM 0 HD1 HIS A 32 13.109 2.312 10.314 1.00 0.00 H new ATOM 0 HD2 HIS A 32 12.044 1.002 6.480 1.00 0.00 H new ATOM 0 HE1 HIS A 32 11.344 0.413 10.567 1.00 0.00 H new ATOM 0 HE2 HIS A 32 10.740 -0.332 8.208 1.00 0.00 H new ATOM 361 N PRO A 33 11.201 4.518 6.725 1.00 0.00 N ATOM 362 CA PRO A 33 9.739 4.621 6.704 1.00 0.00 C ATOM 363 C PRO A 33 9.062 3.383 7.282 1.00 0.00 C ATOM 364 O PRO A 33 9.304 2.263 6.832 1.00 0.00 O ATOM 365 CB PRO A 33 9.414 4.761 5.214 1.00 0.00 C ATOM 366 CG PRO A 33 10.561 4.116 4.515 1.00 0.00 C ATOM 367 CD PRO A 33 11.768 4.373 5.373 1.00 0.00 C ATOM 0 HA PRO A 33 9.381 5.451 7.313 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.473 4.271 4.966 1.00 0.00 H new ATOM 0 HB3 PRO A 33 9.313 5.808 4.927 1.00 0.00 H new ATOM 0 HG2 PRO A 33 10.391 3.046 4.392 1.00 0.00 H new ATOM 0 HG3 PRO A 33 10.695 4.535 3.518 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.480 3.549 5.322 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.299 5.273 5.061 1.00 0.00 H new ATOM 375 N VAL A 34 8.211 3.592 8.282 1.00 0.00 N ATOM 376 CA VAL A 34 7.498 2.492 8.921 1.00 0.00 C ATOM 377 C VAL A 34 6.557 1.803 7.939 1.00 0.00 C ATOM 378 O VAL A 34 5.648 2.427 7.391 1.00 0.00 O ATOM 379 CB VAL A 34 6.686 2.981 10.135 1.00 0.00 C ATOM 380 CG1 VAL A 34 5.724 4.085 9.726 1.00 0.00 C ATOM 381 CG2 VAL A 34 5.938 1.822 10.777 1.00 0.00 C ATOM 0 H VAL A 34 7.999 4.512 8.667 1.00 0.00 H new ATOM 0 HA VAL A 34 8.251 1.780 9.259 1.00 0.00 H new ATOM 0 HB VAL A 34 7.378 3.390 10.871 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.160 4.417 10.597 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.286 4.924 9.316 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.036 3.706 8.971 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.370 2.185 11.633 1.00 0.00 H new ATOM 0 HG22 VAL A 34 5.256 1.381 10.050 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.651 1.068 11.109 1.00 0.00 H new ATOM 391 N PHE A 35 6.782 0.512 7.721 1.00 0.00 N ATOM 392 CA PHE A 35 5.954 -0.264 6.804 1.00 0.00 C ATOM 393 C PHE A 35 4.672 -0.728 7.488 1.00 0.00 C ATOM 394 O PHE A 35 4.666 -1.030 8.682 1.00 0.00 O ATOM 395 CB PHE A 35 6.732 -1.473 6.280 1.00 0.00 C ATOM 396 CG PHE A 35 8.033 -1.110 5.623 1.00 0.00 C ATOM 397 CD1 PHE A 35 8.072 -0.750 4.285 1.00 0.00 C ATOM 398 CD2 PHE A 35 9.217 -1.127 6.343 1.00 0.00 C ATOM 399 CE1 PHE A 35 9.268 -0.416 3.678 1.00 0.00 C ATOM 400 CE2 PHE A 35 10.416 -0.794 5.741 1.00 0.00 C ATOM 401 CZ PHE A 35 10.441 -0.437 4.407 1.00 0.00 C ATOM 0 H PHE A 35 7.530 -0.019 8.166 1.00 0.00 H new ATOM 0 HA PHE A 35 5.685 0.378 5.965 1.00 0.00 H new ATOM 0 HB2 PHE A 35 6.930 -2.154 7.108 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.111 -2.012 5.565 1.00 0.00 H new ATOM 0 HD1 PHE A 35 7.158 -0.730 3.710 1.00 0.00 H new ATOM 0 HD2 PHE A 35 9.203 -1.404 7.387 1.00 0.00 H new ATOM 0 HE1 PHE A 35 9.285 -0.139 2.634 1.00 0.00 H new ATOM 0 HE2 PHE A 35 11.332 -0.813 6.313 1.00 0.00 H new ATOM 0 HZ PHE A 35 11.376 -0.175 3.935 1.00 0.00 H new ATOM 411 N PHE A 36 3.586 -0.781 6.724 1.00 0.00 N ATOM 412 CA PHE A 36 2.297 -1.206 7.255 1.00 0.00 C ATOM 413 C PHE A 36 2.316 -2.691 7.605 1.00 0.00 C ATOM 414 O PHE A 36 2.248 -3.548 6.723 1.00 0.00 O ATOM 415 CB PHE A 36 1.185 -0.923 6.243 1.00 0.00 C ATOM 416 CG PHE A 36 -0.144 -1.505 6.633 1.00 0.00 C ATOM 417 CD1 PHE A 36 -0.481 -2.799 6.271 1.00 0.00 C ATOM 418 CD2 PHE A 36 -1.055 -0.757 7.361 1.00 0.00 C ATOM 419 CE1 PHE A 36 -1.703 -3.337 6.629 1.00 0.00 C ATOM 420 CE2 PHE A 36 -2.278 -1.290 7.722 1.00 0.00 C ATOM 421 CZ PHE A 36 -2.603 -2.582 7.354 1.00 0.00 C ATOM 0 H PHE A 36 3.573 -0.535 5.734 1.00 0.00 H new ATOM 0 HA PHE A 36 2.103 -0.638 8.165 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.079 0.155 6.124 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.477 -1.324 5.273 1.00 0.00 H new ATOM 0 HD1 PHE A 36 0.219 -3.394 5.703 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -0.807 0.254 7.650 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -1.953 -4.347 6.342 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.979 -0.698 8.291 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.559 -3.000 7.633 1.00 0.00 H new ATOM 431 N ILE A 37 2.409 -2.988 8.896 1.00 0.00 N ATOM 432 CA ILE A 37 2.436 -4.369 9.363 1.00 0.00 C ATOM 433 C ILE A 37 1.110 -5.068 9.087 1.00 0.00 C ATOM 434 O ILE A 37 0.119 -4.839 9.780 1.00 0.00 O ATOM 435 CB ILE A 37 2.742 -4.448 10.870 1.00 0.00 C ATOM 436 CG1 ILE A 37 4.086 -3.783 11.175 1.00 0.00 C ATOM 437 CG2 ILE A 37 2.744 -5.897 11.335 1.00 0.00 C ATOM 438 CD1 ILE A 37 5.253 -4.422 10.456 1.00 0.00 C ATOM 0 H ILE A 37 2.467 -2.291 9.638 1.00 0.00 H new ATOM 0 HA ILE A 37 3.231 -4.873 8.813 1.00 0.00 H new ATOM 0 HB ILE A 37 1.962 -3.914 11.413 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.032 -2.730 10.899 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.266 -3.822 12.249 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.962 -5.936 12.402 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.766 -6.341 11.148 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.506 -6.453 10.789 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.173 -3.900 10.719 1.00 0.00 H new ATOM 0 HD12 ILE A 37 5.333 -5.468 10.751 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.095 -4.359 9.379 1.00 0.00 H new ATOM 450 N GLY A 38 1.098 -5.925 8.070 1.00 0.00 N ATOM 451 CA GLY A 38 -0.111 -6.647 7.722 1.00 0.00 C ATOM 452 C GLY A 38 -0.091 -7.158 6.295 1.00 0.00 C ATOM 453 O GLY A 38 0.964 -7.209 5.662 1.00 0.00 O ATOM 0 H GLY A 38 1.905 -6.132 7.481 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -0.237 -7.488 8.404 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -0.973 -5.994 7.859 1.00 0.00 H new ATOM 457 N SER A 39 -1.259 -7.540 5.788 1.00 0.00 N ATOM 458 CA SER A 39 -1.370 -8.055 4.428 1.00 0.00 C ATOM 459 C SER A 39 -1.623 -6.923 3.437 1.00 0.00 C ATOM 460 O SER A 39 -2.316 -5.953 3.748 1.00 0.00 O ATOM 461 CB SER A 39 -2.497 -9.086 4.341 1.00 0.00 C ATOM 462 OG SER A 39 -2.254 -10.021 3.305 1.00 0.00 O ATOM 0 H SER A 39 -2.141 -7.503 6.298 1.00 0.00 H new ATOM 0 HA SER A 39 -0.426 -8.536 4.170 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.590 -9.609 5.293 1.00 0.00 H new ATOM 0 HB3 SER A 39 -3.445 -8.579 4.162 1.00 0.00 H new ATOM 0 HG SER A 39 -2.977 -9.973 2.645 1.00 0.00 H new ATOM 468 N LEU A 40 -1.056 -7.053 2.243 1.00 0.00 N ATOM 469 CA LEU A 40 -1.220 -6.042 1.204 1.00 0.00 C ATOM 470 C LEU A 40 -2.691 -5.687 1.016 1.00 0.00 C ATOM 471 O LEU A 40 -3.022 -4.596 0.554 1.00 0.00 O ATOM 472 CB LEU A 40 -0.631 -6.540 -0.117 1.00 0.00 C ATOM 473 CG LEU A 40 -0.918 -5.678 -1.347 1.00 0.00 C ATOM 474 CD1 LEU A 40 0.092 -4.545 -1.452 1.00 0.00 C ATOM 475 CD2 LEU A 40 -0.902 -6.528 -2.609 1.00 0.00 C ATOM 0 H LEU A 40 -0.479 -7.848 1.970 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.686 -5.145 1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.450 -6.624 -0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.011 -7.544 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.911 -5.243 -1.239 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.128 -3.942 -2.333 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.032 -3.920 -0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.096 -4.960 -1.538 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.108 -5.898 -3.474 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.078 -6.992 -2.723 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.664 -7.304 -2.535 1.00 0.00 H new ATOM 487 N GLU A 41 -3.570 -6.616 1.380 1.00 0.00 N ATOM 488 CA GLU A 41 -5.006 -6.399 1.253 1.00 0.00 C ATOM 489 C GLU A 41 -5.436 -5.144 2.007 1.00 0.00 C ATOM 490 O GLU A 41 -6.103 -4.271 1.451 1.00 0.00 O ATOM 491 CB GLU A 41 -5.776 -7.612 1.779 1.00 0.00 C ATOM 492 CG GLU A 41 -6.053 -8.664 0.717 1.00 0.00 C ATOM 493 CD GLU A 41 -4.809 -9.433 0.319 1.00 0.00 C ATOM 494 OE1 GLU A 41 -3.977 -9.717 1.206 1.00 0.00 O ATOM 495 OE2 GLU A 41 -4.667 -9.751 -0.880 1.00 0.00 O ATOM 0 H GLU A 41 -3.313 -7.525 1.765 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.234 -6.263 0.196 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.209 -8.068 2.591 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -6.723 -7.276 2.201 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.803 -9.362 1.089 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.475 -8.182 -0.165 1.00 0.00 H new ATOM 502 N ALA A 42 -5.050 -5.062 3.276 1.00 0.00 N ATOM 503 CA ALA A 42 -5.394 -3.915 4.106 1.00 0.00 C ATOM 504 C ALA A 42 -4.923 -2.613 3.466 1.00 0.00 C ATOM 505 O ALA A 42 -5.694 -1.665 3.326 1.00 0.00 O ATOM 506 CB ALA A 42 -4.794 -4.070 5.496 1.00 0.00 C ATOM 0 H ALA A 42 -4.499 -5.777 3.751 1.00 0.00 H new ATOM 0 HA ALA A 42 -6.480 -3.874 4.194 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.059 -3.206 6.105 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -5.183 -4.975 5.962 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -3.709 -4.140 5.418 1.00 0.00 H new ATOM 512 N ALA A 43 -3.651 -2.575 3.082 1.00 0.00 N ATOM 513 CA ALA A 43 -3.078 -1.390 2.455 1.00 0.00 C ATOM 514 C ALA A 43 -4.097 -0.695 1.560 1.00 0.00 C ATOM 515 O ALA A 43 -4.184 0.533 1.538 1.00 0.00 O ATOM 516 CB ALA A 43 -1.838 -1.763 1.656 1.00 0.00 C ATOM 0 H ALA A 43 -2.998 -3.351 3.194 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.793 -0.694 3.244 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.421 -0.869 1.193 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.097 -2.207 2.321 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -2.107 -2.481 0.881 1.00 0.00 H new ATOM 522 N PHE A 44 -4.867 -1.487 0.821 1.00 0.00 N ATOM 523 CA PHE A 44 -5.880 -0.947 -0.078 1.00 0.00 C ATOM 524 C PHE A 44 -6.927 -0.151 0.697 1.00 0.00 C ATOM 525 O PHE A 44 -7.324 0.937 0.284 1.00 0.00 O ATOM 526 CB PHE A 44 -6.556 -2.077 -0.857 1.00 0.00 C ATOM 527 CG PHE A 44 -5.652 -2.740 -1.857 1.00 0.00 C ATOM 528 CD1 PHE A 44 -5.456 -2.183 -3.110 1.00 0.00 C ATOM 529 CD2 PHE A 44 -4.998 -3.920 -1.543 1.00 0.00 C ATOM 530 CE1 PHE A 44 -4.625 -2.790 -4.032 1.00 0.00 C ATOM 531 CE2 PHE A 44 -4.165 -4.532 -2.461 1.00 0.00 C ATOM 532 CZ PHE A 44 -3.979 -3.966 -3.707 1.00 0.00 C ATOM 0 H PHE A 44 -4.809 -2.505 0.827 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.386 -0.276 -0.780 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -6.918 -2.827 -0.153 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -7.428 -1.679 -1.376 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -5.959 -1.263 -3.369 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -5.140 -4.367 -0.570 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -4.481 -2.345 -5.006 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -3.660 -5.452 -2.204 1.00 0.00 H new ATOM 0 HZ PHE A 44 -3.329 -4.443 -4.426 1.00 0.00 H new ATOM 542 N GLN A 45 -7.369 -0.705 1.822 1.00 0.00 N ATOM 543 CA GLN A 45 -8.370 -0.048 2.654 1.00 0.00 C ATOM 544 C GLN A 45 -7.745 1.078 3.471 1.00 0.00 C ATOM 545 O GLN A 45 -8.289 2.179 3.544 1.00 0.00 O ATOM 546 CB GLN A 45 -9.034 -1.063 3.586 1.00 0.00 C ATOM 547 CG GLN A 45 -8.316 -1.229 4.915 1.00 0.00 C ATOM 548 CD GLN A 45 -9.097 -2.079 5.898 1.00 0.00 C ATOM 549 OE1 GLN A 45 -10.029 -2.788 5.519 1.00 0.00 O ATOM 550 NE2 GLN A 45 -8.719 -2.012 7.169 1.00 0.00 N ATOM 0 H GLN A 45 -7.050 -1.606 2.178 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.127 0.382 1.998 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -10.062 -0.753 3.774 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -9.079 -2.029 3.084 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -7.341 -1.684 4.742 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -8.137 -0.247 5.352 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.941 -1.411 7.439 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -9.207 -2.562 7.876 1.00 0.00 H new ATOM 559 N GLU A 46 -6.600 0.793 4.083 1.00 0.00 N ATOM 560 CA GLU A 46 -5.903 1.783 4.896 1.00 0.00 C ATOM 561 C GLU A 46 -5.582 3.030 4.078 1.00 0.00 C ATOM 562 O GLU A 46 -5.162 4.051 4.623 1.00 0.00 O ATOM 563 CB GLU A 46 -4.614 1.189 5.468 1.00 0.00 C ATOM 564 CG GLU A 46 -3.983 2.039 6.558 1.00 0.00 C ATOM 565 CD GLU A 46 -2.515 1.723 6.767 1.00 0.00 C ATOM 566 OE1 GLU A 46 -1.908 1.098 5.873 1.00 0.00 O ATOM 567 OE2 GLU A 46 -1.972 2.103 7.826 1.00 0.00 O ATOM 0 H GLU A 46 -6.136 -0.114 4.032 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.560 2.068 5.718 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.827 0.198 5.869 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.895 1.057 4.660 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.091 3.093 6.300 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.521 1.883 7.493 1.00 0.00 H new ATOM 574 N ALA A 47 -5.784 2.940 2.768 1.00 0.00 N ATOM 575 CA ALA A 47 -5.518 4.060 1.875 1.00 0.00 C ATOM 576 C ALA A 47 -6.792 4.516 1.172 1.00 0.00 C ATOM 577 O ALA A 47 -6.990 5.708 0.934 1.00 0.00 O ATOM 578 CB ALA A 47 -4.457 3.681 0.853 1.00 0.00 C ATOM 0 H ALA A 47 -6.131 2.102 2.301 1.00 0.00 H new ATOM 0 HA ALA A 47 -5.148 4.891 2.476 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.269 4.528 0.193 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.535 3.411 1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -4.805 2.832 0.264 1.00 0.00 H new ATOM 584 N PHE A 48 -7.654 3.561 0.840 1.00 0.00 N ATOM 585 CA PHE A 48 -8.909 3.864 0.163 1.00 0.00 C ATOM 586 C PHE A 48 -10.062 3.934 1.159 1.00 0.00 C ATOM 587 O PHE A 48 -10.922 4.812 1.071 1.00 0.00 O ATOM 588 CB PHE A 48 -9.206 2.808 -0.904 1.00 0.00 C ATOM 589 CG PHE A 48 -8.207 2.793 -2.026 1.00 0.00 C ATOM 590 CD1 PHE A 48 -7.798 3.974 -2.624 1.00 0.00 C ATOM 591 CD2 PHE A 48 -7.676 1.597 -2.483 1.00 0.00 C ATOM 592 CE1 PHE A 48 -6.880 3.963 -3.656 1.00 0.00 C ATOM 593 CE2 PHE A 48 -6.757 1.579 -3.515 1.00 0.00 C ATOM 594 CZ PHE A 48 -6.358 2.764 -4.102 1.00 0.00 C ATOM 0 H PHE A 48 -7.506 2.570 1.029 1.00 0.00 H new ATOM 0 HA PHE A 48 -8.807 4.837 -0.317 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -9.228 1.825 -0.434 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.200 2.987 -1.315 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -8.202 4.914 -2.279 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.984 0.668 -2.027 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -6.571 4.891 -4.114 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -6.351 0.640 -3.862 1.00 0.00 H new ATOM 0 HZ PHE A 48 -5.639 2.753 -4.908 1.00 0.00 H new ATOM 604 N TYR A 49 -10.075 3.003 2.107 1.00 0.00 N ATOM 605 CA TYR A 49 -11.123 2.956 3.119 1.00 0.00 C ATOM 606 C TYR A 49 -10.888 4.010 4.196 1.00 0.00 C ATOM 607 O TYR A 49 -11.464 3.944 5.282 1.00 0.00 O ATOM 608 CB TYR A 49 -11.186 1.566 3.754 1.00 0.00 C ATOM 609 CG TYR A 49 -11.835 0.525 2.871 1.00 0.00 C ATOM 610 CD1 TYR A 49 -11.499 0.418 1.527 1.00 0.00 C ATOM 611 CD2 TYR A 49 -12.785 -0.353 3.380 1.00 0.00 C ATOM 612 CE1 TYR A 49 -12.091 -0.531 0.716 1.00 0.00 C ATOM 613 CE2 TYR A 49 -13.380 -1.306 2.577 1.00 0.00 C ATOM 614 CZ TYR A 49 -13.031 -1.391 1.246 1.00 0.00 C ATOM 615 OH TYR A 49 -13.621 -2.339 0.442 1.00 0.00 O ATOM 0 H TYR A 49 -9.371 2.270 2.195 1.00 0.00 H new ATOM 0 HA TYR A 49 -12.074 3.168 2.631 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -10.175 1.242 4.000 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -11.737 1.629 4.692 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -10.762 1.088 1.109 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -13.063 -0.289 4.422 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -11.820 -0.599 -0.327 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -14.115 -1.981 2.990 1.00 0.00 H new ATOM 0 HH TYR A 49 -14.259 -2.864 0.969 1.00 0.00 H new ATOM 625 N VAL A 50 -10.037 4.983 3.887 1.00 0.00 N ATOM 626 CA VAL A 50 -9.726 6.054 4.827 1.00 0.00 C ATOM 627 C VAL A 50 -10.737 7.190 4.720 1.00 0.00 C ATOM 628 O VAL A 50 -11.572 7.210 3.816 1.00 0.00 O ATOM 629 CB VAL A 50 -8.312 6.616 4.589 1.00 0.00 C ATOM 630 CG1 VAL A 50 -7.268 5.521 4.751 1.00 0.00 C ATOM 631 CG2 VAL A 50 -8.217 7.254 3.211 1.00 0.00 C ATOM 0 H VAL A 50 -9.551 5.052 2.993 1.00 0.00 H new ATOM 0 HA VAL A 50 -9.774 5.622 5.827 1.00 0.00 H new ATOM 0 HB VAL A 50 -8.116 7.386 5.335 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -6.275 5.937 4.579 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -7.321 5.114 5.761 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -7.459 4.727 4.029 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -7.211 7.646 3.060 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -8.433 6.506 2.448 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.938 8.068 3.136 1.00 0.00 H new ATOM 641 N LYS A 51 -10.655 8.136 5.649 1.00 0.00 N ATOM 642 CA LYS A 51 -11.561 9.278 5.660 1.00 0.00 C ATOM 643 C LYS A 51 -11.421 10.097 4.381 1.00 0.00 C ATOM 644 O LYS A 51 -10.372 10.085 3.738 1.00 0.00 O ATOM 645 CB LYS A 51 -11.284 10.164 6.878 1.00 0.00 C ATOM 646 CG LYS A 51 -12.522 10.855 7.422 1.00 0.00 C ATOM 647 CD LYS A 51 -12.160 11.969 8.389 1.00 0.00 C ATOM 648 CE LYS A 51 -12.067 11.457 9.819 1.00 0.00 C ATOM 649 NZ LYS A 51 -10.762 10.793 10.087 1.00 0.00 N ATOM 0 H LYS A 51 -9.970 8.134 6.405 1.00 0.00 H new ATOM 0 HA LYS A 51 -12.581 8.899 5.718 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -10.842 9.555 7.667 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.546 10.919 6.607 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -13.104 11.264 6.596 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -13.155 10.125 7.927 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -11.207 12.411 8.097 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -12.909 12.759 8.332 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -12.200 12.288 10.512 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -12.878 10.753 10.