USER MOD reduce.3.24.130724 H: found=0, std=0, add=1199, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1201 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 Single : A 6 ASN :FLIP amide:sc= -0.845 F(o=-2.8,f=-0.85) USER MOD Single : A 7 GLN :FLIP amide:sc= -0.292 F(o=-2.5!,f=-0.29) USER MOD Single : A 9 SER OG : rot -75:sc= 0.0138 USER MOD Single : A 10 GLN :FLIP amide:sc= 0 F(o=-0.79,f=0) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 75:sc= 1.24 USER MOD Single : A 28 THR OG1 : rot 93:sc= 0.742 USER MOD Single : A 33 GLN :FLIP amide:sc= -0.466 F(o=-2.3,f=-0.47) USER MOD Single : A 34 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-2.4!) USER MOD Single : A 36 MET CE :methyl -107:sc= 0 (180deg=-1.38) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 170:sc= -0.691 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -57:sc= 1.21 USER MOD Single : A 86 GLN : amide:sc= -4.73! C(o=-4.7!,f=-10!) USER MOD Single : A 88 THR OG1 : rot -25:sc= 0.223! USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= -0.691! C(o=-0.69!,f=-5.3!) USER MOD Single : A 92 THR OG1 : rot -82:sc= -0.0702 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 LYS NZ :NH3+ -160:sc= -0.0264 (180deg=-0.507) USER MOD Single : A 122 GLN : amide:sc= -0.214 X(o=-0.21,f=-0.21) USER MOD Single : A 127 SER OG : rot 40:sc= 1.13 USER MOD Single : A 134 GLN :FLIP amide:sc= -0.209 F(o=-0.84,f=-0.21) USER MOD Single : A 142 MET CE :methyl 158:sc= -0.141 (180deg=-1.28) USER MOD Single : A 144 GLN :FLIP amide:sc= -4.97! C(o=-11!,f=-5!) USER MOD Single : A 153 TYR OH : rot -135:sc= 0.231 USER MOD Single : A 163 SER OG : rot 71:sc= 1.14 USER MOD ----------------------------------------------------------------- ATOM 20 N LEU A 2 13.792 -22.238 -4.612 1.00 0.00 N ATOM 21 CA LEU A 2 12.812 -21.634 -5.509 1.00 0.00 C ATOM 22 C LEU A 2 11.720 -22.642 -5.860 1.00 0.00 C ATOM 23 O LEU A 2 10.545 -22.290 -5.955 1.00 0.00 O ATOM 24 CB LEU A 2 13.503 -21.153 -6.791 1.00 0.00 C ATOM 25 CG LEU A 2 14.086 -19.748 -6.576 1.00 0.00 C ATOM 26 CD1 LEU A 2 15.278 -19.536 -7.512 1.00 0.00 C ATOM 27 CD2 LEU A 2 13.014 -18.695 -6.878 1.00 0.00 C ATOM 0 HA LEU A 2 12.356 -20.782 -5.004 1.00 0.00 H new ATOM 0 HB2 LEU A 2 14.297 -21.847 -7.069 1.00 0.00 H new ATOM 0 HB3 LEU A 2 12.790 -21.138 -7.615 1.00 0.00 H new ATOM 0 HG LEU A 2 14.413 -19.651 -5.541 1.00 0.00 H new ATOM 0 HD11 LEU A 2 15.689 -18.539 -7.357 1.00 0.00 H new ATOM 0 HD12 LEU A 2 16.044 -20.282 -7.300 1.00 0.00 H new ATOM 0 HD13 LEU A 2 14.951 -19.637 -8.547 1.00 0.00 H new ATOM 0 HD21 LEU A 2 13.429 -17.699 -6.725 1.00 0.00 H new