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -10.536 10.868 11.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -10.821 9.790 9.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -10.016 11.257 9.530 1.00 0.00 H new ATOM 663 N ALA A 52 -12.484 10.807 4.018 1.00 0.00 N ATOM 664 CA ALA A 52 -12.477 11.634 2.818 1.00 0.00 C ATOM 665 C ALA A 52 -11.338 12.646 2.855 1.00 0.00 C ATOM 666 O ALA A 52 -10.663 12.873 1.850 1.00 0.00 O ATOM 667 CB ALA A 52 -13.813 12.345 2.660 1.00 0.00 C ATOM 0 H ALA A 52 -13.361 10.826 4.538 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.320 10.982 1.958 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -13.794 12.959 1.760 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -14.611 11.607 2.579 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -13.993 12.979 3.528 1.00 0.00 H new ATOM 673 N ARG A 53 -11.129 13.252 4.019 1.00 0.00 N ATOM 674 CA ARG A 53 -10.071 14.242 4.186 1.00 0.00 C ATOM 675 C ARG A 53 -8.712 13.566 4.336 1.00 0.00 C ATOM 676 O ARG A 53 -7.708 14.043 3.805 1.00 0.00 O ATOM 677 CB ARG A 53 -10.353 15.120 5.407 1.00 0.00 C ATOM 678 CG ARG A 53 -9.745 16.510 5.311 1.00 0.00 C ATOM 679 CD ARG A 53 -9.727 17.204 6.664 1.00 0.00 C ATOM 680 NE ARG A 53 -9.329 18.605 6.555 1.00 0.00 N ATOM 681 CZ ARG A 53 -8.793 19.297 7.554 1.00 0.00 C ATOM 682 NH1 ARG A 53 -8.591 18.720 8.731 1.00 0.00 N ATOM 683 NH2 ARG A 53 -8.457 20.568 7.377 1.00 0.00 N ATOM 0 H ARG A 53 -11.678 13.075 4.860 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.050 14.868 3.294 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.431 15.212 5.536 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.967 14.624 6.298 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.729 16.438 4.924 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.315 17.109 4.601 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -10.717 17.142 7.116 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -9.039 16.683 7.330 1.00 0.00 H new ATOM 0 HE ARG A 53 -9.470 19.078 5.662 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.847 17.743 8.871 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -8.179 19.254 9.497 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -8.610 21.015 6.473 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.045 21.098 8.145 1.00 0.00 H new ATOM 697 N ASP A 54 -8.687 12.454 5.062 1.00 0.00 N ATOM 698 CA ASP A 54 -7.451 11.711 5.281 1.00 0.00 C ATOM 699 C ASP A 54 -7.139 10.812 4.089 1.00 0.00 C ATOM 700 O ASP A 54 -6.310 9.907 4.183 1.00 0.00 O ATOM 701 CB ASP A 54 -7.555 10.872 6.556 1.00 0.00 C ATOM 702 CG ASP A 54 -7.197 11.662 7.799 1.00 0.00 C ATOM 703 OD1 ASP A 54 -7.939 12.608 8.136 1.00 0.00 O ATOM 704 OD2 ASP A 54 -6.175 11.332 8.437 1.00 0.00 O ATOM 0 H ASP A 54 -9.508 12.047 5.509 1.00 0.00 H new ATOM 0 HA ASP A 54 -6.639 12.429 5.393 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -8.570 10.488 6.653 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -6.894 10.009 6.475 1.00 0.00 H new ATOM 709 N ARG A 55 -7.808 11.068 2.970 1.00 0.00 N ATOM 710 CA ARG A 55 -7.604 10.280 1.760 1.00 0.00 C ATOM 711 C ARG A 55 -6.127 10.248 1.376 1.00 0.00 C ATOM 712 O ARG A 55 -5.444 11.272 1.405 1.00 0.00 O ATOM 713 CB ARG A 55 -8.429 10.853 0.607 1.00 0.00 C ATOM 714 CG ARG A 55 -9.818 10.247 0.493 1.00 0.00 C ATOM 715 CD ARG A 55 -10.349 10.334 -0.930 1.00 0.00 C ATOM 716 NE ARG A 55 -10.869 11.663 -1.240 1.00 0.00 N ATOM 717 CZ ARG A 55 -12.108 12.051 -0.959 1.00 0.00 C ATOM 718 NH1 ARG A 55 -12.949 11.216 -0.365 1.00 0.00 N ATOM 719 NH2 ARG A 55 -12.507 13.277 -1.273 1.00 0.00 N ATOM 0 H ARG A 55 -8.496 11.815 2.876 1.00 0.00 H new ATOM 0 HA ARG A 55 -7.933 9.260 1.961 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -8.522 11.931 0.738 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -7.893 10.691 -0.328 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -9.788 9.204 0.808 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -10.499 10.765 1.169 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -9.552 10.084 -1.630 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -11.138 9.595 -1.068 1.00 0.00 H new ATOM 0 HE ARG A 55 -10.247 12.330 -1.697 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -12.645 10.273 -0.123 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -13.900 11.517 -0.150 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -11.862 13.922 -1.730 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -13.458 13.575 -1.057 1.00 0.00 H new ATOM 733 N LYS A 56 -5.641 9.065 1.016 1.00 0.00 N ATOM 734 CA LYS A 56 -4.246 8.897 0.625 1.00 0.00 C ATOM 735 C LYS A 56 -4.114 7.868 -0.493 1.00 0.00 C ATOM 736 O LYS A 56 -5.104 7.275 -0.925 1.00 0.00 O ATOM 737 CB LYS A 56 -3.405 8.468 1.829 1.00 0.00 C ATOM 738 CG LYS A 56 -3.293 9.536 2.904 1.00 0.00 C ATOM 739 CD LYS A 56 -2.433 9.068 4.066 1.00 0.00 C ATOM 740 CE LYS A 56 -3.228 8.209 5.038 1.00 0.00 C ATOM 741 NZ LYS A 56 -3.354 6.804 4.560 1.00 0.00 N ATOM 0 H LYS A 56 -6.193 8.208 0.987 1.00 0.00 H new ATOM 0 HA LYS A 56 -3.880 9.856 0.257 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.842 7.570 2.265 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.405 8.202 1.487 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.865 10.442 2.475 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -4.288 9.794 3.267 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -1.585 8.499 3.686 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.027 9.933 4.591 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.741 8.219 6.013 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -4.221 8.637 5.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.333 6.157 5.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.253 6.690 4.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -2.563 6.582 3.922 1.00 0.00 H new ATOM 755 N LEU A 57 -2.887 7.659 -0.957 1.00 0.00 N ATOM 756 CA LEU A 57 -2.626 6.700 -2.024 1.00 0.00 C ATOM 757 C LEU A 57 -1.830 5.508 -1.502 1.00 0.00 C ATOM 758 O LEU A 57 -1.417 5.484 -0.342 1.00 0.00 O ATOM 759 CB LEU A 57 -1.866 7.374 -3.168 1.00 0.00 C ATOM 760 CG LEU A 57 -2.524 8.615 -3.772 1.00 0.00 C ATOM 761 CD1 LEU A 57 -1.548 9.350 -4.677 1.00 0.00 C ATOM 762 CD2 LEU A 57 -3.780 8.231 -4.540 1.00 0.00 C ATOM 0 H LEU A 57 -2.057 8.141 -0.611 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.584 6.338 -2.396 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.876 7.652 -2.806 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.721 6.642 -3.962 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.808 9.284 -2.960 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.034 10.230 -5.098 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.677 9.658 -4.099 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.232 8.689 -5.484 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.236 9.126 -4.963 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.519 7.542 -5.343 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.487 7.749 -3.864 1.00 0.00 H new ATOM 774 N LEU A 58 -1.616 4.522 -2.366 1.00 0.00 N ATOM 775 CA LEU A 58 -0.866 3.327 -1.993 1.00 0.00 C ATOM 776 C LEU A 58 0.490 3.295 -2.692 1.00 0.00 C ATOM 777 O LEU A 58 0.585 3.539 -3.894 1.00 0.00 O ATOM 778 CB LEU A 58 -1.664 2.070 -2.345 1.00 0.00 C ATOM 779 CG LEU A 58 -0.900 0.748 -2.273 1.00 0.00 C ATOM 780 CD1 LEU A 58 -0.352 0.524 -0.872 1.00 0.00 C ATOM 781 CD2 LEU A 58 -1.796 -0.409 -2.690 1.00 0.00 C ATOM 0 H LEU A 58 -1.951 4.526 -3.329 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.698 3.354 -0.916 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -2.521 2.008 -1.674 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.057 2.185 -3.355 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.060 0.797 -2.965 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.189 -0.422 -0.840 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.325 1.338 -0.612 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.176 0.495 -0.159 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.236 -1.342 -2.633 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.657 -0.461 -2.023 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.138 -0.254 -3.713 1.00 0.00 H new ATOM 793 N ALA A 59 1.535 2.990 -1.930 1.00 0.00 N ATOM 794 CA ALA A 59 2.884 2.921 -2.476 1.00 0.00 C ATOM 795 C ALA A 59 3.492 1.539 -2.264 1.00 0.00 C ATOM 796 O ALA A 59 3.799 1.151 -1.136 1.00 0.00 O ATOM 797 CB ALA A 59 3.765 3.989 -1.844 1.00 0.00 C ATOM 0 H ALA A 59 1.473 2.787 -0.932 1.00 0.00 H new ATOM 0 HA ALA A 59 2.824 3.103 -3.549 1.00 0.00 H new ATOM 0 HB1 ALA A 59 4.770 3.926 -2.261 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.348 4.974 -2.051 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.809 3.833 -0.766 1.00 0.00 H new ATOM 803 N ILE A 60 3.663 0.799 -3.355 1.00 0.00 N ATOM 804 CA ILE A 60 4.235 -0.540 -3.287 1.00 0.00 C ATOM 805 C ILE A 60 5.744 -0.505 -3.504 1.00 0.00 C ATOM 806 O ILE A 60 6.219 -0.142 -4.580 1.00 0.00 O ATOM 807 CB ILE A 60 3.599 -1.477 -4.332 1.00 0.00 C ATOM 808 CG1 ILE A 60 2.093 -1.595 -4.093 1.00 0.00 C ATOM 809 CG2 ILE A 60 4.258 -2.847 -4.284 1.00 0.00 C ATOM 810 CD1 ILE A 60 1.303 -1.888 -5.349 1.00 0.00 C ATOM 0 H ILE A 60 3.414 1.104 -4.296 1.00 0.00 H new ATOM 0 HA ILE A 60 4.023 -0.924 -2.289 1.00 0.00 H new ATOM 0 HB ILE A 60 3.758 -1.054 -5.324 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.910 -2.386 -3.365 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.729 -0.666 -3.653 1.00 0.00 H new ATOM 0 HG21 ILE A 60 3.798 -3.498 -5.028 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.322 -2.747 -4.498 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.126 -3.280 -3.292 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.243 -1.958 -5.104 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.456 -1.086 -6.071 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.639 -2.832 -5.779 1.00 0.00 H new ATOM 822 N TYR A 61 6.493 -0.886 -2.475 1.00 0.00 N ATOM 823 CA TYR A 61 7.949 -0.898 -2.552 1.00 0.00 C ATOM 824 C TYR A 61 8.480 -2.327 -2.599 1.00 0.00 C ATOM 825 O TYR A 61 8.382 -3.072 -1.622 1.00 0.00 O ATOM 826 CB TYR A 61 8.549 -0.158 -1.356 1.00 0.00 C ATOM 827 CG TYR A 61 10.052 -0.292 -1.254 1.00 0.00 C ATOM 828 CD1 TYR A 61 10.895 0.575 -1.938 1.00 0.00 C ATOM 829 CD2 TYR A 61 10.629 -1.285 -0.472 1.00 0.00 C ATOM 830 CE1 TYR A 61 12.268 0.456 -1.847 1.00 0.00 C ATOM 831 CE2 TYR A 61 12.001 -1.411 -0.374 1.00 0.00 C ATOM 832 CZ TYR A 61 12.816 -0.538 -1.064 1.00 0.00 C ATOM 833 OH TYR A 61 14.184 -0.660 -0.971 1.00 0.00 O ATOM 0 H TYR A 61 6.116 -1.191 -1.578 1.00 0.00 H new ATOM 0 HA TYR A 61 8.244 -0.390 -3.470 1.00 0.00 H new ATOM 0 HB2 TYR A 61 8.291 0.899 -1.426 1.00 0.00 H new ATOM 0 HB3 TYR A 61 8.096 -0.537 -0.440 1.00 0.00 H new ATOM 0 HD1 TYR A 61 10.469 1.355 -2.551 1.00 0.00 H new ATOM 0 HD2 TYR A 61 9.993 -1.971 0.069 1.00 0.00 H new ATOM 0 HE1 TYR A 61 12.909 1.138 -2.386 1.00 0.00 H new ATOM 0 HE2 TYR A 61 12.433 -2.188 0.239 1.00 0.00 H new ATOM 0 HH TYR A 61 14.407 -1.498 -0.514 1.00 0.00 H new ATOM 843 N LEU A 62 9.044 -2.704 -3.741 1.00 0.00 N ATOM 844 CA LEU A 62 9.593 -4.044 -3.917 1.00 0.00 C ATOM 845 C LEU A 62 11.071 -4.081 -3.541 1.00 0.00 C ATOM 846 O LEU A 62 11.922 -3.581 -4.277 1.00 0.00 O ATOM 847 CB LEU A 62 9.412 -4.504 -5.365 1.00 0.00 C ATOM 848 CG LEU A 62 7.976 -4.516 -5.891 1.00 0.00 C ATOM 849 CD1 LEU A 62 7.963 -4.642 -7.406 1.00 0.00 C ATOM 850 CD2 LEU A 62 7.184 -5.648 -5.253 1.00 0.00 C ATOM 0 H LEU A 62 9.133 -2.101 -4.559 1.00 0.00 H new ATOM 0 HA LEU A 62 9.052 -4.721 -3.256 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.008 -3.856 -6.008 1.00 0.00 H new ATOM 0 HB3 LEU A 62 9.821 -5.510 -5.459 1.00 0.00 H new ATOM 0 HG LEU A 62 7.503 -3.571 -5.622 1.00 0.00 H new ATOM 0 HD11 LEU A 62 6.933 -4.649 -7.762 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.493 -3.797 -7.846 1.00 0.00 H new ATOM 0 HD13 LEU A 62 8.454 -5.570 -7.698 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.165 -5.641 -5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 62 7.656 -6.601 -5.491 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.163 -5.513 -4.172 1.00 0.00 H new ATOM 862 N HIS A 63 11.369 -4.679 -2.392 1.00 0.00 N ATOM 863 CA HIS A 63 12.745 -4.784 -1.920 1.00 0.00 C ATOM 864 C HIS A 63 13.442 -5.992 -2.540 1.00 0.00 C ATOM 865 O HIS A 63 13.020 -7.133 -2.344 1.00 0.00 O ATOM 866 CB HIS A 63 12.776 -4.890 -0.395 1.00 0.00 C ATOM 867 CG HIS A 63 14.116 -4.582 0.200 1.00 0.00 C ATOM 868 ND1 HIS A 63 14.565 -3.296 0.416 1.00 0.00 N ATOM 869 CD2 HIS A 63 15.105 -5.402 0.627 1.00 0.00 C ATOM 870 CE1 HIS A 63 15.774 -3.339 0.948 1.00 0.00 C ATOM 871 NE2 HIS A 63 16.124 -4.605 1.086 1.00 0.00 N ATOM 0 H HIS A 63 10.677 -5.098 -1.771 1.00 0.00 H new ATOM 0 HA HIS A 63 13.278 -3.883 -2.225 1.00 0.00 H new ATOM 0 HB2 HIS A 63 12.036 -4.208 0.023 1.00 0.00 H new ATOM 0 HB3 HIS A 63 12.481 -5.898 -0.103 1.00 0.00 H new ATOM 0 HD2 HIS A 63 15.094 -6.482 0.610 1.00 0.00 H new ATOM 0 HE1 HIS A 63 16.374 -2.484 1.223 1.00 0.00 H new ATOM 0 HE2 HIS A 63 17.008 -4.937 1.471 1.00 0.00 H new ATOM 879 N HIS A 64 14.509 -5.734 -3.288 1.00 0.00 N ATOM 880 CA HIS A 64 15.264 -6.800 -3.937 1.00 0.00 C ATOM 881 C HIS A 64 16.747 -6.704 -3.591 1.00 0.00 C ATOM 882 O HIS A 64 17.395 -5.694 -3.866 1.00 0.00 O ATOM 883 CB HIS A 64 15.078 -6.735 -5.453 1.00 0.00 C ATOM 884 CG HIS A 64 15.126 -8.076 -6.120 1.00 0.00 C ATOM 885 ND1 HIS A 64 16.279 -8.608 -6.657 1.00 0.00 N ATOM 886 CD2 HIS A 64 14.154 -8.993 -6.334 1.00 0.00 C ATOM 887 CE1 HIS A 64 16.014 -9.795 -7.174 1.00 0.00 C ATOM 888 NE2 HIS A 64 14.732 -10.052 -6.990 1.00 0.00 N ATOM 0 H HIS A 64 14.871 -4.796 -3.460 1.00 0.00 H new ATOM 0 HA HIS A 64 14.884 -7.754 -3.572 1.00 0.00 H new ATOM 0 HB2 HIS A 64 14.121 -6.263 -5.674 1.00 0.00 H new ATOM 0 HB3 HIS A 64 15.853 -6.098 -5.879 1.00 0.00 H new ATOM 0 HD2 HIS A 64 13.117 -8.908 -6.043 1.00 0.00 H new ATOM 0 HE1 HIS A 64 16.725 -10.444 -7.664 1.00 0.00 H new ATOM 0 HE2 HIS A 64 14.249 -10.900 -7.287 1.00 0.00 H new ATOM 896 N ASP A 65 17.277 -7.761 -2.984 1.00 0.00 N ATOM 897 CA ASP A 65 18.683 -7.796 -2.600 1.00 0.00 C ATOM 898 C ASP A 65 19.581 -7.859 -3.831 1.00 0.00 C ATOM 899 O ASP A 65 20.453 -7.011 -4.019 1.00 0.00 O ATOM 900 CB ASP A 65 18.956 -8.996 -1.692 1.00 0.00 C ATOM 901 CG ASP A 65 20.119 -8.757 -0.750 1.00 0.00 C ATOM 902 OD1 ASP A 65 21.182 -8.302 -1.222 1.00 0.00 O ATOM 903 OD2 ASP A 65 19.966 -9.024 0.461 1.00 0.00 O ATOM 0 H ASP A 65 16.754 -8.604 -2.748 1.00 0.00 H new ATOM 0 HA ASP A 65 18.908 -6.879 -2.055 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.061 -9.219 -1.111 1.00 0.00 H new ATOM 0 HB3 ASP A 65 19.164 -9.872 -2.306 1.00 0.00 H new ATOM 908 N GLU A 66 19.363 -8.871 -4.666 1.00 0.00 N ATOM 909 CA GLU A 66 20.154 -9.045 -5.878 1.00 0.00 C ATOM 910 C GLU A 66 20.561 -7.694 -6.461 1.00 0.00 C ATOM 911 O GLU A 66 21.712 -7.495 -6.848 1.00 0.00 O ATOM 912 CB GLU A 66 19.367 -9.845 -6.918 1.00 0.00 C ATOM 913 CG GLU A 66 19.164 -11.302 -6.538 1.00 0.00 C ATOM 914 CD GLU A 66 18.927 -12.191 -7.743 1.00 0.00 C ATOM 915 OE1 GLU A 66 18.225 -11.749 -8.677 1.00 0.00 O ATOM 916 OE2 GLU A 66 19.442 -13.329 -7.753 1.00 0.00 O ATOM 0 H GLU A 66 18.645 -9.582 -4.525 1.00 0.00 H new ATOM 0 HA GLU A 66 21.057 -9.595 -5.615 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.393 -9.377 -7.064 1.00 0.00 H new ATOM 0 HB3 GLU A 66 19.890 -9.797 -7.873 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.040 -11.658 -5.995 1.00 0.00 H new ATOM 0 HG3 GLU A 66 18.315 -11.382 -5.860 1.00 0.00 H new ATOM 923 N SER A 67 19.607 -6.771 -6.521 1.00 0.00 N ATOM 924 CA SER A 67 19.864 -5.441 -7.060 1.00 0.00 C ATOM 925 C SER A 67 20.979 -4.746 -6.285 1.00 0.00 C ATOM 926 O SER A 67 21.046 -4.834 -5.059 1.00 0.00 O ATOM 927 CB SER A 67 18.590 -4.594 -7.014 1.00 0.00 C ATOM 928 OG SER A 67 18.863 -3.244 -7.350 1.00 0.00 O ATOM 0 H SER A 67 18.649 -6.920 -6.203 1.00 0.00 H new ATOM 0 HA SER A 67 20.181 -5.551 -8.097 1.00 0.00 H new ATOM 0 HB2 SER A 67 17.853 -5.002 -7.705 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.153 -4.643 -6.017 1.00 0.00 H new ATOM 0 HG SER A 67 18.025 -2.785 -7.567 1.00 0.00 H new ATOM 934 N VAL A 68 21.852 -4.054 -7.009 1.00 0.00 N ATOM 935 CA VAL A 68 22.965 -3.342 -6.391 1.00 0.00 C ATOM 936 C VAL A 68 22.574 -1.911 -6.040 1.00 0.00 C ATOM 937 O VAL A 68 23.132 -1.311 -5.120 1.00 0.00 O ATOM 938 CB VAL A 68 24.196 -3.314 -7.315 1.00 0.00 C ATOM 939 CG1 VAL A 68 24.705 -4.725 -7.571 1.00 0.00 C ATOM 940 CG2 VAL A 68 23.864 -2.614 -8.624 1.00 0.00 C ATOM 0 H VAL A 68 21.810 -3.971 -8.025 1.00 0.00 H new ATOM 0 HA VAL A 68 23.218 -3.881 -5.478 1.00 0.00 H new ATOM 0 HB VAL A 68 24.987 -2.752 -6.819 1.00 0.00 H new ATOM 0 HG11 VAL A 68 25.575 -4.685 -8.226 1.00 0.00 H new ATOM 0 HG12 VAL A 68 24.984 -5.188 -6.625 1.00 0.00 H new ATOM 0 HG13 VAL A 68 23.921 -5.314 -8.046 1.00 0.00 H new ATOM 0 HG21 VAL A 68 24.746 -2.603 -9.265 1.00 0.00 H new ATOM 0 HG22 VAL A 68 23.056 -3.146 -9.127 1.00 0.00 H new ATOM 0 HG23 VAL A 68 23.552 -1.590 -8.420 1.00 0.00 H new ATOM 950 N LEU A 69 21.612 -1.368 -6.778 1.00 0.00 N ATOM 951 CA LEU A 69 21.145 -0.006 -6.545 1.00 0.00 C ATOM 952 C LEU A 69 20.463 0.111 -5.185 1.00 0.00 C ATOM 953 O LEU A 69 20.747 1.026 -4.412 1.00 0.00 O ATOM 954 CB LEU A 69 20.178 0.419 -7.651 1.00 0.00 C ATOM 955 CG LEU A 69 20.808 1.093 -8.871 1.00 0.00 C ATOM 956 CD1 LEU A 69 19.757 1.358 -9.937 1.00 0.00 C ATOM 957 CD2 LEU A 69 21.500 2.387 -8.467 1.00 0.00 C ATOM 0 H LEU A 69 21.140 -1.850 -7.543 1.00 0.00 H new ATOM 0 HA LEU A 69 22.011 0.655 -6.555 1.00 0.00 H new ATOM 0 HB2 LEU A 69 19.634 -0.463 -7.989 1.00 0.00 H new ATOM 0 HB3 LEU A 69 19.444 1.102 -7.222 1.00 0.00 H new ATOM 0 HG LEU A 69 21.556 0.419 -9.289 1.00 0.00 H new ATOM 0 HD11 LEU A 69 20.224 1.838 -10.797 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.308 0.415 -10.247 1.00 0.00 H new ATOM 0 HD13 LEU A 69 18.985 2.012 -9.532 1.00 0.00 H new ATOM 0 HD21 LEU A 69 21.943 2.853 -9.347 1.00 0.00 H new ATOM 0 HD22 LEU A 69 20.772 3.066 -8.024 1.00 0.00 H new ATOM 0 HD23 LEU A 69 22.282 2.170 -7.740 1.00 0.00 H new ATOM 969 N THR A 70 19.563 -0.825 -4.898 1.00 0.00 N ATOM 970 CA THR A 70 18.841 -0.828 -3.632 1.00 0.00 C ATOM 971 C THR A 70 19.701 -0.262 -2.508 1.00 0.00 C ATOM 972 O THR A 70 19.227 0.522 -1.686 1.00 0.00 O ATOM 973 CB THR A 70 18.385 -2.248 -3.249 1.00 0.00 C ATOM 974 OG1 THR A 70 17.542 -2.786 -4.275 1.00 0.00 O ATOM 975 CG2 THR A 70 17.637 -2.238 -1.925 1.00 0.00 C ATOM 0 H THR A 70 19.317 -1.591 -5.526 1.00 0.00 H new ATOM 0 HA THR A 70 17.963 -0.197 -3.767 1.00 0.00 H new ATOM 0 HB THR A 70 19.271 -2.873 -3.143 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.461 -3.756 -4.157 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.325 -3.252 -1.676 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.291 -1.856 -1.141 1.00 0.00 H new ATOM 0 HG23 THR A 70 16.758 -1.598 -2.008 1.00 0.00 H new ATOM 983 N ASN A 71 20.967 -0.664 -2.478 1.00 0.00 N ATOM 984 CA ASN A 71 21.894 -0.196 -1.453 1.00 0.00 C ATOM 985 C ASN A 71 21.833 1.323 -1.318 1.00 0.00 C ATOM 986 O ASN A 71 21.623 1.852 -0.226 1.00 0.00 O ATOM 987 CB ASN A 71 23.321 -0.633 -1.789 1.00 0.00 C ATOM 988 CG ASN A 71 24.040 0.370 -2.671 1.00 0.00 C ATOM 989 OD1 ASN A 71 23.625 0.629 -3.801 1.00 0.00 O ATOM 990 ND2 ASN A 71 25.124 0.939 -2.158 1.00 0.00 N ATOM 0 H ASN A 71 21.375 -1.313 -3.151 1.00 0.00 H new ATOM 0 HA ASN A 71 21.600 -0.640 -0.502 1.00 0.00 H new ATOM 0 HB2 ASN A 71 23.883 -0.769 -0.865 1.00 0.00 H new ATOM 0 HB3 ASN A 71 23.293 -1.600 -2.291 1.00 0.00 H new ATOM 0 HD21 ASN A 71 25.649 1.621 -2.705 1.00 0.00 H new ATOM 0 HD22 ASN A 71 25.432 0.694 -1.217 1.00 0.00 H new ATOM 997 N VAL A 72 22.018 2.019 -2.435 1.00 0.00 N ATOM 998 CA VAL A 72 21.982 3.476 -2.442 1.00 0.00 C ATOM 999 C VAL A 72 20.552 3.991 -2.562 1.00 0.00 C ATOM 1000 O VAL A 72 20.150 4.909 -1.847 1.00 0.00 O ATOM 1001 CB VAL A 72 22.821 4.052 -3.598 1.00 0.00 C ATOM 1002 CG1 VAL A 72 24.261 3.571 -3.505 1.00 0.00 C ATOM 1003 CG2 VAL A 72 22.210 3.675 -4.939 1.00 0.00 C ATOM 0 H VAL A 72 22.194 1.597 -3.347 1.00 0.00 H new ATOM 0 HA VAL A 72 22.406 3.807 -1.494 1.00 0.00 H new ATOM 0 HB VAL A 72 22.821 5.139 -3.517 1.00 0.00 H new ATOM 0 HG11 VAL A 72 24.838 3.988 -4.330 1.00 0.00 H new ATOM 0 HG12 VAL A 72 24.693 3.897 -2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 72 24.285 2.483 -3.559 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.816 4.090 -5.744 1.00 0.00 H new ATOM 0 HG22 VAL A 72 22.178 2.589 -5.032 1.00 0.00 H new ATOM 0 HG23 VAL A 72 21.198 4.075 -5.003 1.00 0.00 H new ATOM 1013 N PHE A 73 19.788 3.393 -3.469 1.00 0.00 N ATOM 1014 CA PHE A 73 18.401 3.791 -3.683 1.00 0.00 C ATOM 1015 C PHE A 73 17.709 4.084 -2.355 1.00 0.00 C ATOM 1016 O PHE A 73 16.868 4.980 -2.266 1.00 0.00 O ATOM 1017 CB PHE A 73 17.644 2.694 -4.435 1.00 0.00 C ATOM 1018 CG PHE A 73 16.162 2.930 -4.507 1.00 0.00 C ATOM 1019 CD1 PHE A 73 15.384 2.886 -3.361 1.00 0.00 C ATOM 1020 CD2 PHE A 73 15.548 3.197 -5.720 1.00 0.00 C ATOM 1021 CE1 PHE A 73 14.020 3.102 -3.425 1.00 0.00 C ATOM 1022 CE2 PHE A 73 14.185 3.415 -5.789 1.00 0.00 C ATOM 1023 CZ PHE A 73 13.420 3.368 -4.640 1.00 0.00 C ATOM 0 H PHE A 73 20.105 2.631 -4.068 1.00 0.00 H new ATOM 0 HA PHE A 73 18.398 4.701 -4.283 1.00 0.00 H new ATOM 0 HB2 PHE A 73 18.041 2.618 -5.447 1.00 0.00 H new ATOM 0 HB3 PHE A 73 17.828 1.737 -3.947 1.00 0.00 H new ATOM 0 HD1 PHE A 73 15.848 2.681 -2.408 1.00 0.00 H new ATOM 0 HD2 PHE A 73 16.141 3.235 -6.622 1.00 0.00 H new ATOM 0 HE1 PHE A 73 13.424 3.063 -2.525 1.00 0.00 H new ATOM 0 HE2 PHE A 73 13.718 3.622 -6.741 1.00 0.00 H new ATOM 0 HZ PHE A 73 12.355 3.539 -4.692 1.00 0.00 H new ATOM 1033 N CYS A 74 18.067 3.323 -1.327 1.00 0.00 N ATOM 1034 CA CYS A 74 17.480 3.500 -0.004 1.00 0.00 C ATOM 1035 C CYS A 74 18.301 4.478 0.829 1.00 0.00 C ATOM 1036 O CYS A 74 17.752 5.278 1.587 1.00 0.00 O ATOM 1037 CB CYS A 74 17.382 2.154 0.717 1.00 0.00 C ATOM 1038 SG CYS A 74 18.973 1.333 0.968 1.00 0.00 S ATOM 0 H CYS A 74 18.761 2.578 -1.384 1.00 0.00 H new ATOM 0 HA CYS A 74 16.478 3.911 -0.130 1.00 0.00 H new ATOM 0 HB2 CYS A 74 16.907 2.307 1.686 1.00 0.00 H new ATOM 0 HB3 CYS A 74 16.731 1.494 0.144 1.00 0.00 H new ATOM 0 HG CYS A 74 18.868 0.469 1.934 1.00 0.00 H new ATOM 1044 N SER A 75 19.621 4.407 0.685 1.00 0.00 N ATOM 1045 CA SER A 75 20.519 5.283 1.429 1.00 0.00 C ATOM 1046 C SER A 75 20.491 6.699 0.861 1.00 0.00 C ATOM 1047 O SER A 75 21.003 7.635 1.474 1.00 0.00 O ATOM 1048 CB SER A 75 21.947 4.734 1.392 1.00 0.00 C ATOM 1049 OG SER A 75 22.104 3.660 2.303 1.00 0.00 O ATOM 0 H SER A 75 20.092 3.752 0.060 1.00 0.00 H new ATOM 0 HA SER A 75 20.178 5.319 2.464 1.00 0.00 H new ATOM 0 HB2 SER A 75 22.184 4.397 0.383 1.00 0.00 H new ATOM 0 HB3 SER A 75 22.652 5.529 1.637 1.00 0.00 H new ATOM 0 HG SER A 75 22.038 2.810 1.820 1.00 0.00 H new ATOM 1055 N GLN A 76 19.890 6.846 -0.315 1.00 0.00 N ATOM 1056 CA GLN A 76 19.795 8.146 -0.967 1.00 0.00 C ATOM 1057 C GLN A 76 18.358 8.658 -0.957 1.00 0.00 C ATOM 1058 O GLN A 76 18.115 9.849 -0.770 1.00 0.00 O ATOM 1059 CB GLN A 76 20.307 8.058 -2.406 1.00 0.00 C ATOM 1060 CG GLN A 76 21.772 7.665 -2.507 1.00 0.00 C ATOM 1061 CD GLN A 76 22.708 8.796 -2.129 1.00 0.00 C ATOM 1062 OE1 GLN A 76 22.295 9.778 -1.511 1.00 0.00 O ATOM 1063 NE2 GLN A 76 23.976 8.664 -2.499 1.00 0.00 N ATOM 0 H GLN A 76 19.462 6.081 -0.836 1.00 0.00 H new ATOM 0 HA GLN A 76 20.415 8.848 -0.410 1.00 0.00 H new ATOM 0 HB2 GLN A 76 19.706 7.332 -2.953 1.00 0.00 H new ATOM 0 HB3 GLN A 76 20.164 9.022 -2.894 1.00 0.00 H new ATOM 0 HG2 GLN A 76 21.960 6.810 -1.857 1.00 0.00 H new ATOM 0 HG3 GLN A 76 21.989 7.345 -3.526 1.00 0.00 H new ATOM 0 HE21 GLN A 76 24.274 7.833 -3.010 1.00 0.00 H new ATOM 0 HE22 GLN A 76 24.652 9.393 -2.272 1.00 0.00 H new ATOM 1072 N MET A 77 17.411 7.748 -1.159 1.00 0.00 N ATOM 1073 CA MET A 77 15.997 8.108 -1.172 1.00 0.00 C ATOM 1074 C MET A 77 15.340 7.777 0.164 1.00 0.00 C ATOM 1075 O MET A 77 14.651 8.612 0.752 1.00 0.00 O ATOM 1076 CB MET A 77 15.273 7.377 -2.304 1.00 0.00 C ATOM 1077 CG MET A 77 15.981 7.482 -3.646 1.00 0.00 C ATOM 1078 SD MET A 77 14.994 6.828 -5.005 1.00 0.00 S ATOM 1079 CE MET A 77 16.277 6.189 -6.079 1.00 0.00 C ATOM 0 H MET A 77 17.596 6.757 -1.316 1.00 0.00 H new ATOM 0 HA MET A 77 15.923 9.183 -1.337 1.00 0.00 H new ATOM 0 HB2 MET A 77 15.169 6.325 -2.038 1.00 0.00 H new ATOM 0 HB3 MET A 77 14.266 7.782 -2.401 1.00 0.00 H new ATOM 0 HG2 MET A 77 16.220 8.527 -3.846 1.00 0.00 H new ATOM 0 HG3 MET A 77 16.927 6.942 -3.597 1.00 0.00 H new ATOM 0 HE1 MET A 77 15.823 5.612 -6.885 1.00 0.00 H new ATOM 0 HE2 MET A 77 16.844 7.018 -6.502 1.00 0.00 H new ATOM 0 HE3 MET A 77 16.946 5.547 -5.505 1.00 0.00 H new ATOM 1089 N LEU A 78 15.556 6.555 0.638 1.00 0.00 N ATOM 1090 CA LEU A 78 14.984 6.114 1.906 1.00 0.00 C ATOM 1091 C LEU A 78 15.839 6.579 3.080 1.00 0.00 C ATOM 1092 O LEU A 78 15.718 6.063 4.192 1.00 0.00 O ATOM 1093 CB LEU A 78 14.854 4.590 1.926 1.00 0.00 C ATOM 1094 CG LEU A 78 13.854 3.988 0.939 1.00 0.00 C ATOM 1095 CD1 LEU A 78 14.011 2.477 0.874 1.00 0.00 C ATOM 1096 CD2 LEU A 78 12.431 4.362 1.327 1.00 0.00 C ATOM 0 H LEU A 78 16.123 5.852 0.164 1.00 0.00 H new ATOM 0 HA LEU A 78 13.994 6.558 2.004 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.835 4.159 1.726 1.00 0.00 H new ATOM 0 HB3 LEU A 78 14.570 4.283 2.933 1.00 0.00 H new ATOM 0 HG LEU A 78 14.059 4.396 -0.051 1.00 0.00 H new ATOM 0 HD11 LEU A 78 13.291 2.066 0.166 1.00 0.00 H new ATOM 0 HD12 LEU A 78 15.021 2.230 0.548 1.00 0.00 H new ATOM 0 HD13 LEU A 78 13.834 2.050 1.861 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.733 3.925 0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 78 12.215 3.983 2.326 1.00 0.00 H new ATOM 0 HD23 LEU A 78 12.325 5.447 1.320 1.00 0.00 H new ATOM 1108 N CYS A 79 16.702 7.557 2.827 1.00 0.00 N ATOM 1109 CA CYS A 79 17.576 8.093 3.864 1.00 0.00 C ATOM 1110 C CYS A 79 17.093 9.463 4.328 1.00 0.00 C ATOM 1111 O CYS A 79 17.390 9.892 5.443 1.00 0.00 O ATOM 1112 CB CYS A 79 19.012 8.193 3.347 1.00 0.00 C ATOM 1113 SG CYS A 79 19.353 9.697 2.402 1.00 0.00 S ATOM 0 H CYS A 79 16.815 7.995 1.913 1.00 0.00 H new ATOM 0 HA CYS A 79 17.550 7.412 4.715 1.00 0.00 H new ATOM 0 HB2 CYS A 79 19.696 8.146 4.194 1.00 0.00 H new ATOM 0 HB3 CYS A 79 19.222 7.327 2.719 1.00 0.00 H new ATOM 0 HG CYS A 79 20.392 9.507 1.644 1.00 0.00 H new ATOM 1119 N ALA A 80 16.349 10.146 3.465 1.00 0.00 N ATOM 1120 CA ALA A 80 15.824 11.467 3.787 1.00 0.00 C ATOM 1121 C ALA A 80 14.608 11.367 4.702 1.00 0.00 C ATOM 1122 O ALA A 80 13.665 10.630 4.417 1.00 0.00 O ATOM 1123 CB ALA A 80 15.467 12.218 2.512 1.00 0.00 C ATOM 0 H ALA A 80 16.096 9.806 2.537 1.00 0.00 H new ATOM 0 HA ALA A 80 16.600 12.020 4.317 1.00 0.00 H new ATOM 0 HB1 ALA A 80 15.076 13.203 2.767 1.00 0.00 H new ATOM 0 HB2 ALA A 80 16.358 12.330 1.894 1.00 0.00 H new ATOM 0 HB3 ALA A 80 14.711 11.659 1.960 1.00 0.00 H new ATOM 1129 N GLU A 81 14.638 12.114 5.802 1.00 0.00 N ATOM 1130 CA GLU A 81 13.538 12.107 6.759 1.00 0.00 C ATOM 1131 C GLU A 81 12.267 12.672 6.131 1.00 0.00 C ATOM 1132 O GLU A 81 11.170 12.163 6.360 1.00 0.00 O ATOM 1133 CB GLU A 81 13.910 12.917 8.003 1.00 0.00 C ATOM 1134 CG GLU A 81 14.953 12.243 8.879 1.00 0.00 C ATOM 1135 CD GLU A 81 14.983 12.805 10.287 1.00 0.00 C ATOM 1136 OE1 GLU A 81 14.016 12.566 11.041 1.00 0.00 O ATOM 1137 OE2 GLU A 81 15.972 13.483 10.635 1.00 0.00 O ATOM 0 H GLU A 81 15.411 12.731 6.052 1.00 0.00 H new ATOM 0 HA GLU A 81 13.350 11.074 7.050 1.00 0.00 H new ATOM 0 HB2 GLU A 81 14.284 13.893 7.693 1.00 0.00 H new ATOM 0 HB3 GLU A 81 13.011 13.094 8.594 1.00 0.00 H new ATOM 0 HG2 GLU A 81 14.749 11.173 8.923 1.00 0.00 H new ATOM 0 HG3 GLU A 81 15.936 12.361 8.423 1.00 0.00 H new ATOM 1144 N SER A 82 12.425 13.729 5.340 1.00 0.00 N ATOM 1145 CA SER A 82 11.290 14.367 4.683 1.00 0.00 C ATOM 1146 C SER A 82 10.611 13.403 3.715 1.00 0.00 C ATOM 1147 O SER A 82 9.392 13.438 3.541 1.00 0.00 O ATOM 1148 CB SER A 82 11.746 15.621 3.935 1.00 0.00 C ATOM 1149 OG SER A 82 10.673 16.529 3.760 1.00 0.00 O ATOM 0 H SER A 82 13.327 14.161 5.139 1.00 0.00 H new ATOM 0 HA SER A 82 10.570 14.652 5.450 1.00 0.00 H new ATOM 0 HB2 SER A 82 12.550 16.106 4.488 1.00 0.00 H new ATOM 0 HB3 SER A 82 12.152 15.341 2.963 1.00 0.00 H new ATOM 0 HG SER A 82 10.991 17.323 3.281 1.00 0.00 H new ATOM 1155 N ILE A 83 11.408 12.545 3.088 1.00 0.00 N ATOM 1156 CA ILE A 83 10.884 11.571 2.138 1.00 0.00 C ATOM 1157 C ILE A 83 10.200 10.413 2.858 1.00 0.00 C ATOM 1158 O ILE A 83 9.016 10.151 2.649 1.00 0.00 O ATOM 1159 CB ILE A 83 11.998 11.011 1.234 1.00 0.00 C ATOM 1160 CG1 ILE A 83 12.676 12.145 0.462 1.00 0.00 C ATOM 1161 CG2 ILE A 83 11.431 9.975 0.274 1.00 0.00 C ATOM 1162 CD1 ILE A 83 11.787 12.781 -0.583 1.00 0.00 C ATOM 0 H ILE A 83 12.419 12.504 3.220 1.00 0.00 H new ATOM 0 HA ILE A 83 10.154 12.094 1.520 1.00 0.00 H new ATOM 0 HB ILE A 83 12.745 10.526 1.862 1.00 0.00 H new ATOM 0 HG12 ILE A 83 12.999 12.911 1.167 1.00 0.00 H new ATOM 0 HG13 ILE A 83 13.573 11.758 -0.022 1.00 0.00 H new ATOM 0 HG21 ILE A 83 12.231 9.589 -0.358 1.00 0.00 H new ATOM 0 HG22 ILE A 83 10.989 9.156 0.842 1.00 0.00 H new ATOM 0 HG23 ILE A 83 10.666 10.437 -0.350 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.333 13.576 -1.090 1.00 0.00 H new ATOM 0 HD12 ILE A 83 11.484 12.028 -1.310 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.902 13.198 -0.103 1.00 0.00 H new ATOM 1174 N VAL A 84 10.953 9.725 3.710 1.00 0.00 N ATOM 1175 CA VAL A 84 10.419 8.598 4.465 1.00 0.00 C ATOM 1176 C VAL A 84 9.174 9.000 5.247 1.00 0.00 C ATOM 1177 O VAL A 84 8.245 8.209 5.404 1.00 0.00 O ATOM 1178 CB VAL A 84 11.466 8.031 5.443 1.00 0.00 C ATOM 1179 CG1 VAL A 84 12.717 7.598 4.694 1.00 0.00 C ATOM 1180 CG2 VAL A 84 11.803 9.057 6.514 1.00 0.00 C ATOM 0 H VAL A 84 11.935 9.929 3.895 1.00 0.00 H new ATOM 0 HA VAL A 84 10.155 7.828 3.740 1.00 0.00 H new ATOM 0 HB VAL A 84 11.044 7.153 5.933 1.00 0.00 H new ATOM 0 HG11 VAL A 84 13.445 7.200 5.401 1.00 0.00 H new ATOM 0 HG12 VAL A 84 12.458 6.827 3.968 1.00 0.00 H new ATOM 0 HG13 VAL A 84 13.146 8.456 4.176 1.00 0.00 H new ATOM 0 HG21 VAL A 84 12.544 8.641 7.197 1.00 0.00 H new ATOM 0 HG22 VAL A 84 12.206 9.954 6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 84 10.901 9.313 7.070 1.00 0.00 H new ATOM 1190 N SER A 85 9.162 10.236 5.735 1.00 0.00 N ATOM 1191 CA SER A 85 8.032 10.744 6.504 1.00 0.00 C ATOM 1192 C SER A 85 6.872 11.113 5.585 1.00 0.00 C ATOM 1193 O SER A 85 5.767 10.585 5.719 1.00 0.00 O ATOM 1194 CB SER A 85 8.454 11.963 7.327 1.00 0.00 C ATOM 1195 OG SER A 85 7.574 12.172 8.417 1.00 0.00 O ATOM 0 H SER A 85 9.922 10.905 5.611 1.00 0.00 H new ATOM 0 HA SER A 85 7.701 9.956 7.180 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.469 11.822 7.697 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.467 12.848 6.691 1.00 0.00 H new ATOM 0 HG SER A 85 7.866 12.955 8.928 1.00 0.00 H new ATOM 1201 N TYR A 86 7.130 12.023 4.653 1.00 0.00 N ATOM 1202 CA TYR A 86 6.108 12.466 3.713 1.00 0.00 C ATOM 1203 C TYR A 86 5.423 11.274 3.051 1.00 0.00 C ATOM 1204 O TYR A 86 4.196 11.218 2.961 1.00 0.00 O ATOM 1205 CB TYR A 86 6.724 13.371 2.645 1.00 0.00 C ATOM 1206 CG TYR A 86 5.703 14.019 1.738 1.00 0.00 C ATOM 1207 CD1 TYR A 86 5.035 13.278 0.771 1.00 0.00 C ATOM 1208 CD2 TYR A 86 5.407 15.373 1.846 1.00 0.00 C ATOM 1209 CE1 TYR A 86 4.102 13.866 -0.061 1.00 0.00 C ATOM 1210 CE2 TYR A 86 4.475 15.968 1.020 1.00 0.00 C ATOM 1211 CZ TYR A 86 3.825 15.211 0.067 1.00 0.00 C ATOM 1212 OH TYR A 86 2.896 15.801 -0.759 1.00 0.00 O ATOM 0 H TYR A 86 8.039 12.469 4.528 1.00 0.00 H new ATOM 0 HA TYR A 86 5.359 13.030 4.270 1.00 0.00 H new ATOM 0 HB2 TYR A 86 7.309 14.150 3.134 1.00 0.00 H new ATOM 0 HB3 TYR A 86 7.416 12.785 2.039 1.00 0.00 H new ATOM 0 HD1 TYR A 86 5.249 12.224 0.668 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.915 15.970 2.589 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.592 13.275 -0.808 1.00 0.00 H new ATOM 0 HE2 TYR A 86 4.256 17.021 1.119 1.00 0.00 H new ATOM 0 HH TYR A 86 2.819 16.752 -0.537 1.00 0.00 H new ATOM 1222 N LEU A 87 6.226 10.321 2.589 1.00 0.00 N ATOM 1223 CA LEU A 87 5.700 9.128 1.935 1.00 0.00 C ATOM 1224 C LEU A 87 4.949 8.248 2.930 1.00 0.00 C ATOM 1225 O LEU A 87 3.958 7.607 2.582 1.00 0.00 O ATOM 1226 CB LEU A 87 6.836 8.333 1.290 1.00 0.00 C ATOM 1227 CG LEU A 87 6.479 6.928 0.801 1.00 0.00 C ATOM 1228 CD1 LEU A 87 5.874 6.987 -0.593 1.00 0.00 C ATOM 1229 CD2 LEU A 87 7.708 6.031 0.814 1.00 0.00 C ATOM 0 H LEU A 87 7.243 10.352 2.655 1.00 0.00 H new ATOM 0 HA LEU A 87 5.002 9.446 1.160 1.00 0.00 H new ATOM 0 HB2 LEU A 87 7.218 8.904 0.444 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.649 8.249 2.011 1.00 0.00 H new ATOM 0 HG LEU A 87 5.738 6.504 1.479 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.626 5.979 -0.925 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.969 7.595 -0.572 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.592 7.430 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.436 5.036 0.463 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.471 6.450 0.159 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.099 5.964 1.829 1.00 0.00 H new ATOM 1241 N SER A 88 5.428 8.224 4.170 1.00 0.00 N ATOM 1242 CA SER A 88 4.803 7.422 5.215 1.00 0.00 C ATOM 1243 C SER A 88 3.675 8.194 5.892 1.00 0.00 C ATOM 1244 O SER A 88 2.888 7.627 6.649 1.00 0.00 O ATOM 1245 CB SER A 88 5.844 7.001 6.255 1.00 0.00 C ATOM 1246 OG SER A 88 6.277 8.111 7.021 1.00 0.00 O ATOM 0 H SER A 88 6.247 8.751 4.475 1.00 0.00 H new ATOM 0 HA SER A 88 4.381 6.530 4.751 1.00 0.00 H new ATOM 0 HB2 SER A 88 5.419 6.244 6.914 1.00 0.00 H new ATOM 0 HB3 SER A 88 6.698 6.545 5.755 1.00 0.00 H new ATOM 0 HG SER A 88 7.237 8.249 6.883 1.00 0.00 H new ATOM 1252 N GLN A 89 3.605 9.492 5.613 1.00 0.00 N ATOM 1253 CA GLN A 89 2.575 10.343 6.195 1.00 0.00 C ATOM 1254 C GLN A 89 1.399 10.508 5.238 1.00 0.00 C ATOM 1255 O GLN A 89 0.262 10.180 5.573 1.00 0.00 O ATOM 1256 CB GLN A 89 3.155 11.714 6.549 1.00 0.00 C ATOM 1257 CG GLN A 89 2.174 12.859 6.355 1.00 0.00 C ATOM 1258 CD GLN A 89 2.394 13.989 7.341 1.00 0.00 C ATOM 1259 OE1 GLN A 89 2.788 15.092 6.960 1.00 0.00 O ATOM 1260 NE2 GLN A 89 2.141 13.721 8.616 1.00 0.00 N ATOM 0 H GLN A 89 4.249 9.976 4.988 1.00 0.00 H new ATOM 0 HA GLN A 89 2.215 9.862 7.105 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.486 11.702 7.588 1.00 0.00 H new ATOM 0 HB3 GLN A 89 4.038 11.895 5.936 1.00 0.00 H new ATOM 0 HG2 GLN A 89 2.267 13.244 5.340 1.00 0.00 H new ATOM 0 HG3 GLN A 89 1.157 12.483 6.461 1.00 0.00 H new ATOM 0 HE21 GLN A 89 1.816 12.793 8.887 1.00 0.00 H new ATOM 0 HE22 GLN A 89 2.271 14.443 9.325 1.00 0.00 H new ATOM 1269 N ASN A 90 1.683 11.019 4.043 1.00 0.00 N ATOM 1270 CA ASN A 90 0.648 11.228 3.037 1.00 0.00 C ATOM 1271 C ASN A 90 0.318 9.924 2.317 1.00 0.00 C ATOM 1272 O ASN A 90 -0.837 9.664 1.978 1.00 0.00 O ATOM 1273 CB ASN A 90 1.099 12.283 2.024 1.00 0.00 C ATOM 1274 CG ASN A 90 1.543 13.571 2.690 1.00 0.00 C ATOM 1275 OD1 ASN A 90 2.764 13.576 3.211 1.00 0.00 O flip ATOM 1276 ND2 ASN A 90 0.796 14.549 2.735 1.00 0.00 N flip ATOM 0 H ASN A 90 2.620 11.295 3.749 1.00 0.00 H new ATOM 0 HA ASN A 90 -0.251 11.580 3.543 1.00 0.00 H new ATOM 0 HB2 ASN A 90 1.920 11.883 1.428 1.00 0.00 H new ATOM 0 HB3 ASN A 90 0.280 12.496 1.336 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -0.135 14.499 2.321 1.00 0.00 H new ATOM 0 HD22 ASN A 90 1.108 15.409 3.186 1.00 0.00 H new ATOM 1283 N PHE A 91 1.340 9.106 2.087 1.00 0.00 N ATOM 1284 CA PHE A 91 1.160 7.829 1.407 1.00 0.00 C ATOM 1285 C PHE A 91 1.370 6.665 2.371 1.00 0.00 C ATOM 1286 O PHE A 91 1.860 6.849 3.486 1.00 0.00 O ATOM 1287 CB PHE A 91 2.130 7.712 0.230 1.00 0.00 C ATOM 1288 CG PHE A 91 1.753 8.567 -0.946 1.00 0.00 C ATOM 1289 CD1 PHE A 91 1.510 9.922 -0.784 1.00 0.00 C ATOM 1290 CD2 PHE A 91 1.640 8.017 -2.212 1.00 0.00 C ATOM 1291 CE1 PHE A 91 1.163 10.712 -1.864 1.00 0.00 C ATOM 1292 CE2 PHE A 91 1.293 8.802 -3.295 1.00 0.00 C ATOM 1293 CZ PHE A 91 1.053 10.151 -3.121 1.00 0.00 C ATOM 0 H PHE A 91 2.302 9.305 2.362 1.00 0.00 H new ATOM 0 HA PHE A 91 0.138 7.787 1.032 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.130 7.989 0.565 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.178 6.671 -0.089 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.593 10.366 0.197 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.825 6.963 -2.354 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.978 11.767 -1.725 1.00 0.00 H new ATOM 0 HE2 PHE A 91 1.209 8.361 -4.277 1.00 0.00 H new ATOM 0 HZ PHE A 91 0.780 10.766 -3.966 1.00 0.00 H new ATOM 1303 N ILE A 92 0.994 5.468 1.935 1.00 0.00 N ATOM 1304 CA ILE A 92 1.141 4.274 2.758 1.00 0.00 C ATOM 1305 C ILE A 92 2.433 3.534 2.427 1.00 0.00 C ATOM 1306 O ILE A 92 2.662 3.142 1.283 1.00 0.00 O ATOM 1307 CB ILE A 92 -0.048 3.313 2.575 1.00 0.00 C ATOM 1308 CG1 ILE A 92 -1.331 3.946 3.120 1.00 0.00 C ATOM 1309 CG2 ILE A 92 0.230 1.987 3.266 1.00 0.00 C ATOM 1310 CD1 ILE A 92 -1.352 4.065 4.627 1.00 0.00 C ATOM 0 H ILE A 92 0.585 5.299 1.016 1.00 0.00 H new ATOM 0 HA ILE A 92 1.171 4.608 3.795 1.00 0.00 H new ATOM 0 HB ILE A 92 -0.182 3.123 1.510 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.451 4.938 2.684 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.185 3.350 2.799 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -0.620 1.319 3.127 1.00 0.00 H new ATOM 0 HG22 ILE A 92 1.123 1.533 2.836 1.00 0.00 H new ATOM 0 HG23 ILE A 92 0.387 2.158 4.331 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.290 4.522 4.943 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -1.263 3.074 5.072 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.518 4.685 4.955 1.00 0.00 H new ATOM 1322 N THR A 93 3.275 3.344 3.438 1.00 0.00 N ATOM 1323 CA THR A 93 4.544 2.650 3.256 1.00 0.00 C ATOM 1324 C THR A 93 4.371 1.142 3.396 1.00 0.00 C ATOM 1325 O THR A 93 4.067 0.641 4.478 1.00 0.00 O ATOM 1326 CB THR A 93 5.598 3.131 4.271 1.00 0.00 C ATOM 1327 OG1 THR A 93 5.971 4.484 3.987 1.00 0.00 O ATOM 1328 CG2 THR A 93 6.831 2.241 4.234 1.00 0.00 C ATOM 0 H THR A 93 3.101 3.661 4.392 1.00 0.00 H new ATOM 0 HA THR A 93 4.889 2.881 2.248 1.00 0.00 H new ATOM 0 HB THR A 93 5.161 3.077 5.268 1.00 0.00 H new ATOM 0 HG1 THR A 93 6.822 4.494 3.500 1.00 0.00 H new ATOM 0 HG21 THR A 93 7.561 2.600 4.959 1.00 0.00 H new ATOM 0 HG22 THR A 93 6.548 1.217 4.480 1.00 0.00 H new ATOM 0 HG23 THR A 93 7.268 2.266 3.236 1.00 0.00 H new ATOM 1336 N TRP A 94 4.568 0.425 2.296 1.00 0.00 N ATOM 1337 CA TRP A 94 4.434 -1.028 2.297 1.00 0.00 C ATOM 1338 C TRP A 94 5.510 -1.674 1.432 1.00 0.00 C ATOM 1339 O TRP A 94 5.684 -1.313 0.268 1.00 0.00 O ATOM 1340 CB TRP A 94 3.047 -1.433 1.795 1.00 0.00 C ATOM 1341 CG TRP A 94 2.770 -2.900 1.934 1.00 0.00 C ATOM 1342 CD1 TRP A 94 2.297 -3.543 3.042 1.00 0.00 C ATOM 1343 CD2 TRP A 94 2.952 -3.905 0.931 1.00 0.00 C ATOM 1344 NE1 TRP A 94 2.173 -4.887 2.788 1.00 0.00 N ATOM 1345 CE2 TRP A 94 2.568 -5.135 1.499 1.00 0.00 C ATOM 1346 CE3 TRP A 94 3.399 -3.885 -0.393 1.00 0.00 C ATOM 1347 CZ2 TRP A 94 2.620 -6.331 0.789 1.00 0.00 C ATOM 1348 CZ3 TRP A 94 3.450 -5.074 -1.096 1.00 0.00 C ATOM 1349 CH2 TRP A 94 3.062 -6.283 -0.505 1.00 0.00 C ATOM 0 H TRP A 94 4.821 0.825 1.392 1.00 0.00 H new ATOM 0 HA TRP A 94 4.559 -1.379 3.321 1.00 0.00 H new ATOM 0 HB2 TRP A 94 2.291 -0.874 2.347 1.00 0.00 H new ATOM 0 HB3 TRP A 94 2.951 -1.150 0.747 1.00 0.00 H new ATOM 0 HD1 TRP A 94 2.056 -3.065 3.980 1.00 0.00 H new ATOM 0 HE1 TRP A 94 1.841 -5.587 3.451 1.00 0.00 H new ATOM 0 HE3 TRP A 94 3.699 -2.958 -0.858 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 2.322 -7.264 1.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 3.795 -5.071 -2.119 1.00 0.00 H new ATOM 0 HH2 TRP A 94 3.113 -7.195 -1.082 1.00 0.00 H new ATOM 1360 N ALA A 95 6.231 -2.631 2.008 1.00 0.00 N ATOM 1361 CA ALA A 95 7.289 -3.329 1.288 1.00 0.00 C ATOM 1362 C ALA A 95 7.060 -4.836 1.301 1.00 0.00 C ATOM 1363 O ALA A 95 6.394 -5.365 2.192 1.00 0.00 O ATOM 1364 CB ALA A 95 8.646 -2.994 1.889 1.00 0.00 C ATOM 0 H ALA A 95 6.101 -2.940 2.971 1.00 0.00 H new ATOM 0 HA ALA A 95 7.271 -2.994 0.251 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.427 -3.522 1.342 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.819 -1.920 1.822 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.666 -3.300 2.935 1.00 0.00 H new ATOM 1370 N TRP A 96 7.614 -5.523 0.309 1.00 0.00 N ATOM 1371 CA TRP A 96 7.469 -6.971 0.207 1.00 0.00 C ATOM 1372 C TRP A 96 8.758 -7.613 -0.296 1.00 0.00 C ATOM 1373 O TRP A 96 9.124 -7.460 -1.461 1.00 0.00 O ATOM 1374 CB TRP A 96 6.311 -7.323 -0.728 1.00 0.00 C ATOM 1375 CG TRP A 96 6.117 -8.799 -0.903 1.00 0.00 C ATOM 1376 CD1 TRP A 96 6.401 -9.536 -2.017 1.00 0.00 C ATOM 1377 CD2 TRP A 96 5.595 -9.715 0.065 1.00 0.00 C ATOM 1378 NE1 TRP A 96 6.086 -10.856 -1.800 1.00 0.00 N ATOM 1379 CE2 TRP A 96 5.591 -10.992 -0.530 1.00 0.00 C ATOM 1380 CE3 TRP A 96 5.133 -9.582 1.377 1.00 0.00 C ATOM 1381 CZ2 TRP A 96 5.142 -12.125 0.143 1.00 0.00 C ATOM 1382 CZ3 TRP A 96 4.686 -10.708 2.043 1.00 0.00 C ATOM 1383 CH2 TRP A 96 4.694 -11.966 1.426 1.00 0.00 C ATOM 0 H TRP A 96 8.168 -5.101 -0.436 1.00 0.00 H new ATOM 0 HA TRP A 96 7.255 -7.361 1.202 1.00 0.00 H new ATOM 0 HB2 TRP A 96 5.392 -6.887 -0.337 1.00 0.00 H new ATOM 0 HB3 TRP A 96 6.489 -6.869 -1.703 1.00 0.00 H new ATOM 0 HD1 TRP A 96 6.813 -9.140 -2.934 1.00 0.00 H new ATOM 0 HE1 TRP A 96 6.202 -11.612 -2.475 1.00 0.00 H new ATOM 0 HE3 TRP A 96 5.125 -8.617 1.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 5.147 -13.095 -0.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 4.324 -10.616 3.057 1.00 0.00 H new ATOM 0 HH2 TRP A 96 4.340 -12.827 1.974 1.00 0.00 H new ATOM 1394 N ASP A 97 9.440 -8.330 0.589 1.00 0.00 N ATOM 1395 CA ASP A 97 10.688 -8.997 0.234 1.00 0.00 C ATOM 1396 C ASP A 97 10.425 -10.191 -0.678 1.00 0.00 C ATOM 1397 O ASP A 97 9.906 -11.218 -0.241 1.00 0.00 O ATOM 1398 CB ASP A 97 11.423 -9.455 1.495 1.00 0.00 C ATOM 1399 CG ASP A 97 10.581 -10.378 2.353 1.00 0.00 C ATOM 1400 OD1 ASP A 97 9.475 -9.965 2.762 1.00 0.00 O ATOM 1401 OD2 ASP A 97 11.027 -11.515 2.615 1.00 0.00 O ATOM 0 H ASP A 97 9.150 -8.465 1.558 1.00 0.00 H new ATOM 0 HA ASP A 97 11.313 -8.283 -0.302 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.342 -9.967 1.210 1.00 0.00 H new ATOM 0 HB3 ASP A 97 11.712 -8.582 2.081 1.00 0.00 H new ATOM 1406 N LEU A 98 10.786 -10.048 -1.949 1.00 0.00 N ATOM 1407 CA LEU A 98 10.589 -11.115 -2.925 1.00 0.00 C ATOM 1408 C LEU A 98 11.926 -11.614 -3.463 1.00 0.00 C ATOM 1409 O LEU A 98 11.983 -12.268 -4.505 1.00 0.00 O ATOM 1410 CB LEU A 98 9.713 -10.622 -4.078 1.00 0.00 C ATOM 1411 CG LEU A 98 10.355 -9.603 -5.020 1.00 0.00 C ATOM 1412 CD1 LEU A 98 9.676 -9.632 -6.381 1.00 0.00 C ATOM 1413 CD2 LEU A 98 10.291 -8.206 -4.419 1.00 0.00 C ATOM 0 H LEU A 98 11.216 -9.204 -2.328 1.00 0.00 H new ATOM 0 HA LEU A 98 10.088 -11.944 -2.425 1.00 0.00 H new ATOM 0 HB2 LEU A 98 9.402 -11.485 -4.666 1.00 0.00 H new ATOM 0 HB3 LEU A 98 8.809 -10.180 -3.658 1.00 0.00 H new ATOM 0 HG LEU A 98 11.403 -9.871 -5.154 1.00 0.00 H new ATOM 0 HD11 LEU A 98 10.146 -8.900 -7.038 1.00 0.00 H new ATOM 0 HD12 LEU A 98 9.775 -10.627 -6.816 1.00 0.00 H new ATOM 0 HD13 LEU A 98 8.619 -9.390 -6.266 1.00 0.00 H new ATOM 0 HD21 LEU A 98 10.753 -7.494 -5.103 1.00 0.00 H new ATOM 0 HD22 LEU A 98 9.250 -7.928 -4.254 1.00 0.00 H new ATOM 0 HD23 LEU A 98 10.825 -8.194 -3.469 1.00 0.00 H new ATOM 1425 N THR A 99 13.001 -11.302 -2.746 1.00 0.00 N ATOM 1426 CA THR A 99 14.337 -11.720 -3.151 1.00 0.00 C ATOM 1427 C THR A 99 14.385 -13.218 -3.426 1.00 0.00 C ATOM 1428 O THR A 99 14.976 -13.660 -4.412 1.00 0.00 O ATOM 1429 CB THR A 99 15.384 -11.374 -2.075 1.00 0.00 C ATOM 1430 OG1 THR A 99 15.250 -10.003 -1.684 1.00 0.00 O ATOM 1431 CG2 THR A 99 16.793 -11.624 -2.590 1.00 0.00 C ATOM 0 H THR A 99 12.972 -10.761 -1.882 1.00 0.00 H new ATOM 0 HA THR A 99 14.574 -11.178 -4.066 1.00 0.00 H new ATOM 0 HB THR A 99 15.211 -12.016 -1.212 1.00 0.00 H new ATOM 0 HG1 THR A 99 15.918 -9.792 -0.999 1.00 0.00 H new ATOM 0 HG21 THR A 99 17.514 -11.372 -1.813 1.00 0.00 H new ATOM 0 HG22 THR A 99 16.901 -12.675 -2.859 1.00 0.00 H new ATOM 0 HG23 THR A 99 16.975 -11.004 -3.468 1.00 0.00 H new ATOM 1439 N LYS A 100 13.759 -13.997 -2.551 1.00 0.00 N ATOM 1440 CA LYS A 100 13.728 -15.447 -2.700 1.00 0.00 C ATOM 1441 C LYS A 100 12.881 -15.852 -3.902 1.00 0.00 C ATOM 1442 O LYS A 100 11.926 -15.162 -4.261 1.00 0.00 O ATOM 1443 CB LYS A 100 13.176 -16.099 -1.431 1.00 0.00 C ATOM 1444 CG LYS A 100 14.210 -16.260 -0.330 1.00 0.00 C ATOM 1445 CD LYS A 100 14.327 -15.002 0.514 1.00 0.00 C ATOM 1446 CE LYS A 100 15.608 -14.997 1.333 1.00 0.00 C ATOM 1447 NZ LYS A 100 16.813 -14.815 0.477 1.00 0.00 N ATOM 0 H LYS A 100 13.265 -13.648 -1.730 1.00 0.00 H new ATOM 0 HA LYS A 100 14.749 -15.792 -2.864 1.00 0.00 H new ATOM 0 HB2 LYS A 100 12.348 -15.498 -1.055 1.00 0.00 H new ATOM 0 HB3 LYS A 100 12.770 -17.079 -1.683 1.00 0.00 H new ATOM 0 HG2 LYS A 100 13.937 -17.102 0.306 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.179 -16.495 -0.771 1.00 0.00 H new ATOM 0 HD2 LYS A 100 14.304 -14.125 -0.133 1.00 0.00 H new ATOM 0 HD3 LYS A 100 13.468 -14.929 1.180 1.00 0.00 H new ATOM 0 HE2 LYS A 100 15.563 -14.197 2.072 1.00 0.00 H new ATOM 0 HE3 LYS A 100 15.691 -15.935 1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 17.620 -14.531 1.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 17.035 -15.710 -0.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 16.627 -14.077 -0.232 1.00 0.00 H new ATOM 1461 N ASP A 101 13.235 -16.974 -4.519 1.00 0.00 N ATOM 1462 CA ASP A 101 12.506 -17.472 -5.679 1.00 0.00 C ATOM 1463 C ASP A 101 11.039 -17.715 -5.336 1.00 0.00 C ATOM 1464 O ASP A 101 10.143 -17.144 -5.958 1.00 0.00 O ATOM 1465 CB ASP A 101 13.143 -18.764 -6.193 1.00 0.00 C ATOM 1466 CG ASP A 101 12.421 -19.325 -7.402 1.00 0.00 C ATOM 1467 OD1 ASP A 101 11.191 -19.135 -7.499 1.00 0.00 O ATOM 1468 OD2 ASP A 101 13.086 -19.953 -8.252 1.00 0.00 O ATOM 0 H ASP A 101 14.023 -17.556 -4.235 1.00 0.00 H new ATOM 0 HA ASP A 101 12.557 -16.715 -6.461 1.00 0.00 H new ATOM 0 HB2 ASP A 101 14.185 -18.574 -6.452 1.00 0.00 H new ATOM 0 HB3 ASP A 101 13.143 -19.508 -5.396 1.00 0.00 H new ATOM 1473 N SER A 102 10.802 -18.566 -4.343 1.00 0.00 N ATOM 1474 CA SER A 102 9.444 -18.889 -3.920 1.00 0.00 C ATOM 1475 C SER A 102 8.575 -17.635 -3.882 1.00 0.00 C ATOM 1476 O SER A 102 7.497 -17.597 -4.472 1.00 0.00 O ATOM 1477 CB SER A 102 9.461 -19.554 -2.543 1.00 0.00 C ATOM 1478 OG SER A 102 8.147 -19.705 -2.034 1.00 0.00 O ATOM 0 H SER A 102 11.533 -19.044 -3.816 1.00 0.00 H new ATOM 0 HA SER A 102 9.019 -19.583 -4.645 1.00 0.00 H new ATOM 0 HB2 SER A 102 9.942 -20.530 -2.613 1.00 0.00 H new ATOM 0 HB3 SER A 102 10.055 -18.954 -1.853 1.00 0.00 H new ATOM 0 HG SER A 102 8.184 -20.134 -1.154 1.00 0.00 H new ATOM 1484 N ASN A 103 9.054 -16.612 -3.182 1.00 0.00 N ATOM 1485 CA ASN A 103 8.321 -15.356 -3.065 1.00 0.00 C ATOM 1486 C ASN A 103 8.292 -14.617 -4.400 1.00 0.00 C ATOM 1487 O ASN A 103 7.275 -14.035 -4.776 1.00 0.00 O ATOM 1488 CB ASN A 103 8.956 -14.469 -1.992 1.00 0.00 C ATOM 1489 CG ASN A 103 8.842 -15.070 -0.604 1.00 0.00 C ATOM 1490 OD1 ASN A 103 7.970 -14.691 0.178 1.00 0.00 O ATOM 1491 ND2 ASN A 103 9.725 -16.012 -0.293 1.00 0.00 N ATOM 0 H ASN A 103 9.946 -16.628 -2.687 1.00 0.00 H new ATOM 0 HA ASN A 103 7.296 -15.588 -2.776 1.00 0.00 H new ATOM 0 HB2 ASN A 103 10.008 -14.310 -2.231 1.00 0.00 H new ATOM 0 HB3 ASN A 103 8.476 -13.491 -2.002 1.00 0.00 H new ATOM 0 HD21 ASN A 103 9.698 -16.453 0.626 1.00 0.00 H new ATOM 0 HD22 ASN A 103 10.430 -16.294 -0.973 1.00 0.00 H new ATOM 1498 N ARG A 104 9.415 -14.646 -5.110 1.00 0.00 N ATOM 1499 CA ARG A 104 9.519 -13.979 -6.403 1.00 0.00 C ATOM 1500 C ARG A 104 8.323 -14.318 -7.287 1.00 0.00 C ATOM 1501 O ARG A 104 7.649 -13.428 -7.805 1.00 0.00 O ATOM 1502 CB ARG A 104 10.817 -14.381 -7.105 1.00 0.00 C ATOM 1503 CG ARG A 104 11.313 -13.349 -8.105 1.00 0.00 C ATOM 1504 CD ARG A 104 12.768 -13.589 -8.477 1.00 0.00 C ATOM 1505 NE ARG A 104 13.177 -12.788 -9.629 1.00 0.00 N ATOM 1506 CZ ARG A 104 12.983 -13.161 -10.889 1.00 0.00 C ATOM 1507 NH1 ARG A 104 12.389 -14.315 -11.158 1.00 0.00 N ATOM 1508 NH2 ARG A 104 13.384 -12.378 -11.882 1.00 0.00 N ATOM 0 H ARG A 104 10.265 -15.124 -4.812 1.00 0.00 H new ATOM 0 HA ARG A 104 9.527 -12.903 -6.229 1.00 0.00 H new ATOM 0 HB2 ARG A 104 11.590 -14.548 -6.354 1.00 0.00 H new ATOM 0 HB3 ARG A 104 10.663 -15.329 -7.620 1.00 0.00 H new ATOM 0 HG2 ARG A 104 10.696 -13.385 -9.003 1.00 0.00 H new ATOM 0 HG3 ARG A 104 11.204 -12.350 -7.683 1.00 0.00 H new ATOM 0 HD2 ARG A 104 13.404 -13.350 -7.625 1.00 0.00 H new ATOM 0 HD3 ARG A 104 12.916 -14.646 -8.699 1.00 0.00 H new ATOM 0 HE ARG A 104 13.636 -11.894 -9.456 1.00 0.00 H new ATOM 0 HH11 ARG A 104 12.080 -14.919 -10.397 1.00 0.00 H new ATOM 0 HH12 ARG A 104 12.241 -14.599 -12.126 1.00 0.00 H new ATOM 0 HH21 ARG A 104 13.841 -11.489 -11.678 1.00 0.00 H new ATOM 0 HH22 ARG A 104 13.235 -12.665 -12.850 1.00 0.00 H new ATOM 1522 N ALA A 105 8.066 -15.611 -7.456 1.00 0.00 N ATOM 1523 CA ALA A 105 6.951 -16.068 -8.276 1.00 0.00 C ATOM 1524 C ALA A 105 5.622 -15.558 -7.729 1.00 0.00 C ATOM 1525 O ALA A 105 4.806 -15.006 -8.468 1.00 0.00 O ATOM 1526 CB ALA A 105 6.943 -17.588 -8.357 1.00 0.00 C ATOM 0 H ALA A 105 8.615 -16.361 -7.036 1.00 0.00 H new ATOM 0 HA ALA A 105 7.080 -15.663 -9.280 1.00 0.00 H new ATOM 0 HB1 ALA A 105 6.105 -17.915 -8.972 1.00 0.00 H new ATOM 0 HB2 ALA A 105 7.876 -17.934 -8.801 1.00 0.00 H new ATOM 0 HB3 ALA A 105 6.842 -18.005 -7.355 1.00 0.00 H new ATOM 1532 N ARG A 106 5.410 -15.748 -6.431 1.00 0.00 N ATOM 1533 CA ARG A 106 4.179 -15.309 -5.785 1.00 0.00 C ATOM 1534 C ARG A 106 3.786 -13.911 -6.257 1.00 0.00 C ATOM 1535 O ARG A 106 2.758 -13.731 -6.910 1.00 0.00 O ATOM 1536 CB ARG A 106 4.343 -15.318 -4.265 1.00 0.00 C ATOM 1537 CG ARG A 106 4.167 -16.693 -3.641 1.00 0.00 C ATOM 1538 CD ARG A 106 4.414 -16.660 -2.141 1.00 0.00 C ATOM 1539 NE ARG A 106 4.556 -18.002 -1.581 1.00 0.00 N ATOM 1540 CZ ARG A 106 3.544 -18.852 -1.446 1.00 0.00 C ATOM 1541 NH1 ARG A 106 2.324 -18.503 -1.830 1.00 0.00 N ATOM 1542 NH2 ARG A 106 3.753 -20.055 -0.927 1.00 0.00 N ATOM 0 H ARG A 106 6.075 -16.203 -5.806 1.00 0.00 H new ATOM 0 HA ARG A 106 3.386 -16.004 -6.061 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.333 -14.938 -4.013 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.617 -14.633 -3.826 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.158 -17.056 -3.837 1.00 0.00 H new ATOM 0 HG3 ARG A 106 4.855 -17.397 -4.109 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.316 -16.084 -1.934 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.588 -16.147 -1.649 1.00 0.00 H new ATOM 0 HE ARG A 106 5.482 -18.302 -1.277 1.00 0.00 H new ATOM 0 HH11 ARG A 106 2.160 -17.579 -2.231 1.00 0.00 H new ATOM 0 HH12 ARG A 106 1.549 -19.158 -1.725 1.00 0.00 H new ATOM 0 HH21 ARG A 106 4.691 -20.327 -0.632 1.00 0.00 H new ATOM 0 HH22 ARG A 106 2.976 -20.708 -0.823 1.00 0.00 H new ATOM 1556 N PHE A 107 4.612 -12.926 -5.921 1.00 0.00 N ATOM 1557 CA PHE A 107 4.351 -11.544 -6.308 1.00 0.00 C ATOM 1558 C PHE A 107 3.882 -11.465 -7.758 1.00 0.00 C ATOM 1559 O PHE A 107 2.914 -10.772 -8.073 1.00 0.00 O ATOM 1560 CB PHE A 107 5.608 -10.693 -6.119 1.00 0.00 C ATOM 1561 CG PHE A 107 5.455 -9.281 -6.608 1.00 0.00 C ATOM 1562 CD1 PHE A 107 4.469 -8.457 -6.089 1.00 0.00 C ATOM 1563 CD2 PHE A 107 6.297 -8.778 -7.587 1.00 0.00 C ATOM 1564 CE1 PHE A 107 4.326 -7.158 -6.538 1.00 0.00 C ATOM 1565 CE2 PHE A 107 6.159 -7.479 -8.040 1.00 0.00 C ATOM 1566 CZ PHE A 107 5.172 -6.668 -7.514 1.00 0.00 C ATOM 0 H PHE A 107 5.468 -13.059 -5.382 1.00 0.00 H new ATOM 0 HA PHE A 107 3.559 -11.156 -5.667 1.00 0.00 H new ATOM 0 HB2 PHE A 107 5.870 -10.676 -5.061 1.00 0.00 H new ATOM 0 HB3 PHE A 107 6.438 -11.164 -6.646 1.00 0.00 H new ATOM 0 HD1 PHE A 107 3.805 -8.834 -5.325 1.00 0.00 H new ATOM 0 HD2 PHE A 107 7.070 -9.408 -8.001 1.00 0.00 H new ATOM 0 HE1 PHE A 107 3.553 -6.526 -6.126 1.00 0.00 H new ATOM 0 HE2 PHE A 107 6.822 -7.099 -8.804 1.00 0.00 H new ATOM 0 HZ PHE A 107 5.062 -5.653 -7.865 1.00 0.00 H new ATOM 1576 N LEU A 108 4.577 -12.179 -8.637 1.00 0.00 N ATOM 1577 CA LEU A 108 4.234 -12.190 -10.055 1.00 0.00 C ATOM 1578 C LEU A 108 2.951 -12.979 -10.299 1.00 0.00 C ATOM 1579 O LEU A 108 2.260 -12.769 -11.296 1.00 0.00 O ATOM 1580 CB LEU A 108 5.379 -12.792 -10.872 1.00 0.00 C ATOM 1581 CG LEU A 108 6.493 -11.826 -11.279 1.00 0.00 C ATOM 1582 CD1 LEU A 108 7.642 -12.581 -11.929 1.00 0.00 C ATOM 1583 CD2 LEU A 108 5.955 -10.757 -12.219 1.00 0.00 C ATOM 0 H LEU A 108 5.381 -12.757 -8.393 1.00 0.00 H new ATOM 0 HA LEU A 108 4.071 -11.160 -10.372 1.00 0.00 H new ATOM 0 HB2 LEU A 108 5.822 -13.604 -10.296 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.960 -13.234 -11.776 1.00 0.00 H new ATOM 0 HG LEU A 108 6.869 -11.336 -10.381 1.00 0.00 H new ATOM 0 HD11 LEU A 108 8.425 -11.878 -12.212 1.00 0.00 H new ATOM 0 HD12 LEU A 108 8.045 -13.308 -11.224 1.00 0.00 H new ATOM 0 HD13 LEU A 108 7.281 -13.099 -12.818 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.761 -10.079 -12.498 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.552 -11.230 -13.115 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.166 -10.196 -11.718 1.00 0.00 H new ATOM 1595 N THR A 109 2.637 -13.887 -9.380 1.00 0.00 N ATOM 1596 CA THR A 109 1.437 -14.706 -9.494 1.00 0.00 C ATOM 1597 C THR A 109 0.209 -13.956 -8.991 1.00 0.00 C ATOM 1598 O THR A 109 -0.907 -14.194 -9.452 1.00 0.00 O ATOM 1599 CB THR A 109 1.579 -16.022 -8.706 1.00 0.00 C ATOM 1600 OG1 THR A 109 2.776 -16.702 -9.100 1.00 0.00 O ATOM 1601 CG2 THR A 109 0.377 -16.925 -8.940 1.00 0.00 C ATOM 0 H THR A 109 3.197 -14.074 -8.548 1.00 0.00 H new ATOM 0 HA THR A 109 1.310 -14.936 -10.552 1.00 0.00 H new ATOM 0 HB THR A 109 1.631 -15.780 -7.644 1.00 0.00 H new ATOM 0 HG1 THR A 109 3.551 -16.127 -8.929 1.00 0.00 H new ATOM 0 HG21 THR A 109 0.500 -17.848 -8.374 1.00 0.00 H new ATOM 0 HG22 THR A 109 -0.530 -16.416 -8.613 1.00 0.00 H new ATOM 0 HG23 THR A 109 0.299 -17.159 -10.002 1.00 0.00 H new ATOM 1609 N MET A 110 0.423 -13.048 -8.044 1.00 0.00 N ATOM 1610 CA MET A 110 -0.668 -12.261 -7.481 1.00 0.00 C ATOM 1611 C MET A 110 -0.951 -11.032 -8.339 1.00 0.00 C ATOM 1612 O MET A 110 -2.106 -10.644 -8.520 1.00 0.00 O ATOM 1613 CB MET A 110 -0.330 -11.833 -6.051 1.00 0.00 C ATOM 1614 CG MET A 110 1.035 -11.178 -5.919 1.00 0.00 C ATOM 1615 SD MET A 110 1.301 -10.448 -4.292 1.00 0.00 S ATOM 1616 CE MET A 110 0.993 -8.719 -4.642 1.00 0.00 C ATOM 0 H MET A 110 1.341 -12.839 -7.651 1.00 0.00 H new ATOM 0 HA MET A 110 -1.562 -12.884 -7.465 1.00 0.00 H new ATOM 0 HB2 MET A 110 -1.093 -11.139 -5.699 1.00 0.00 H new ATOM 0 HB3 MET A 110 -0.369 -12.707 -5.400 1.00 0.00 H new ATOM 0 HG2 MET A 110 1.810 -11.920 -6.111 1.00 0.00 H new ATOM 0 HG3 MET A 110 1.138 -10.405 -6.681 1.00 0.00 H new ATOM 0 HE1 MET A 110 1.577 -8.100 -3.961 1.00 0.00 H new ATOM 0 HE2 MET A 110 1.281 -8.499 -5.670 1.00 0.00 H new ATOM 0 HE3 MET A 110 -0.067 -8.504 -4.508 1.00 0.00 H new ATOM 1626 N CYS A 111 0.107 -10.425 -8.863 1.00 0.00 N ATOM 1627 CA CYS A 111 -0.028 -9.239 -9.701 1.00 0.00 C ATOM 1628 C CYS A 111 -1.003 -9.492 -10.847 1.00 0.00 C ATOM 1629 O CYS A 111 -1.629 -8.565 -11.358 1.00 0.00 O ATOM 1630 CB CYS A 111 1.334 -8.823 -10.257 1.00 0.00 C ATOM 1631 SG CYS A 111 2.049 -10.007 -11.422 1.00 0.00 S ATOM 0 H CYS A 111 1.069 -10.734 -8.723 1.00 0.00 H new ATOM 0 HA CYS A 111 -0.422 -8.431 -9.084 1.00 0.00 H new ATOM 0 HB2 CYS A 111 1.232 -7.858 -10.753 1.00 0.00 H new ATOM 0 HB3 CYS A 111 2.026 -8.683 -9.427 1.00 0.00 H new ATOM 0 HG CYS A 111 1.541 -11.185 -11.210 1.00 0.00 H new ATOM 1637 N ASN A 112 -1.124 -10.754 -11.246 1.00 0.00 N ATOM 1638 CA ASN A 112 -2.021 -11.129 -12.334 1.00 0.00 C ATOM 1639 C ASN A 112 -3.476 -11.091 -11.877 1.00 0.00 C ATOM 1640 O ASN A 112 -4.380 -10.833 -12.671 1.00 0.00 O ATOM 1641 CB ASN A 112 -1.673 -12.526 -12.851 1.00 0.00 C ATOM 1642 CG ASN A 112 -2.419 -12.874 -14.124 1.00 0.00 C ATOM 1643 OD1 ASN A 112 -3.450 -13.546 -14.089 1.00 0.00 O ATOM 1644 ND2 ASN A 112 -1.900 -12.416 -15.258 1.00 0.00 N ATOM 0 H ASN A 112 -0.613 -11.534 -10.833 1.00 0.00 H new ATOM 0 HA ASN A 112 -1.894 -10.408 -13.142 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -0.600 -12.586 -13.034 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -1.907 -13.263 -12.083 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.358 -12.618 -16.147 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -1.043 -11.863 -15.240 1.00 0.00 H new ATOM 1651 N ARG A 113 -3.693 -11.349 -10.591 1.00 0.00 N ATOM 1652 CA ARG A 113 -5.038 -11.345 -10.028 1.00 0.00 C ATOM 1653 C ARG A 113 -5.430 -9.945 -9.565 1.00 0.00 C ATOM 1654 O ARG A 113 -6.560 -9.503 -9.776 1.00 0.00 O ATOM 1655 CB ARG A 113 -5.126 -12.324 -8.856 1.00 0.00 C ATOM 1656 CG ARG A 113 -5.495 -13.739 -9.272 1.00 0.00 C ATOM 1657 CD ARG A 113 -4.261 -14.557 -9.618 1.00 0.00 C ATOM 1658 NE ARG A 113 -4.541 -15.991 -9.631 1.00 0.00 N ATOM 1659 CZ ARG A 113 -3.828 -16.873 -10.323 1.00 0.00 C ATOM 1660 NH1 ARG A 113 -2.798 -16.469 -11.054 1.00 0.00 N ATOM 1661 NH2 ARG A 113 -4.144 -18.161 -10.284 1.00 0.00 N ATOM 0 H ARG A 113 -2.955 -11.563 -9.920 1.00 0.00 H new ATOM 0 HA ARG A 113 -5.732 -11.659 -10.808 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -4.167 -12.345 -8.338 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.866 -11.959 -8.143 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -6.041 -14.226 -8.464 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -6.163 -13.704 -10.133 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -3.886 -14.252 -10.595 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -3.473 -14.348 -8.895 1.00 0.00 H new ATOM 0 HE ARG A 113 -5.327 -16.334 -9.079 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -2.552 -15.480 -11.086 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -2.252 -17.148 -11.585 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -4.935 -18.475 -9.722 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -3.596 -18.837 -10.816 1.00 0.00 H new ATOM 1675 N HIS A 114 -4.488 -9.251 -8.933 1.00 0.00 N ATOM 1676 CA HIS A 114 -4.735 -7.901 -8.440 1.00 0.00 C ATOM 1677 C HIS A 114 -4.832 -6.910 -9.596 1.00 0.00 C ATOM 1678 O HIS A 114 -5.869 -6.279 -9.801 1.00 0.00 O ATOM 1679 CB HIS A 114 -3.624 -7.475 -7.480 1.00 0.00 C ATOM 1680 CG HIS A 114 -3.730 -8.104 -6.124 1.00 0.00 C ATOM 1681 ND1 HIS A 114 -4.198 -7.430 -5.016 1.00 0.00 N ATOM 1682 CD2 HIS A 114 -3.426 -9.353 -5.702 1.00 0.00 C ATOM 1683 CE1 HIS A 114 -4.177 -8.237 -3.971 1.00 0.00 C ATOM 1684 NE2 HIS A 114 -3.713 -9.411 -4.360 1.00 0.00 N ATOM 0 H HIS A 114 -3.548 -9.601 -8.751 1.00 0.00 H new ATOM 0 HA HIS A 114 -5.685 -7.904 -7.906 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -2.659 -7.733 -7.917 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -3.645 -6.391 -7.371 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -3.031 -10.155 -6.308 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -4.487 -7.981 -2.969 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -3.588 -10.227 -3.761 1.00 0.00 H new ATOM 1692 N PHE A 115 -3.744 -6.776 -10.347 1.00 0.00 N ATOM 1693 CA PHE A 115 -3.706 -5.861 -11.481 1.00 0.00 C ATOM 1694 C PHE A 115 -4.092 -6.577 -12.772 1.00 0.00 C ATOM 1695 O PHE A 115 -5.144 -6.311 -13.352 1.00 0.00 O ATOM 1696 CB PHE A 115 -2.311 -5.248 -11.623 1.00 0.00 C ATOM 1697 CG PHE A 115 -1.744 -4.743 -10.327 1.00 0.00 C ATOM 1698 CD1 PHE A 115 -2.315 -3.657 -9.682 1.00 0.00 C ATOM 1699 CD2 PHE A 115 -0.640 -5.353 -9.753 1.00 0.00 C ATOM 1700 CE1 PHE A 115 -1.795 -3.190 -8.490 1.00 0.00 C ATOM 1701 CE2 PHE A 115 -0.116 -4.891 -8.561 1.00 0.00 C ATOM 1702 CZ PHE A 115 -0.695 -3.808 -7.928 1.00 0.00 C ATOM 0 H PHE A 115 -2.877 -7.290 -10.190 1.00 0.00 H new ATOM 0 HA PHE A 115 -4.428 -5.066 -11.297 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -1.635 -5.995 -12.040 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -2.355 -4.425 -12.336 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -3.176 -3.170 -10.116 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -0.184 -6.200 -10.244 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -2.248 -2.342 -7.998 1.00 0.00 H new ATOM 0 HE2 PHE A 115 0.745 -5.376 -8.125 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.288 -3.445 -6.996 1.00 0.00 H new ATOM 1712 N GLY A 116 -3.231 -7.488 -13.217 1.00 0.00 N ATOM 1713 CA GLY A 116 -3.498 -8.228 -14.436 1.00 0.00 C ATOM 1714 C GLY A 116 -2.231 -8.591 -15.184 1.00 0.00 C ATOM 1715 O GLY A 116 -1.149 -8.641 -14.598 1.00 0.00 O ATOM 0 H GLY A 116 -2.354 -7.726 -12.755 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -4.045 -9.138 -14.192 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -4.141 -7.633 -15.085 1.00 0.00 H new ATOM 1719 N SER A 117 -2.364 -8.848 -16.481 1.00 0.00 N ATOM 1720 CA SER A 117 -1.221 -9.214 -17.309 1.00 0.00 C ATOM 1721 C SER A 117 -0.460 -7.972 -17.765 1.00 0.00 C ATOM 1722 O SER A 117 0.745 -7.852 -17.543 1.00 0.00 O ATOM 1723 CB SER A 117 -1.682 -10.018 -18.526 1.00 0.00 C ATOM 1724 OG SER A 117 -0.608 -10.751 -19.090 1.00 0.00 O ATOM 0 H SER A 117 -3.252 -8.810 -16.981 1.00 0.00 H new ATOM 0 HA SER A 117 -0.551 -9.829 -16.708 1.00 0.00 H new ATOM 0 HB2 SER A 117 -2.479 -10.702 -18.233 1.00 0.00 H new ATOM 0 HB3 SER A 117 -2.099 -9.344 -19.274 1.00 0.00 H new ATOM 0 HG SER A 117 -0.929 -11.258 -19.865 1.00 0.00 H new ATOM 1730 N VAL A 118 -1.173 -7.050 -18.403 1.00 0.00 N ATOM 1731 CA VAL A 118 -0.568 -5.816 -18.890 1.00 0.00 C ATOM 1732 C VAL A 118 0.458 -5.279 -17.898 1.00 0.00 C ATOM 1733 O VAL A 118 1.643 -5.168 -18.213 1.00 0.00 O ATOM 1734 CB VAL A 118 -1.631 -4.733 -19.149 1.00 0.00 C ATOM 1735 CG1 VAL A 118 -0.975 -3.438 -19.604 1.00 0.00 C ATOM 1736 CG2 VAL A 118 -2.644 -5.216 -20.176 1.00 0.00 C ATOM 0 H VAL A 118 -2.171 -7.134 -18.595 1.00 0.00 H new ATOM 0 HA VAL A 118 -0.070 -6.057 -19.829 1.00 0.00 H new ATOM 0 HB VAL A 118 -2.159 -4.536 -18.216 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -1.742 -2.685 -19.782 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.292 -3.085 -18.831 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -0.420 -3.615 -20.525 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -3.388 -4.438 -20.347 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.134 -5.442 -21.112 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -3.137 -6.115 -19.806 1.00 0.00 H new ATOM 1746 N VAL A 119 -0.005 -4.948 -16.697 1.00 0.00 N ATOM 1747 CA VAL A 119 0.872 -4.423 -15.658 1.00 0.00 C ATOM 1748 C VAL A 119 1.932 -5.447 -15.265 1.00 0.00 C ATOM 1749 O VAL A 119 3.114 -5.122 -15.157 1.00 0.00 O ATOM 1750 CB VAL A 119 0.076 -4.018 -14.403 1.00 0.00 C ATOM 1751 CG1 VAL A 119 1.010 -3.488 -13.326 1.00 0.00 C ATOM 1752 CG2 VAL A 119 -0.984 -2.986 -14.756 1.00 0.00 C ATOM 0 H VAL A 119 -0.983 -5.034 -16.420 1.00 0.00 H new ATOM 0 HA VAL A 119 1.359 -3.540 -16.071 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.426 -4.902 -14.011 1.00 0.00 H new ATOM 0 HG11 VAL A 119 0.430 -3.207 -12.447 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.728 -4.262 -13.054 1.00 0.00 H new ATOM 0 HG13 VAL A 119 1.542 -2.615 -13.704 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.537 -2.711 -13.858 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -0.505 -2.100 -15.173 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.671 -3.406 -15.491 1.00 0.00 H new ATOM 1762 N ALA A 120 1.500 -6.686 -15.053 1.00 0.00 N ATOM 1763 CA ALA A 120 2.412 -7.758 -14.675 1.00 0.00 C ATOM 1764 C ALA A 120 3.662 -7.750 -15.548 1.00 0.00 C ATOM 1765 O ALA A 120 4.775 -7.585 -15.051 1.00 0.00 O ATOM 1766 CB ALA A 120 1.710 -9.105 -14.768 1.00 0.00 C ATOM 0 H ALA A 120 0.524 -6.972 -15.137 1.00 0.00 H new ATOM 0 HA ALA A 120 2.721 -7.591 -13.643 1.00 0.00 H new ATOM 0 HB1 ALA A 120 2.403 -9.897 -14.483 1.00 0.00 H new ATOM 0 HB2 ALA A 120 0.851 -9.115 -14.097 1.00 0.00 H new ATOM 0 HB3 ALA A 120 1.372 -9.269 -15.791 1.00 0.00 H new ATOM 1772 N GLN A 121 3.469 -7.929 -16.851 1.00 0.00 N ATOM 1773 CA GLN A 121 4.582 -7.943 -17.793 1.00 0.00 C ATOM 1774 C GLN A 121 5.555 -6.805 -17.502 1.00 0.00 C ATOM 1775 O GLN A 121 6.769 -7.008 -17.454 1.00 0.00 O ATOM 1776 CB GLN A 121 4.065 -7.834 -19.228 1.00 0.00 C ATOM 1777 CG GLN A 121 5.139 -8.055 -20.280 1.00 0.00 C ATOM 1778 CD GLN A 121 4.597 -7.979 -21.694 1.00 0.00 C ATOM 1779 OE1 GLN A 121 4.328 -9.002 -22.324 1.00 0.00 O ATOM 1780 NE2 GLN A 121 4.432 -6.763 -22.200 1.00 0.00 N ATOM 0 H GLN A 121 2.553 -8.066 -17.278 1.00 0.00 H new ATOM 0 HA GLN A 121 5.112 -8.888 -17.677 1.00 0.00 H new ATOM 0 HB2 GLN A 121 3.269 -8.564 -19.375 1.00 0.00 H new ATOM 0 HB3 GLN A 121 3.624 -6.848 -19.373 1.00 0.00 H new ATOM 0 HG2 GLN A 121 5.923 -7.308 -20.155 1.00 0.00 H new ATOM 0 HG3 GLN A 121 5.600 -9.030 -20.124 1.00 0.00 H new ATOM 0 HE21 GLN A 121 4.668 -5.942 -21.642 1.00 0.00 H new ATOM 0 HE22 GLN A 121 4.069 -6.649 -23.146 1.00 0.00 H new ATOM 1789 N THR A 122 5.015 -5.605 -17.310 1.00 0.00 N ATOM 1790 CA THR A 122 5.835 -4.434 -17.026 1.00 0.00 C ATOM 1791 C THR A 122 6.994 -4.786 -16.099 1.00 0.00 C ATOM 1792 O THR A 122 8.150 -4.482 -16.393 1.00 0.00 O ATOM 1793 CB THR A 122 5.003 -3.308 -16.384 1.00 0.00 C ATOM 1794 OG1 THR A 122 3.816 -3.078 -17.151 1.00 0.00 O ATOM 1795 CG2 THR A 122 5.811 -2.023 -16.294 1.00 0.00 C ATOM 0 H THR A 122 4.013 -5.419 -17.346 1.00 0.00 H new ATOM 0 HA THR A 122 6.229 -4.085 -17.980 1.00 0.00 H new ATOM 0 HB THR A 122 4.729 -3.618 -15.376 1.00 0.00 H new ATOM 0 HG1 THR A 122 3.292 -2.362 -16.735 1.00 0.00 H new ATOM 0 HG21 THR A 122 5.203 -1.242 -15.837 1.00 0.00 H new ATOM 0 HG22 THR A 122 6.699 -2.194 -15.686 1.00 0.00 H new ATOM 0 HG23 THR A 122 6.111 -1.711 -17.294 1.00 0.00 H new ATOM 1803 N ILE A 123 6.676 -5.429 -14.980 1.00 0.00 N ATOM 1804 CA ILE A 123 7.692 -5.823 -14.012 1.00 0.00 C ATOM 1805 C ILE A 123 8.564 -6.949 -14.558 1.00 0.00 C ATOM 1806 O ILE A 123 9.787 -6.822 -14.628 1.00 0.00 O ATOM 1807 CB ILE A 123 7.058 -6.278 -12.685 1.00 0.00 C ATOM 1808 CG1 ILE A 123 6.181 -5.166 -12.105 1.00 0.00 C ATOM 1809 CG2 ILE A 123 8.138 -6.680 -11.692 1.00 0.00 C ATOM 1810 CD1 ILE A 123 5.388 -5.593 -10.890 1.00 0.00 C ATOM 0 H ILE A 123 5.724 -5.688 -14.722 1.00 0.00 H new ATOM 0 HA ILE A 123 8.310 -4.944 -13.828 1.00 0.00 H new ATOM 0 HB ILE A 123 6.429 -7.147 -12.880 1.00 0.00 H new ATOM 0 HG12 ILE A 123 6.812 -4.319 -11.837 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.492 -4.819 -12.875 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.674 -6.999 -10.759 1.00 0.00 H new ATOM 0 HG22 ILE A 123 8.725 -7.501 -12.105 1.00 0.00 H new ATOM 0 HG23 ILE A 123 8.791 -5.828 -11.500 1.00 0.00 H new ATOM 0 HD11 ILE A 123 4.790 -4.755 -10.533 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.730 -6.420 -11.157 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.071 -5.912 -10.103 1.00 0.00 H new ATOM 1822 N ARG A 124 7.927 -8.049 -14.945 1.00 0.00 N ATOM 1823 CA ARG A 124 8.645 -9.197 -15.486 1.00 0.00 C ATOM 1824 C ARG A 124 9.770 -8.748 -16.414 1.00 0.00 C ATOM 1825 O ARG A 124 10.886 -9.263 -16.349 1.00 0.00 O ATOM 1826 CB ARG A 124 7.683 -10.117 -16.241 1.00 0.00 C ATOM 1827 CG ARG A 124 8.345 -11.370 -16.792 1.00 0.00 C ATOM 1828 CD ARG A 124 7.349 -12.243 -17.539 1.00 0.00 C ATOM 1829 NE ARG A 124 7.120 -11.769 -18.901 1.00 0.00 N ATOM 1830 CZ ARG A 124 6.014 -12.022 -19.591 1.00 0.00 C ATOM 1831 NH1 ARG A 124 5.040 -12.739 -19.048 1.00 0.00 N ATOM 1832 NH2 ARG A 124 5.879 -11.556 -20.826 1.00 0.00 N ATOM 0 H ARG A 124 6.915 -8.170 -14.894 1.00 0.00 H new ATOM 0 HA ARG A 124 9.083 -9.745 -14.652 1.00 0.00 H new ATOM 0 HB2 ARG A 124 6.873 -10.408 -15.573 1.00 0.00 H new ATOM 0 HB3 ARG A 124 7.233 -9.562 -17.064 1.00 0.00 H new ATOM 0 HG2 ARG A 124 9.158 -11.089 -17.461 1.00 0.00 H new ATOM 0 HG3 ARG A 124 8.788 -11.939 -15.974 1.00 0.00 H new ATOM 0 HD2 ARG A 124 7.717 -13.269 -17.569 1.00 0.00 H new ATOM 0 HD3 ARG A 124 6.403 -12.259 -16.997 1.00 0.00 H new ATOM 0 HE ARG A 124 7.850 -11.213 -19.347 1.00 0.00 H new ATOM 0 HH11 ARG A 124 5.139 -13.098 -18.098 1.00 0.00 H new ATOM 0 HH12 ARG A 124 4.191 -12.932 -19.580 1.00 0.00 H new ATOM 0 HH21 ARG A 124 6.625 -11.003 -21.247 1.00 0.00 H new ATOM 0 HH22 ARG A 124 5.029 -11.751 -21.355 1.00 0.00 H new ATOM 1846 N THR A 125 9.468 -7.783 -17.277 1.00 0.00 N ATOM 1847 CA THR A 125 10.452 -7.265 -18.219 1.00 0.00 C ATOM 1848 C THR A 125 11.550 -6.493 -17.498 1.00 0.00 C ATOM 1849 O THR A 125 12.727 -6.606 -17.839 1.00 0.00 O ATOM 1850 CB THR A 125 9.797 -6.345 -19.267 1.00 0.00 C ATOM 1851 OG1 THR A 125 9.117 -5.266 -18.615 1.00 0.00 O ATOM 1852 CG2 THR A 125 8.815 -7.122 -20.131 1.00 0.00 C ATOM 0 H THR A 125 8.549 -7.344 -17.343 1.00 0.00 H new ATOM 0 HA THR A 125 10.889 -8.126 -18.725 1.00 0.00 H new ATOM 0 HB THR A 125 10.582 -5.944 -19.908 1.00 0.00 H new ATOM 0 HG1 THR A 125 8.954 -5.501 -17.678 1.00 0.00 H new ATOM 0 HG21 THR A 125 8.365 -6.452 -20.863 1.00 0.00 H new ATOM 0 HG22 THR A 125 9.341 -7.924 -20.648 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.034 -7.548 -19.501 1.00 0.00 H new ATOM 1860 N GLN A 126 11.158 -5.710 -16.499 1.00 0.00 N ATOM 1861 CA GLN A 126 12.111 -4.919 -15.729 1.00 0.00 C ATOM 1862 C GLN A 126 13.226 -5.799 -15.174 1.00 0.00 C ATOM 1863 O GLN A 126 12.974 -6.727 -14.405 1.00 0.00 O ATOM 1864 CB GLN A 126 11.399 -4.195 -14.585 1.00 0.00 C ATOM 1865 CG GLN A 126 10.589 -2.991 -15.038 1.00 0.00 C ATOM 1866 CD GLN A 126 11.458 -1.799 -15.387 1.00 0.00 C ATOM 1867 OE1 GLN A 126 12.271 -1.352 -14.578 1.00 0.00 O ATOM 1868 NE2 GLN A 126 11.291 -1.278 -16.596 1.00 0.00 N ATOM 0 H GLN A 126 10.187 -5.606 -16.203 1.00 0.00 H new ATOM 0 HA GLN A 126 12.554 -4.180 -16.397 1.00 0.00 H new ATOM 0 HB2 GLN A 126 10.738 -4.897 -14.077 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.140 -3.870 -13.855 1.00 0.00 H new ATOM 0 HG2 GLN A 126 9.991 -3.266 -15.907 1.00 0.00 H new ATOM 0 HG3 GLN A 126 9.893 -2.709 -14.248 1.00 0.00 H new ATOM 0 HE21 GLN A 126 10.605 -1.681 -17.235 1.00 0.00 H new ATOM 0 HE22 GLN A 126 11.848 -0.475 -16.887 1.00 0.00 H new ATOM 1877 N LYS A 127 14.460 -5.503 -15.568 1.00 0.00 N ATOM 1878 CA LYS A 127 15.614 -6.266 -15.110 1.00 0.00 C ATOM 1879 C LYS A 127 15.728 -6.220 -13.589 1.00 0.00 C ATOM 1880 O LYS A 127 14.942 -5.552 -12.917 1.00 0.00 O ATOM 1881 CB LYS A 127 16.896 -5.722 -15.744 1.00 0.00 C ATOM 1882 CG LYS A 127 17.224 -6.350 -17.087 1.00 0.00 C ATOM 1883 CD LYS A 127 16.245 -5.910 -18.163 1.00 0.00 C ATOM 1884 CE LYS A 127 16.362 -6.774 -19.410 1.00 0.00 C ATOM 1885 NZ LYS A 127 15.510 -6.263 -20.520 1.00 0.00 N ATOM 0 H LYS A 127 14.686 -4.739 -16.205 1.00 0.00 H new ATOM 0 HA LYS A 127 15.476 -7.303 -15.416 1.00 0.00 H new ATOM 0 HB2 LYS A 127 16.800 -4.644 -15.870 1.00 0.00 H new ATOM 0 HB3 LYS A 127 17.729 -5.890 -15.061 1.00 0.00 H new ATOM 0 HG2 LYS A 127 18.237 -6.074 -17.381 1.00 0.00 H new ATOM 0 HG3 LYS A 127 17.203 -7.436 -16.997 1.00 0.00 H new ATOM 0 HD2 LYS A 127 15.228 -5.965 -17.775 1.00 0.00 H new ATOM 0 HD3 LYS A 127 16.432 -4.868 -18.422 1.00 0.00 H new ATOM 0 HE2 LYS A 127 17.402 -6.804 -19.735 1.00 0.00 H new ATOM 0 HE3 LYS A 127 16.073 -7.797 -19.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 15.617 -6.878 -21.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 14.514 -6.258 -20.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 15.803 -5.296 -20.765 1.00 0.00 H new ATOM 1899 N THR A 128 16.713 -6.933 -13.052 1.00 0.00 N ATOM 1900 CA THR A 128 16.930 -6.974 -11.611 1.00 0.00 C ATOM 1901 C THR A 128 17.511 -5.658 -11.106 1.00 0.00 C ATOM 1902 O THR A 128 16.947 -5.021 -10.216 1.00 0.00 O ATOM 1903 CB THR A 128 17.876 -8.124 -11.218 1.00 0.00 C ATOM 1904 OG1 THR A 128 17.408 -9.356 -11.778 1.00 0.00 O ATOM 1905 CG2 THR A 128 17.970 -8.253 -9.705 1.00 0.00 C ATOM 0 H THR A 128 17.374 -7.490 -13.594 1.00 0.00 H new ATOM 0 HA THR A 128 15.957 -7.140 -11.149 1.00 0.00 H new ATOM 0 HB THR A 128 18.868 -7.900 -11.611 1.00 0.00 H new ATOM 0 HG1 THR A 128 18.016 -10.082 -11.525 1.00 0.00 H new ATOM 0 HG21 THR A 128 18.643 -9.071 -9.451 1.00 0.00 H new ATOM 0 HG22 THR A 128 18.353 -7.324 -9.284 1.00 0.00 H new ATOM 0 HG23 THR A 128 16.981 -8.456 -9.295 1.00 0.00 H new ATOM 1913 N ASP A 129 18.640 -5.256 -11.679 1.00 0.00 N ATOM 1914 CA ASP A 129 19.296 -4.014 -11.287 1.00 0.00 C ATOM 1915 C ASP A 129 18.284 -2.880 -11.162 1.00 0.00 C ATOM 1916 O ASP A 129 18.346 -2.081 -10.229 1.00 0.00 O ATOM 1917 CB ASP A 129 20.376 -3.641 -12.303 1.00 0.00 C ATOM 1918 CG ASP A 129 19.823 -2.850 -13.472 1.00 0.00 C ATOM 1919 OD1 ASP A 129 19.761 -1.606 -13.371 1.00 0.00 O ATOM 1920 OD2 ASP A 129 19.452 -3.474 -14.488 1.00 0.00 O ATOM 0 H ASP A 129 19.120 -5.772 -12.416 1.00 0.00 H new ATOM 0 HA ASP A 129 19.761 -4.169 -10.314 1.00 0.00 H new ATOM 0 HB2 ASP A 129 21.151 -3.057 -11.807 1.00 0.00 H new ATOM 0 HB3 ASP A 129 20.850 -4.549 -12.675 1.00 0.00 H new ATOM 1925 N GLN A 130 17.354 -2.817 -12.110 1.00 0.00 N ATOM 1926 CA GLN A 130 16.329 -1.780 -12.106 1.00 0.00 C ATOM 1927 C GLN A 130 15.735 -1.606 -10.712 1.00 0.00 C ATOM 1928 O GLN A 130 15.534 -0.484 -10.247 1.00 0.00 O ATOM 1929 CB GLN A 130 15.223 -2.122 -13.105 1.00 0.00 C ATOM 1930 CG GLN A 130 15.715 -2.246 -14.538 1.00 0.00 C ATOM 1931 CD GLN A 130 16.619 -1.100 -14.946 1.00 0.00 C ATOM 1932 OE1 GLN A 130 16.491 0.016 -14.443 1.00 0.00 O ATOM 1933 NE2 GLN A 130 17.541 -1.370 -15.862 1.00 0.00 N ATOM 0 H GLN A 130 17.289 -3.471 -12.890 1.00 0.00 H new ATOM 0 HA GLN A 130 16.798 -0.841 -12.401 1.00 0.00 H new ATOM 0 HB2 GLN A 130 14.754 -3.060 -12.808 1.00 0.00 H new ATOM 0 HB3 GLN A 130 14.453 -1.352 -13.059 1.00 0.00 H new ATOM 0 HG2 GLN A 130 16.253 -3.187 -14.653 1.00 0.00 H new ATOM 0 HG3 GLN A 130 14.858 -2.285 -15.210 1.00 0.00 H new ATOM 0 HE21 GLN A 130 17.612 -2.310 -16.253 1.00 0.00 H new ATOM 0 HE22 GLN A 130 18.179 -0.638 -16.175 1.00 0.00 H new ATOM 1942 N PHE A 131 15.457 -2.724 -10.049 1.00 0.00 N ATOM 1943 CA PHE A 131 14.884 -2.695 -8.708 1.00 0.00 C ATOM 1944 C PHE A 131 15.709 -1.804 -7.784 1.00 0.00 C ATOM 1945 O PHE A 131 16.884 -1.531 -8.029 1.00 0.00 O ATOM 1946 CB PHE A 131 14.806 -4.111 -8.134 1.00 0.00 C ATOM 1947 CG PHE A 131 13.564 -4.854 -8.537 1.00 0.00 C ATOM 1948 CD1 PHE A 131 13.456 -5.417 -9.798 1.00 0.00 C ATOM 1949 CD2 PHE A 131 12.504 -4.988 -7.655 1.00 0.00 C ATOM 1950 CE1 PHE A 131 12.314 -6.100 -10.172 1.00 0.00 C ATOM 1951 CE2 PHE A 131 11.360 -5.670 -8.022 1.00 0.00 C ATOM 1952 CZ PHE A 131 11.265 -6.228 -9.282 1.00 0.00 C ATOM 0 H PHE A 131 15.619 -3.661 -10.418 1.00 0.00 H new ATOM 0 HA PHE A 131 13.877 -2.283 -8.778 1.00 0.00 H new ATOM 0 HB2 PHE A 131 15.679 -4.675 -8.461 1.00 0.00 H new ATOM 0 HB3 PHE A 131 14.850 -4.056 -7.046 1.00 0.00 H new ATOM 0 HD1 PHE A 131 14.274 -5.321 -10.497 1.00 0.00 H new ATOM 0 HD2 PHE A 131 12.573 -4.554 -6.668 1.00 0.00 H new ATOM 0 HE1 PHE A 131 12.242 -6.533 -11.159 1.00 0.00 H new ATOM 0 HE2 PHE A 131 10.541 -5.767 -7.325 1.00 0.00 H new ATOM 0 HZ PHE A 131 10.373 -6.763 -9.571 1.00 0.00 H new ATOM 1962 N PRO A 132 15.080 -1.339 -6.695 1.00 0.00 N ATOM 1963 CA PRO A 132 13.681 -1.657 -6.393 1.00 0.00 C ATOM 1964 C PRO A 132 12.712 -0.986 -7.360 1.00 0.00 C ATOM 1965 O PRO A 132 13.088 -0.077 -8.101 1.00 0.00 O ATOM 1966 CB PRO A 132 13.490 -1.108 -4.977 1.00 0.00 C ATOM 1967 CG PRO A 132 14.507 -0.027 -4.850 1.00 0.00 C ATOM 1968 CD PRO A 132 15.685 -0.467 -5.674 1.00 0.00 C ATOM 0 HA PRO A 132 13.477 -2.724 -6.482 1.00 0.00 H new ATOM 0 HB2 PRO A 132 12.481 -0.721 -4.835 1.00 0.00 H new ATOM 0 HB3 PRO A 132 13.642 -1.885 -4.227 1.00 0.00 H new ATOM 0 HG2 PRO A 132 14.113 0.924 -5.209 1.00 0.00 H new ATOM 0 HG3 PRO A 132 14.793 0.120 -3.808 1.00 0.00 H new ATOM 0 HD2 PRO A 132 16.200 0.382 -6.124 1.00 0.00 H new ATOM 0 HD3 PRO A 132 16.419 -1.002 -5.072 1.00 0.00 H new ATOM 1976 N LEU A 133 11.463 -1.438 -7.348 1.00 0.00 N ATOM 1977 CA LEU A 133 10.439 -0.880 -8.224 1.00 0.00 C ATOM 1978 C LEU A 133 9.342 -0.196 -7.414 1.00 0.00 C ATOM 1979 O LEU A 133 8.571 -0.853 -6.714 1.00 0.00 O ATOM 1980 CB LEU A 133 9.832 -1.980 -9.097 1.00 0.00 C ATOM 1981 CG LEU A 133 10.585 -2.304 -10.388 1.00 0.00 C ATOM 1982 CD1 LEU A 133 9.925 -3.467 -11.113 1.00 0.00 C ATOM 1983 CD2 LEU A 133 10.649 -1.079 -11.289 1.00 0.00 C ATOM 0 H LEU A 133 11.135 -2.189 -6.741 1.00 0.00 H new ATOM 0 HA LEU A 133 10.911 -0.135 -8.864 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.762 -2.891 -8.502 1.00 0.00 H new ATOM 0 HB3 LEU A 133 8.814 -1.690 -9.357 1.00 0.00 H new ATOM 0 HG LEU A 133 11.603 -2.594 -10.130 1.00 0.00 H new ATOM 0 HD11 LEU A 133 10.474 -3.683 -12.029 1.00 0.00 H new ATOM 0 HD12 LEU A 133 9.931 -4.347 -10.470 1.00 0.00 H new ATOM 0 HD13 LEU A 133 8.896 -3.205 -11.360 1.00 0.00 H new ATOM 0 HD21 LEU A 133 11.188 -1.327 -12.203 1.00 0.00 H new ATOM 0 HD22 LEU A 133 9.638 -0.759 -11.540 1.00 0.00 H new ATOM 0 HD23 LEU A 133 11.167 -0.272 -10.770 1.00 0.00 H new ATOM 1995 N PHE A 134 9.278 1.127 -7.514 1.00 0.00 N ATOM 1996 CA PHE A 134 8.275 1.901 -6.792 1.00 0.00 C ATOM 1997 C PHE A 134 7.083 2.220 -7.690 1.00 0.00 C ATOM 1998 O PHE A 134 7.226 2.885 -8.717 1.00 0.00 O ATOM 1999 CB PHE A 134 8.888 3.198 -6.258 1.00 0.00 C ATOM 2000 CG PHE A 134 8.226 3.703 -5.008 1.00 0.00 C ATOM 2001 CD1 PHE A 134 6.930 4.191 -5.043 1.00 0.00 C ATOM 2002 CD2 PHE A 134 8.900 3.690 -3.798 1.00 0.00 C ATOM 2003 CE1 PHE A 134 6.319 4.657 -3.894 1.00 0.00 C ATOM 2004 CE2 PHE A 134 8.295 4.155 -2.645 1.00 0.00 C ATOM 2005 CZ PHE A 134 7.002 4.638 -2.694 1.00 0.00 C ATOM 0 H PHE A 134 9.909 1.686 -8.088 1.00 0.00 H new ATOM 0 HA PHE A 134 7.924 1.301 -5.953 1.00 0.00 H new ATOM 0 HB2 PHE A 134 9.947 3.035 -6.058 1.00 0.00 H new ATOM 0 HB3 PHE A 134 8.824 3.966 -7.029 1.00 0.00 H new ATOM 0 HD1 PHE A 134 6.391 4.208 -5.979 1.00 0.00 H new ATOM 0 HD2 PHE A 134 9.911 3.312 -3.755 1.00 0.00 H new ATOM 0 HE1 PHE A 134 5.308 5.036 -3.935 1.00 0.00 H new ATOM 0 HE2 PHE A 134 8.832 4.141 -1.708 1.00 0.00 H new ATOM 0 HZ PHE A 134 6.526 5.000 -1.795 1.00 0.00 H new ATOM 2015 N LEU A 135 5.909 1.742 -7.295 1.00 0.00 N ATOM 2016 CA LEU A 135 4.691 1.975 -8.064 1.00 0.00 C ATOM 2017 C LEU A 135 3.624 2.647 -7.204 1.00 0.00 C ATOM 2018 O LEU A 135 3.498 2.355 -6.015 1.00 0.00 O ATOM 2019 CB LEU A 135 4.156 0.655 -8.622 1.00 0.00 C ATOM 2020 CG LEU A 135 5.167 -0.219 -9.362 1.00 0.00 C ATOM 2021 CD1 LEU A 135 5.959 -1.068 -8.380 1.00 0.00 C ATOM 2022 CD2 LEU A 135 4.464 -1.100 -10.384 1.00 0.00 C ATOM 0 H LEU A 135 5.774 1.191 -6.447 1.00 0.00 H new ATOM 0 HA LEU A 135 4.935 2.640 -8.892 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.741 0.076 -7.797 1.00 0.00 H new ATOM 0 HB3 LEU A 135 3.333 0.878 -9.301 1.00 0.00 H new ATOM 0 HG LEU A 135 5.862 0.433 -9.891 1.00 0.00 H new ATOM 0 HD11 LEU A 135 6.674 -1.684 -8.926 1.00 0.00 H new ATOM 0 HD12 LEU A 135 6.494 -0.419 -7.687 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.278 -1.711 -7.823 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.200 -1.715 -10.901 1.00 0.00 H new ATOM 0 HD22 LEU A 135 3.745 -1.743 -9.877 1.00 0.00 H new ATOM 0 HD23 LEU A 135 3.943 -0.473 -11.107 1.00 0.00 H new ATOM 2034 N ILE A 136 2.859 3.545 -7.814 1.00 0.00 N ATOM 2035 CA ILE A 136 1.802 4.255 -7.105 1.00 0.00 C ATOM 2036 C ILE A 136 0.426 3.864 -7.635 1.00 0.00 C ATOM 2037 O ILE A 136 0.020 4.297 -8.714 1.00 0.00 O ATOM 2038 CB ILE A 136 1.970 5.781 -7.224 1.00 0.00 C ATOM 2039 CG1 ILE A 136 3.324 6.212 -6.656 1.00 0.00 C ATOM 2040 CG2 ILE A 136 0.836 6.497 -6.506 1.00 0.00 C ATOM 2041 CD1 ILE A 136 3.760 7.588 -7.111 1.00 0.00 C ATOM 0 H ILE A 136 2.951 3.798 -8.798 1.00 0.00 H new ATOM 0 HA ILE A 136 1.880 3.970 -6.056 1.00 0.00 H new ATOM 0 HB ILE A 136 1.935 6.054 -8.279 1.00 0.00 H new ATOM 0 HG12 ILE A 136 3.273 6.197 -5.567 1.00 0.00 H new ATOM 0 HG13 ILE A 136 4.080 5.484 -6.950 1.00 0.00 H new ATOM 0 HG21 ILE A 136 0.969 7.575 -6.599 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -0.116 6.209 -6.952 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.841 6.221 -5.452 1.00 0.00 H new ATOM 0 HD11 ILE A 136 4.728 7.828 -6.670 1.00 0.00 H new ATOM 0 HD12 ILE A 136 3.843 7.602 -8.198 1.00 0.00 H new ATOM 0 HD13 ILE A 136 3.024 8.326 -6.794 1.00 0.00 H new ATOM 2053 N ILE A 137 -0.286 3.045 -6.869 1.00 0.00 N ATOM 2054 CA ILE A 137 -1.617 2.598 -7.260 1.00 0.00 C ATOM 2055 C ILE A 137 -2.698 3.449 -6.601 1.00 0.00 C ATOM 2056 O ILE A 137 -2.943 3.339 -5.400 1.00 0.00 O ATOM 2057 CB ILE A 137 -1.846 1.121 -6.891 1.00 0.00 C ATOM 2058 CG1 ILE A 137 -0.720 0.251 -7.454 1.00 0.00 C ATOM 2059 CG2 ILE A 137 -3.197 0.649 -7.408 1.00 0.00 C ATOM 2060 CD1 ILE A 137 -0.685 0.213 -8.965 1.00 0.00 C ATOM 0 H ILE A 137 0.037 2.677 -5.974 1.00 0.00 H new ATOM 0 HA ILE A 137 -1.681 2.707 -8.343 1.00 0.00 H new ATOM 0 HB ILE A 137 -1.842 1.029 -5.805 1.00 0.00 H new ATOM 0 HG12 ILE A 137 0.236 0.624 -7.086 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -0.833 -0.765 -7.075 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -3.344 -0.397 -7.139 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.988 1.253 -6.963 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -3.228 0.753 -8.493 1.00 0.00 H new ATOM 0 HD11 ILE A 137 0.138 -0.422 -9.294 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -1.626 -0.189 -9.341 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -0.541 1.222 -9.351 1.00 0.00 H new ATOM 2072 N MET A 138 -3.343 4.296 -7.396 1.00 0.00 N ATOM 2073 CA MET A 138 -4.401 5.164 -6.891 1.00 0.00 C ATOM 2074 C MET A 138 -5.775 4.562 -7.165 1.00 0.00 C ATOM 2075 O MET A 138 -6.525 4.254 -6.239 1.00 0.00 O ATOM 2076 CB MET A 138 -4.301 6.550 -7.529 1.00 0.00 C ATOM 2077 CG MET A 138 -5.499 7.440 -7.240 1.00 0.00 C ATOM 2078 SD MET A 138 -5.568 8.885 -8.317 1.00 0.00 S ATOM 2079 CE MET A 138 -6.765 8.342 -9.535 1.00 0.00 C ATOM 0 H MET A 138 -3.152 4.400 -8.393 1.00 0.00 H new ATOM 0 HA MET A 138 -4.275 5.259 -5.813 1.00 0.00 H new ATOM 0 HB2 MET A 138 -3.398 7.042 -7.169 1.00 0.00 H new ATOM 0 HB3 MET A 138 -4.194 6.437 -8.608 1.00 0.00 H new ATOM 0 HG2 MET A 138 -6.414 6.860 -7.358 1.00 0.00 H new ATOM 0 HG3 MET A 138 -5.461 7.768 -6.201 1.00 0.00 H new ATOM 0 HE1 MET A 138 -6.916 9.130 -10.273 1.00 0.00 H new ATOM 0 HE2 MET A 138 -6.397 7.445 -10.032 1.00 0.00 H new ATOM 0 HE3 MET A 138 -7.711 8.121 -9.042 1.00 0.00 H new ATOM 2164 N ASN A 144 -8.551 -0.697 -9.754 1.00 0.00 N ATOM 2165 CA ASN A 144 -7.151 -0.361 -9.520 1.00 0.00 C ATOM 2166 C ASN A 144 -6.448 -0.019 -10.830 1.00 0.00 C ATOM 2167 O ASN A 144 -6.843 -0.486 -11.898 1.00 0.00 O ATOM 2168 CB ASN A 144 -6.433 -1.524 -8.832 1.00 0.00 C ATOM 2169 CG ASN A 144 -7.032 -1.853 -7.478 1.00 0.00 C ATOM 2170 OD1 ASN A 144 -7.211 -0.974 -6.636 1.00 0.00 O ATOM 2171 ND2 ASN A 144 -7.345 -3.126 -7.263 1.00 0.00 N ATOM 0 HA ASN A 144 -7.117 0.513 -8.870 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -6.480 -2.406 -9.471 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -5.379 -1.275 -8.709 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -7.751 -3.408 -6.371 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -7.179 -3.822 -7.990 1.00 0.00 H new ATOM 2178 N GLU A 145 -5.404 0.799 -10.739 1.00 0.00 N ATOM 2179 CA GLU A 145 -4.646 1.203 -11.917 1.00 0.00 C ATOM 2180 C GLU A 145 -3.267 1.726 -11.525 1.00 0.00 C ATOM 2181 O GLU A 145 -2.996 1.973 -10.349 1.00 0.00 O ATOM 2182 CB GLU A 145 -5.408 2.277 -12.697 1.00 0.00 C ATOM 2183 CG GLU A 145 -5.512 3.603 -11.963 1.00 0.00 C ATOM 2184 CD GLU A 145 -6.498 4.554 -12.614 1.00 0.00 C ATOM 2185 OE1 GLU A 145 -6.490 4.658 -13.858 1.00 0.00 O ATOM 2186 OE2 GLU A 145 -7.278 5.194 -11.877 1.00 0.00 O ATOM 0 H GLU A 145 -5.064 1.195 -9.862 1.00 0.00 H new ATOM 0 HA GLU A 145 -4.516 0.326 -12.551 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -4.913 2.439 -13.654 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -6.412 1.912 -12.915 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -5.815 3.421 -10.932 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -4.529 4.073 -11.928 1.00 0.00 H new ATOM 2193 N VAL A 146 -2.399 1.892 -12.517 1.00 0.00 N ATOM 2194 CA VAL A 146 -1.048 2.386 -12.277 1.00 0.00 C ATOM 2195 C VAL A 146 -0.899 3.829 -12.746 1.00 0.00 C ATOM 2196 O VAL A 146 -1.179 4.150 -13.902 1.00 0.00 O ATOM 2197 CB VAL A 146 0.003 1.515 -12.989 1.00 0.00 C ATOM 2198 CG1 VAL A 146 1.396 2.098 -12.803 1.00 0.00 C ATOM 2199 CG2 VAL A 146 -0.057 0.083 -12.478 1.00 0.00 C ATOM 0 H VAL A 146 -2.607 1.692 -13.495 1.00 0.00 H new ATOM 0 HA VAL A 146 -0.880 2.338 -11.201 1.00 0.00 H new ATOM 0 HB VAL A 146 -0.221 1.506 -14.056 1.00 0.00 H new ATOM 0 HG11 VAL A 146 2.125 1.469 -13.313 1.00 0.00 H new ATOM 0 HG12 VAL A 146 1.428 3.104 -13.222 1.00 0.00 H new ATOM 0 HG13 VAL A 146 1.634 2.140 -11.740 1.00 0.00 H new ATOM 0 HG21 VAL A 146 0.693 -0.518 -12.992 1.00 0.00 H new ATOM 0 HG22 VAL A 146 0.141 0.071 -11.406 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -1.047 -0.330 -12.669 1.00 0.00 H new ATOM 2209 N LEU A 147 -0.456 4.696 -11.843 1.00 0.00 N ATOM 2210 CA LEU A 147 -0.268 6.107 -12.164 1.00 0.00 C ATOM 2211 C LEU A 147 1.170 6.382 -12.590 1.00 0.00 C ATOM 2212 O LEU A 147 1.426 6.786 -13.723 1.00 0.00 O ATOM 2213 CB LEU A 147 -0.631 6.977 -10.959 1.00 0.00 C ATOM 2214 CG LEU A 147 -2.075 7.475 -10.901 1.00 0.00 C ATOM 2215 CD1 LEU A 147 -2.265 8.671 -11.821 1.00 0.00 C ATOM 2216 CD2 LEU A 147 -3.040 6.358 -11.271 1.00 0.00 C ATOM 0 H LEU A 147 -0.220 4.447 -10.882 1.00 0.00 H new ATOM 0 HA LEU A 147 -0.927 6.356 -12.996 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.427 6.409 -10.051 1.00 0.00 H new ATOM 0 HB3 LEU A 147 0.031 7.843 -10.949 1.00 0.00 H new ATOM 0 HG LEU A 147 -2.289 7.790 -9.880 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -3.299 9.011 -11.766 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -1.600 9.478 -11.511 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -2.032 8.382 -12.846 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -4.063 6.731 -11.224 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.826 6.012 -12.282 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.923 5.530 -10.572 1.00 0.00 H new ATOM 2228 N ASN A 148 2.107 6.157 -11.674 1.00 0.00 N ATOM 2229 CA ASN A 148 3.520 6.379 -11.955 1.00 0.00 C ATOM 2230 C ASN A 148 4.323 5.096 -11.755 1.00 0.00 C ATOM 2231 O ASN A 148 4.070 4.332 -10.823 1.00 0.00 O ATOM 2232 CB ASN A 148 4.073 7.485 -11.055 1.00 0.00 C ATOM 2233 CG ASN A 148 3.627 8.866 -11.495 1.00 0.00 C ATOM 2234 OD1 ASN A 148 3.290 9.079 -12.660 1.00 0.00 O ATOM 2235 ND2 ASN A 148 3.624 9.812 -10.563 1.00 0.00 N ATOM 0 H ASN A 148 1.912 5.821 -10.731 1.00 0.00 H new ATOM 0 HA ASN A 148 3.613 6.687 -12.996 1.00 0.00 H new ATOM 0 HB2 ASN A 148 3.748 7.311 -10.029 1.00 0.00 H new ATOM 0 HB3 ASN A 148 5.162 7.440 -11.057 1.00 0.00 H new ATOM 0 HD21 ASN A 148 3.334 10.761 -10.800 1.00 0.00 H new ATOM 0 HD22 ASN A 148 3.911 9.590 -9.610 1.00 0.00 H new ATOM 2242 N VAL A 149 5.292 4.867 -12.635 1.00 0.00 N ATOM 2243 CA VAL A 149 6.133 3.679 -12.555 1.00 0.00 C ATOM 2244 C VAL A 149 7.611 4.047 -12.608 1.00 0.00 C ATOM 2245 O VAL A 149 8.126 4.440 -13.656 1.00 0.00 O ATOM 2246 CB VAL A 149 5.819 2.692 -13.695 1.00 0.00 C ATOM 2247 CG1 VAL A 149 6.714 1.465 -13.600 1.00 0.00 C ATOM 2248 CG2 VAL A 149 4.351 2.294 -13.666 1.00 0.00 C ATOM 0 H VAL A 149 5.514 5.489 -13.412 1.00 0.00 H new ATOM 0 HA VAL A 149 5.915 3.201 -11.600 1.00 0.00 H new ATOM 0 HB VAL A 149 6.019 3.186 -14.646 1.00 0.00 H new ATOM 0 HG11 VAL A 149 6.478 0.779 -14.413 1.00 0.00 H new ATOM 0 HG12 VAL A 149 7.758 1.770 -13.674 1.00 0.00 H new ATOM 0 HG13 VAL A 149 6.548 0.967 -12.645 1.00 0.00 H new ATOM 0 HG21 VAL A 149 4.147 1.596 -14.478 1.00 0.00 H new ATOM 0 HG22 VAL A 149 4.122 1.818 -12.713 1.00 0.00 H new ATOM 0 HG23 VAL A 149 3.731 3.182 -13.786 1.00 0.00 H new ATOM 2258 N ILE A 150 8.289 3.918 -11.473 1.00 0.00 N ATOM 2259 CA ILE A 150 9.709 4.236 -11.391 1.00 0.00 C ATOM 2260 C ILE A 150 10.560 2.973 -11.465 1.00 0.00 C ATOM 2261 O ILE A 150 10.215 1.945 -10.882 1.00 0.00 O ATOM 2262 CB ILE A 150 10.043 4.991 -10.091 1.00 0.00 C ATOM 2263 CG1 ILE A 150 9.221 6.278 -9.998 1.00 0.00 C ATOM 2264 CG2 ILE A 150 11.531 5.300 -10.026 1.00 0.00 C ATOM 2265 CD1 ILE A 150 8.972 6.735 -8.578 1.00 0.00 C ATOM 0 H ILE A 150 7.878 3.595 -10.597 1.00 0.00 H new ATOM 0 HA ILE A 150 9.938 4.877 -12.242 1.00 0.00 H new ATOM 0 HB ILE A 150 9.786 4.356 -9.243 1.00 0.00 H new ATOM 0 HG12 ILE A 150 9.738 7.070 -10.540 1.00 0.00 H new ATOM 0 HG13 ILE A 150 8.263 6.124 -10.495 1.00 0.00 H new ATOM 0 HG21 ILE A 150 11.752 5.834 -9.102 1.00 0.00 H new ATOM 0 HG22 ILE A 150 12.097 4.369 -10.052 1.00 0.00 H new ATOM 0 HG23 ILE A 150 11.812 5.919 -10.878 1.00 0.00 H new ATOM 0 HD11 ILE A 150 8.384 7.653 -8.589 1.00 0.00 H new ATOM 0 HD12 ILE A 150 8.427 5.961 -8.037 1.00 0.00 H new ATOM 0 HD13 ILE A 150 9.925 6.921 -8.083 1.00 0.00 H new ATOM 2277 N GLN A 151 11.675 3.058 -12.184 1.00 0.00 N ATOM 2278 CA GLN A 151 12.576 1.921 -12.333 1.00 0.00 C ATOM 2279 C GLN A 151 13.441 1.746 -11.089 1.00 0.00 C ATOM 2280 O GLN A 151 13.297 0.771 -10.353 1.00 0.00 O ATOM 2281 CB GLN A 151 13.464 2.106 -13.565 1.00 0.00 C ATOM 2282 CG GLN A 151 12.697 2.080 -14.877 1.00 0.00 C ATOM 2283 CD GLN A 151 13.423 2.809 -15.991 1.00 0.00 C ATOM 2284 OE1 GLN A 151 14.649 2.923 -15.979 1.00 0.00 O ATOM 2285 NE2 GLN A 151 12.667 3.307 -16.963 1.00 0.00 N ATOM 0 H GLN A 151 11.976 3.902 -12.672 1.00 0.00 H new ATOM 0 HA GLN A 151 11.971 1.023 -12.461 1.00 0.00 H new ATOM 0 HB2 GLN A 151 13.993 3.055 -13.482 1.00 0.00 H new ATOM 0 HB3 GLN A 151 14.219 1.320 -13.580 1.00 0.00 H new ATOM 0 HG2 GLN A 151 12.528 1.045 -15.175 1.00 0.00 H new ATOM 0 HG3 GLN A 151 11.717 2.533 -14.730 1.00 0.00 H new ATOM 0 HE21 GLN A 151 11.654 3.189 -16.933 1.00 0.00 H new ATOM 0 HE22 GLN A 151 13.099 3.807 -17.740 1.00 0.00 H new ATOM 2294 N GLY A 152 14.341 2.698 -10.862 1.00 0.00 N ATOM 2295 CA GLY A 152 15.217 2.629 -9.706 1.00 0.00 C ATOM 2296 C GLY A 152 16.315 3.673 -9.749 1.00 0.00 C ATOM 2297 O GLY A 152 16.810 4.106 -8.709 1.00 0.00 O ATOM 0 H GLY A 152 14.479 3.515 -11.457 1.00 0.00 H new ATOM 0 HA2 GLY A 152 14.628 2.763 -8.799 1.00 0.00 H new ATOM 0 HA3 GLY A 152 15.665 1.637 -9.652 1.00 0.00 H new ATOM 2301 N ASN A 153 16.699 4.077 -10.955 1.00 0.00 N ATOM 2302 CA ASN A 153 17.748 5.075 -11.129 1.00 0.00 C ATOM 2303 C ASN A 153 17.201 6.483 -10.915 1.00 0.00 C ATOM 2304 O ASN A 153 17.855 7.473 -11.243 1.00 0.00 O ATOM 2305 CB ASN A 153 18.362 4.962 -12.526 1.00 0.00 C ATOM 2306 CG ASN A 153 17.378 5.322 -13.621 1.00 0.00 C ATOM 2307 OD1 ASN A 153 16.744 6.377 -13.580 1.00 0.00 O ATOM 2308 ND2 ASN A 153 17.244 4.445 -14.609 1.00 0.00 N ATOM 0 H ASN A 153 16.300 3.729 -11.827 1.00 0.00 H new ATOM 0 HA ASN A 153 18.520 4.887 -10.383 1.00 0.00 H new ATOM 0 HB2 ASN A 153 19.231 5.617 -12.592 1.00 0.00 H new ATOM 0 HB3 ASN A 153 18.718 3.944 -12.682 1.00 0.00 H new ATOM 0 HD21 ASN A 153 16.596 4.633 -15.374 1.00 0.00 H new ATOM 0 HD22 ASN A 153 17.789 3.583 -14.603 1.00 0.00 H new ATOM 2315 N THR A 154 15.995 6.566 -10.361 1.00 0.00 N ATOM 2316 CA THR A 154 15.358 7.851 -10.103 1.00 0.00 C ATOM 2317 C THR A 154 16.130 8.646 -9.057 1.00 0.00 C ATOM 2318 O THR A 154 17.133 8.176 -8.518 1.00 0.00 O ATOM 2319 CB THR A 154 13.904 7.672 -9.627 1.00 0.00 C ATOM 2320 OG1 THR A 154 13.216 8.927 -9.674 1.00 0.00 O ATOM 2321 CG2 THR A 154 13.863 7.119 -8.210 1.00 0.00 C ATOM 0 H THR A 154 15.440 5.757 -10.082 1.00 0.00 H new ATOM 0 HA THR A 154 15.358 8.399 -11.045 1.00 0.00 H new ATOM 0 HB THR A 154 13.412 6.962 -10.292 1.00 0.00 H new ATOM 0 HG1 THR A 154 12.464 8.912 -9.045 1.00 0.00 H new ATOM 0 HG21 THR A 154 12.826 7.001 -7.895 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.363 6.151 -8.183 1.00 0.00 H new ATOM 0 HG23 THR A 154 14.371 7.809 -7.536 1.00 0.00 H new ATOM 2329 N THR A 155 15.657 9.856 -8.771 1.00 0.00 N ATOM 2330 CA THR A 155 16.303 10.717 -7.789 1.00 0.00 C ATOM 2331 C THR A 155 15.296 11.242 -6.771 1.00 0.00 C ATOM 2332 O THR A 155 14.133 11.478 -7.099 1.00 0.00 O ATOM 2333 CB THR A 155 17.004 11.911 -8.463 1.00 0.00 C ATOM 2334 OG1 THR A 155 16.056 12.670 -9.223 1.00 0.00 O ATOM 2335 CG2 THR A 155 18.126 11.436 -9.373 1.00 0.00 C ATOM 0 H THR A 155 14.828 10.261 -9.206 1.00 0.00 H new ATOM 0 HA THR A 155 17.049 10.109 -7.278 1.00 0.00 H new ATOM 0 HB THR A 155 17.432 12.541 -7.683 1.00 0.00 H new ATOM 0 HG1 THR A 155 16.509 13.428 -9.647 1.00 0.00 H new ATOM 0 HG21 THR A 155 18.606 12.297 -9.838 1.00 0.00 H new ATOM 0 HG22 THR A 155 18.860 10.883 -8.787 1.00 0.00 H new ATOM 0 HG23 THR A 155 17.717 10.787 -10.147 1.00 0.00 H new ATOM 2343 N VAL A 156 15.751 11.424 -5.535 1.00 0.00 N ATOM 2344 CA VAL A 156 14.890 11.923 -4.470 1.00 0.00 C ATOM 2345 C VAL A 156 13.921 12.977 -4.994 1.00 0.00 C ATOM 2346 O VAL A 156 12.719 12.913 -4.736 1.00 0.00 O ATOM 2347 CB VAL A 156 15.715 12.527 -3.318 1.00 0.00 C ATOM 2348 CG1 VAL A 156 14.802 13.186 -2.295 1.00 0.00 C ATOM 2349 CG2 VAL A 156 16.579 11.459 -2.665 1.00 0.00 C ATOM 0 H VAL A 156 16.711 11.233 -5.247 1.00 0.00 H new ATOM 0 HA VAL A 156 14.325 11.070 -4.094 1.00 0.00 H new ATOM 0 HB VAL A 156 16.373 13.293 -3.728 1.00 0.00 H new ATOM 0 HG11 VAL A 156 15.403 13.607 -1.489 1.00 0.00 H new ATOM 0 HG12 VAL A 156 14.231 13.981 -2.775 1.00 0.00 H new ATOM 0 HG13 VAL A 156 14.117 12.443 -1.887 1.00 0.00 H new ATOM 0 HG21 VAL A 156 17.155 11.903 -1.853 1.00 0.00 H new ATOM 0 HG22 VAL A 156 15.942 10.669 -2.268 1.00 0.00 H new ATOM 0 HG23 VAL A 156 17.260 11.039 -3.405 1.00 0.00 H new ATOM 2359 N ASP A 157 14.453 13.946 -5.732 1.00 0.00 N ATOM 2360 CA ASP A 157 13.635 15.014 -6.295 1.00 0.00 C ATOM 2361 C ASP A 157 12.456 14.442 -7.076 1.00 0.00 C ATOM 2362 O ASP A 157 11.339 14.950 -6.991 1.00 0.00 O ATOM 2363 CB ASP A 157 14.481 15.907 -7.205 1.00 0.00 C ATOM 2364 CG ASP A 157 15.503 16.718 -6.432 1.00 0.00 C ATOM 2365 OD1 ASP A 157 16.203 16.133 -5.579 1.00 0.00 O ATOM 2366 OD2 ASP A 157 15.603 17.937 -6.681 1.00 0.00 O ATOM 0 H ASP A 157 15.446 14.014 -5.954 1.00 0.00 H new ATOM 0 HA ASP A 157 13.245 15.612 -5.472 1.00 0.00 H new ATOM 0 HB2 ASP A 157 14.994 15.288 -7.941 1.00 0.00 H new ATOM 0 HB3 ASP A 157 13.827 16.583 -7.756 1.00 0.00 H new ATOM 2371 N GLU A 158 12.715 13.383 -7.837 1.00 0.00 N ATOM 2372 CA GLU A 158 11.675 12.744 -8.634 1.00 0.00 C ATOM 2373 C GLU A 158 10.554 12.215 -7.744 1.00 0.00 C ATOM 2374 O GLU A 158 9.373 12.446 -8.009 1.00 0.00 O ATOM 2375 CB GLU A 158 12.266 11.601 -9.462 1.00 0.00 C ATOM 2376 CG GLU A 158 13.153 12.070 -10.603 1.00 0.00 C ATOM 2377 CD GLU A 158 12.407 12.928 -11.606 1.00 0.00 C ATOM 2378 OE1 GLU A 158 11.776 12.357 -12.521 1.00 0.00 O ATOM 2379 OE2 GLU A 158 12.455 14.169 -11.478 1.00 0.00 O ATOM 0 H GLU A 158 13.635 12.950 -7.918 1.00 0.00 H new ATOM 0 HA GLU A 158 11.258 13.493 -9.307 1.00 0.00 H new ATOM 0 HB2 GLU A 158 12.845 10.951 -8.806 1.00 0.00 H new ATOM 0 HB3 GLU A 158 11.453 11.000 -9.869 1.00 0.00 H new ATOM 0 HG2 GLU A 158 13.991 12.637 -10.198 1.00 0.00 H new ATOM 0 HG3 GLU A 158 13.572 11.203 -11.113 1.00 0.00 H new ATOM 2386 N LEU A 159 10.932 11.504 -6.687 1.00 0.00 N ATOM 2387 CA LEU A 159 9.959 10.941 -5.757 1.00 0.00 C ATOM 2388 C LEU A 159 8.949 11.997 -5.320 1.00 0.00 C ATOM 2389 O LEU A 159 7.744 11.831 -5.504 1.00 0.00 O ATOM 2390 CB LEU A 159 10.671 10.363 -4.533 1.00 0.00 C ATOM 2391 CG LEU A 159 11.782 9.351 -4.818 1.00 0.00 C ATOM 2392 CD1 LEU A 159 12.493 8.962 -3.531 1.00 0.00 C ATOM 2393 CD2 LEU A 159 11.216 8.119 -5.510 1.00 0.00 C ATOM 0 H LEU A 159 11.904 11.304 -6.453 1.00 0.00 H new ATOM 0 HA LEU A 159 9.423 10.142 -6.269 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.096 11.188 -3.962 1.00 0.00 H new ATOM 0 HB3 LEU A 159 9.926 9.885 -3.896 1.00 0.00 H new ATOM 0 HG LEU A 159 12.509 9.816 -5.484 1.00 0.00 H new ATOM 0 HD11 LEU A 159 13.280 8.241 -3.754 1.00 0.00 H new ATOM 0 HD12 LEU A 159 12.932 9.850 -3.075 1.00 0.00 H new ATOM 0 HD13 LEU A 159 11.777 8.516 -2.841 1.00 0.00 H new ATOM 0 HD21 LEU A 159 12.020 7.410 -5.705 1.00 0.00 H new ATOM 0 HD22 LEU A 159 10.468 7.653 -4.868 1.00 0.00 H new ATOM 0 HD23 LEU A 159 10.753 8.411 -6.453 1.00 0.00 H new ATOM 2405 N MET A 160 9.450 13.084 -4.741 1.00 0.00 N ATOM 2406 CA MET A 160 8.591 14.169 -4.282 1.00 0.00 C ATOM 2407 C MET A 160 7.589 14.565 -5.362 1.00 0.00 C ATOM 2408 O MET A 160 6.383 14.601 -5.120 1.00 0.00 O ATOM 2409 CB MET A 160 9.434 15.382 -3.882 1.00 0.00 C ATOM 2410 CG MET A 160 9.852 15.377 -2.421 1.00 0.00 C ATOM 2411 SD MET A 160 8.460 15.616 -1.300 1.00 0.00 S ATOM 2412 CE MET A 160 8.992 14.648 0.111 1.00 0.00 C ATOM 0 H MET A 160 10.445 13.236 -4.579 1.00 0.00 H new ATOM 0 HA MET A 160 8.038 13.817 -3.411 1.00 0.00 H new ATOM 0 HB2 MET A 160 10.327 15.415 -4.507 1.00 0.00 H new ATOM 0 HB3 MET A 160 8.868 16.291 -4.086 1.00 0.00 H new ATOM 0 HG2 MET A 160 10.341 14.431 -2.190 1.00 0.00 H new ATOM 0 HG3 MET A 160 10.587 16.165 -2.255 1.00 0.00 H new ATOM 0 HE1 MET A 160 8.371 14.890 0.973 1.00 0.00 H new ATOM 0 HE2 MET A 160 8.896 13.587 -0.119 1.00 0.00 H new ATOM 0 HE3 MET A 160 10.033 14.877 0.338 1.00 0.00 H new ATOM 2422 N MET A 161 8.098 14.862 -6.554 1.00 0.00 N ATOM 2423 CA MET A 161 7.246 15.254 -7.671 1.00 0.00 C ATOM 2424 C MET A 161 6.205 14.179 -7.965 1.00 0.00 C ATOM 2425 O MET A 161 5.002 14.438 -7.918 1.00 0.00 O ATOM 2426 CB MET A 161 8.093 15.515 -8.918 1.00 0.00 C ATOM 2427 CG MET A 161 8.610 16.941 -9.015 1.00 0.00 C ATOM 2428 SD MET A 161 9.553 17.237 -10.523 1.00 0.00 S ATOM 2429 CE MET A 161 8.299 17.978 -11.566 1.00 0.00 C ATOM 0 H MET A 161 9.094 14.839 -6.771 1.00 0.00 H new ATOM 0 HA MET A 161 6.726 16.171 -7.395 1.00 0.00 H new ATOM 0 HB2 MET A 161 8.940 14.829 -8.922 1.00 0.00 H new ATOM 0 HB3 MET A 161 7.499 15.292 -9.804 1.00 0.00 H new ATOM 0 HG2 MET A 161 7.768 17.632 -8.976 1.00 0.00 H new ATOM 0 HG3 MET A 161 9.238 17.155 -8.150 1.00 0.00 H new ATOM 0 HE1 MET A 161 8.730 18.219 -12.538 1.00 0.00 H new ATOM 0 HE2 MET A 161 7.475 17.277 -11.698 1.00 0.00 H new ATOM 0 HE3 MET A 161 7.928 18.890 -11.098 1.00 0.00 H new ATOM 2439 N ARG A 162 6.675 12.973 -8.267 1.00 0.00 N ATOM 2440 CA ARG A 162 5.784 11.860 -8.570 1.00 0.00 C ATOM 2441 C ARG A 162 4.670 11.757 -7.532 1.00 0.00 C ATOM 2442 O ARG A 162 3.494 11.632 -7.877 1.00 0.00 O ATOM 2443 CB ARG A 162 6.570 10.549 -8.621 1.00 0.00 C ATOM 2444 CG ARG A 162 7.461 10.420 -9.846 1.00 0.00 C ATOM 2445 CD ARG A 162 6.667 9.990 -11.069 1.00 0.00 C ATOM 2446 NE ARG A 162 6.147 11.133 -11.815 1.00 0.00 N ATOM 2447 CZ ARG A 162 6.803 11.722 -12.808 1.00 0.00 C ATOM 2448 NH1 ARG A 162 7.997 11.277 -13.175 1.00 0.00 N ATOM 2449 NH2 ARG A 162 6.264 12.758 -13.439 1.00 0.00 N ATOM 0 H ARG A 162 7.668 12.742 -8.308 1.00 0.00 H new ATOM 0 HA ARG A 162 5.333 12.044 -9.545 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.185 10.469 -7.725 1.00 0.00 H new ATOM 0 HB3 ARG A 162 5.869 9.714 -8.602 1.00 0.00 H new ATOM 0 HG2 ARG A 162 7.949 11.374 -10.045 1.00 0.00 H new ATOM 0 HG3 ARG A 162 8.250 9.694 -9.649 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.302 9.391 -11.721 1.00 0.00 H new ATOM 0 HD3 ARG A 162 5.839 9.353 -10.758 1.00 0.00 H new ATOM 0 HE ARG A 162 5.230 11.499 -11.559 1.00 0.00 H new ATOM 0 HH11 ARG A 162 8.414 10.480 -12.694 1.00 0.00 H new ATOM 0 HH12 ARG A 162 8.498 11.732 -13.938 1.00 0.00 H new ATOM 0 HH21 ARG A 162 5.345 13.102 -13.161 1.00 0.00 H new ATOM 0 HH22 ARG A 162 6.769 13.210 -14.202 1.00 0.00 H new ATOM 2463 N LEU A 163 5.048 11.809 -6.259 1.00 0.00 N ATOM 2464 CA LEU A 163 4.082 11.722 -5.170 1.00 0.00 C ATOM 2465 C LEU A 163 3.082 12.872 -5.234 1.00 0.00 C ATOM 2466 O LEU A 163 1.885 12.658 -5.421 1.00 0.00 O ATOM 2467 CB LEU A 163 4.802 11.733 -3.820 1.00 0.00 C ATOM 2468 CG LEU A 163 5.755 10.565 -3.559 1.00 0.00 C ATOM 2469 CD1 LEU A 163 6.595 10.829 -2.319 1.00 0.00 C ATOM 2470 CD2 LEU A 163 4.977 9.265 -3.412 1.00 0.00 C ATOM 0 H LEU A 163 6.017 11.911 -5.956 1.00 0.00 H new ATOM 0 HA LEU A 163 3.537 10.784 -5.277 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.367 12.662 -3.739 1.00 0.00 H new ATOM 0 HB3 LEU A 163 4.051 11.747 -3.030 1.00 0.00 H new ATOM 0 HG LEU A 163 6.425 10.469 -4.413 1.00 0.00 H new ATOM 0 HD11 LEU A 163 7.267 9.988 -2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 163 7.180 11.737 -2.462 1.00 0.00 H new ATOM 0 HD13 LEU A 163 5.941 10.951 -1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 163 5.671 8.445 -3.227 1.00 0.00 H new ATOM 0 HD22 LEU A 163 4.283 9.349 -2.576 1.00 0.00 H new ATOM 0 HD23 LEU A 163 4.420 9.069 -4.328 1.00 0.00 H new ATOM 2482 N MET A 164 3.583 14.094 -5.081 1.00 0.00 N ATOM 2483 CA MET A 164 2.734 15.279 -5.126 1.00 0.00 C ATOM 2484 C MET A 164 1.774 15.215 -6.309 1.00 0.00 C ATOM 2485 O MET A 164 0.565 15.383 -6.149 1.00 0.00 O ATOM 2486 CB MET A 164 3.591 16.543 -5.217 1.00 0.00 C ATOM 2487 CG MET A 164 4.013 17.090 -3.863 1.00 0.00 C ATOM 2488 SD MET A 164 4.716 18.746 -3.971 1.00 0.00 S ATOM 2489 CE MET A 164 3.232 19.748 -3.920 1.00 0.00 C ATOM 0 H MET A 164 4.572 14.289 -4.925 1.00 0.00 H new ATOM 0 HA MET A 164 2.148 15.311 -4.207 1.00 0.00 H new ATOM 0 HB2 MET A 164 4.482 16.326 -5.806 1.00 0.00 H new ATOM 0 HB3 MET A 164 3.034 17.312 -5.753 1.00 0.00 H new ATOM 0 HG2 MET A 164 3.150 17.109 -3.198 1.00 0.00 H new ATOM 0 HG3 MET A 164 4.745 16.417 -3.416 1.00 0.00 H new ATOM 0 HE1 MET A 164 3.503 20.802 -3.978 1.00 0.00 H new ATOM 0 HE2 MET A 164 2.590 19.491 -4.763 1.00 0.00 H new ATOM 0 HE3 MET A 164 2.699 19.561 -2.988 1.00 0.00 H new ATOM 2499 N ALA A 165 2.320 14.972 -7.496 1.00 0.00 N ATOM 2500 CA ALA A 165 1.511 14.885 -8.706 1.00 0.00 C ATOM 2501 C ALA A 165 0.398 13.854 -8.549 1.00 0.00 C ATOM 2502 O ALA A 165 -0.763 14.130 -8.847 1.00 0.00 O ATOM 2503 CB ALA A 165 2.386 14.542 -9.902 1.00 0.00 C ATOM 0 H ALA A 165 3.319 14.832 -7.646 1.00 0.00 H new ATOM 0 HA ALA A 165 1.049 15.857 -8.875 1.00 0.00 H new ATOM 0 HB1 ALA A 165 1.769 14.480 -10.798 1.00 0.00 H new ATOM 0 HB2 ALA A 165 3.141 15.317 -10.034 1.00 0.00 H new ATOM 0 HB3 ALA A 165 2.875 13.583 -9.732 1.00 0.00 H new ATOM 2509 N ALA A 166 0.761 12.665 -8.079 1.00 0.00 N ATOM 2510 CA ALA A 166 -0.207 11.594 -7.881 1.00 0.00 C ATOM 2511 C ALA A 166 -1.390 12.070 -7.045 1.00 0.00 C ATOM 2512 O ALA A 166 -2.528 11.659 -7.272 1.00 0.00 O ATOM 2513 CB ALA A 166 0.459 10.395 -7.222 1.00 0.00 C ATOM 0 H ALA A 166 1.719 12.420 -7.828 1.00 0.00 H new ATOM 0 HA ALA A 166 -0.584 11.294 -8.859 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -0.276 9.603 -7.080 1.00 0.00 H new ATOM 0 HB2 ALA A 166 1.266 10.032 -7.858 1.00 0.00 H new ATOM 0 HB3 ALA A 166 0.865 10.690 -6.255 1.00 0.00 H new ATOM 2519 N MET A 167 -1.113 12.938 -6.078 1.00 0.00 N ATOM 2520 CA MET A 167 -2.156 13.471 -5.208 1.00 0.00 C ATOM 2521 C MET A 167 -3.022 14.482 -5.954 1.00 0.00 C ATOM 2522 O MET A 167 -4.249 14.414 -5.907 1.00 0.00 O ATOM 2523 CB MET A 167 -1.535 14.126 -3.973 1.00 0.00 C ATOM 2524 CG MET A 167 -0.752 13.158 -3.101 1.00 0.00 C ATOM 2525 SD MET A 167 -1.822 12.080 -2.128 1.00 0.00 S ATOM 2526 CE MET A 167 -1.837 12.944 -0.559 1.00 0.00 C ATOM 0 H MET A 167 -0.176 13.287 -5.877 1.00 0.00 H new ATOM 0 HA MET A 167 -2.788 12.642 -4.891 1.00 0.00 H new ATOM 0 HB2 MET A 167 -0.873 14.931 -4.293 1.00 0.00 H new ATOM 0 HB3 MET A 167 -2.326 14.581 -3.377 1.00 0.00 H new ATOM 0 HG2 MET A 167 -0.105 12.548 -3.732 1.00 0.00 H new ATOM 0 HG3 MET A 167 -0.104 13.722 -2.430 1.00 0.00 H new ATOM 0 HE1 MET A 167 -1.948 12.224 0.252 1.00 0.00 H new ATOM 0 HE2 MET A 167 -0.901 13.489 -0.435 1.00 0.00 H new ATOM 0 HE3 MET A 167 -2.671 13.646 -0.538 1.00 0.00 H new ATOM 2536 N GLU A 168 -2.373 15.417 -6.640 1.00 0.00 N ATOM 2537 CA GLU A 168 -3.086 16.442 -7.394 1.00 0.00 C ATOM 2538 C GLU A 168 -3.951 15.814 -8.483 1.00 0.00 C ATOM 2539 O GLU A 168 -5.064 16.271 -8.746 1.00 0.00 O ATOM 2540 CB GLU A 168 -2.096 17.428 -8.018 1.00 0.00 C ATOM 2541 CG GLU A 168 -1.173 18.087 -7.007 1.00 0.00 C ATOM 2542 CD GLU A 168 -1.778 19.333 -6.390 1.00 0.00 C ATOM 2543 OE1 GLU A 168 -2.354 20.148 -7.141 1.00 0.00 O ATOM 2544 OE2 GLU A 168 -1.676 19.493 -5.156 1.00 0.00 O ATOM 0 H GLU A 168 -1.357 15.486 -6.689 1.00 0.00 H new ATOM 0 HA GLU A 168 -3.736 16.979 -6.703 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -1.493 16.904 -8.760 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -2.652 18.202 -8.548 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -0.936 17.374 -6.218 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -0.233 18.347 -7.494 1.00 0.00 H new ATOM 2551 N ILE A 169 -3.431 14.766 -9.111 1.00 0.00 N ATOM 2552 CA ILE A 169 -4.156 14.075 -10.171 1.00 0.00 C ATOM 2553 C ILE A 169 -5.412 13.401 -9.629 1.00 0.00 C ATOM 2554 O ILE A 169 -6.456 13.394 -10.281 1.00 0.00 O ATOM 2555 CB ILE A 169 -3.274 13.015 -10.857 1.00 0.00 C ATOM 2556 CG1 ILE A 169 -2.078 13.681 -11.542 1.00 0.00 C ATOM 2557 CG2 ILE A 169 -4.090 12.217 -11.863 1.00 0.00 C ATOM 2558 CD1 ILE A 169 -0.964 12.716 -11.884 1.00 0.00 C ATOM 0 H ILE A 169 -2.511 14.376 -8.905 1.00 0.00 H new ATOM 0 HA ILE A 169 -4.439 14.830 -10.904 1.00 0.00 H new ATOM 0 HB ILE A 169 -2.899 12.329 -10.097 1.00 0.00 H new ATOM 0 HG12 ILE A 169 -2.418 14.169 -12.455 1.00 0.00 H new ATOM 0 HG13 ILE A 169 -1.685 14.462 -10.891 1.00 0.00 H new ATOM 0 HG21 ILE A 169 -3.453 11.472 -12.339 1.00 0.00 H new ATOM 0 HG22 ILE A 169 -4.912 11.717 -11.350 1.00 0.00 H new ATOM 0 HG23 ILE A 169 -4.491 12.889 -12.621 1.00 0.00 H new ATOM 0 HD11 ILE A 169 -0.150 13.257 -12.367 1.00 0.00 H new ATOM 0 HD12 ILE A 169 -0.597 12.246 -10.972 1.00 0.00 H new ATOM 0 HD13 ILE A 169 -1.342 11.949 -12.560 1.00 0.00 H new ATOM 2570 N PHE A 170 -5.304 12.837 -8.430 1.00 0.00 N ATOM 2571 CA PHE A 170 -6.432 12.162 -7.799 1.00 0.00 C ATOM 2572 C PHE A 170 -7.654 13.073 -7.751 1.00 0.00 C ATOM 2573 O PHE A 170 -8.652 12.830 -8.430 1.00 0.00 O ATOM 2574 CB PHE A 170 -6.058 11.714 -6.384 1.00 0.00 C ATOM 2575 CG PHE A 170 -7.235 11.254 -5.572 1.00 0.00 C ATOM 2576 CD1 PHE A 170 -8.000 12.163 -4.860 1.00 0.00 C ATOM 2577 CD2 PHE A 170 -7.575 9.912 -5.519 1.00 0.00 C ATOM 2578 CE1 PHE A 170 -9.083 11.742 -4.111 1.00 0.00 C ATOM 2579 CE2 PHE A 170 -8.656 9.484 -4.772 1.00 0.00 C ATOM 2580 CZ PHE A 170 -9.412 10.401 -4.068 1.00 0.00 C ATOM 0 H PHE A 170 -4.447 12.834 -7.876 1.00 0.00 H new ATOM 0 HA PHE A 170 -6.680 11.285 -8.397 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -5.331 10.904 -6.448 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -5.570 12.540 -5.867 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -7.748 13.213 -4.890 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -6.988 9.191 -6.068 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -9.671 12.461 -3.560 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -8.909 8.435 -4.739 1.00 0.00 H new ATOM 0 HZ PHE A 170 -10.259 10.070 -3.485 1.00 0.00 H new ATOM 2590 N THR A 171 -7.570 14.124 -6.941 1.00 0.00 N ATOM 2591 CA THR A 171 -8.668 15.072 -6.802 1.00 0.00 C ATOM 2592 C THR A 171 -9.157 15.551 -8.163 1.00 0.00 C ATOM 2593 O THR A 171 -10.312 15.336 -8.530 1.00 0.00 O ATOM 2594 CB THR A 171 -8.253 16.293 -5.959 1.00 0.00 C ATOM 2595 OG1 THR A 171 -9.223 17.337 -6.099 1.00 0.00 O ATOM 2596 CG2 THR A 171 -6.885 16.804 -6.384 1.00 0.00 C ATOM 0 H THR A 171 -6.752 14.340 -6.371 1.00 0.00 H new ATOM 0 HA THR A 171 -9.476 14.546 -6.293 1.00 0.00 H new ATOM 0 HB THR A 171 -8.200 15.985 -4.915 1.00 0.00 H new ATOM 0 HG1 THR A 171 -8.953 18.109 -5.559 1.00 0.00 H new ATOM 0 HG21 THR A 171 -6.613 17.666 -5.775 1.00 0.00 H new ATOM 0 HG22 THR A 171 -6.144 16.016 -6.249 1.00 0.00 H new ATOM 0 HG23 THR A 171 -6.916 17.097 -7.434 1.00 0.00 H new