ATOM 0 HD22 LEU A 2 12.686 -18.796 -7.912 1.00 0.00 H new ATOM 0 HD23 LEU A 2 12.164 -18.840 -6.212 1.00 0.00 H new ATOM 39 N ARG A 3 12.118 -23.896 -6.051 1.00 0.00 N ATOM 40 CA ARG A 3 11.164 -24.945 -6.390 1.00 0.00 C ATOM 41 C ARG A 3 10.093 -25.060 -5.312 1.00 0.00 C ATOM 42 O ARG A 3 8.917 -25.273 -5.611 1.00 0.00 O ATOM 43 CB ARG A 3 11.887 -26.285 -6.538 1.00 0.00 C ATOM 44 CG ARG A 3 13.036 -26.141 -7.539 1.00 0.00 C ATOM 45 CD ARG A 3 13.486 -27.528 -8.005 1.00 0.00 C ATOM 46 NE ARG A 3 13.357 -28.491 -6.915 1.00 0.00 N ATOM 47 CZ ARG A 3 13.248 -29.794 -7.158 1.00 0.00 C ATOM 48 NH1 ARG A 3 13.260 -30.233 -8.387 1.00 0.00 N ATOM 49 NH2 ARG A 3 13.130 -30.635 -6.166 1.00 0.00 N ATOM 0 H ARG A 3 13.086 -24.208 -5.978 1.00 0.00 H new ATOM 0 HA ARG A 3 10.688 -24.685 -7.336 1.00 0.00 H new ATOM 0 HB2 ARG A 3 12.272 -26.611 -5.572 1.00 0.00 H new ATOM 0 HB3 ARG A 3 11.189 -27.051 -6.878 1.00 0.00 H new ATOM 0 HG2 ARG A 3 12.715 -25.545 -8.394 1.00 0.00 H new ATOM 0 HG3 ARG A 3 13.870 -25.613 -7.077 1.00 0.00 H new ATOM 0 HD2 ARG A 3 12.884 -27.847 -8.856 1.00 0.00 H new ATOM 0 HD3 ARG A 3 14.521 -27.488 -8.344 1.00 0.00 H new ATOM 0 HE ARG A 3 13.350 -28.159 -5.951 1.00 0.00 H new ATOM 0 HH11 ARG A 3 13.353 -29.577 -9.162 1.00 0.00 H new ATOM 0 HH12 ARG A 3 13.176 -31.233 -8.572 1.00 0.00 H new ATOM 0 HH21 ARG A 3 13.121 -30.292 -5.205 1.00 0.00 H new ATOM 0 HH22 ARG A 3 13.046 -31.634 -6.352 1.00 0.00 H new ATOM 63 N PHE A 4 10.506 -24.915 -4.057 1.00 0.00 N ATOM 64 CA PHE A 4 9.572 -25.003 -2.941 1.00 0.00 C ATOM 65 C PHE A 4 8.635 -23.801 -2.935 1.00 0.00 C ATOM 66 O PHE A 4 7.420 -23.949 -2.802 1.00 0.00 O ATOM 67 CB PHE A 4 10.342 -25.063 -1.619 1.00 0.00 C ATOM 68 CG PHE A 4 9.423 -25.543 -0.522 1.00 0.00 C ATOM 69 CD1 PHE A 4 9.224 -26.916 -0.327 1.00 0.00 C ATOM 70 CD2 PHE A 4 8.769 -24.617 0.301 1.00 0.00 C ATOM 71 CE1 PHE A 4 8.372 -27.361 0.691 1.00 0.00 C ATOM 72 CE2 PHE A 4 7.917 -25.064 1.318 1.00 0.00 C ATOM 73 CZ PHE A 4 7.719 -26.437 1.513 1.00 0.00 C ATOM 0 H PHE A 4 11.474 -24.737 -3.789 1.00 0.00 H new ATOM 0 HA PHE A 4 8.979 -25.911 -3.055 1.00 0.00 H new ATOM 0 HB2 PHE A 4 11.195 -25.735 -1.713 1.00 0.00 H new ATOM 0 HB3 PHE A 4 10.738 -24.078 -1.371 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.727 -27.631 -0.961 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.922 -23.558 0.151 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.219 -28.419 0.842 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.412 -24.350 1.952 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.062 -26.782 2.298 1.00 0.00 H new ATOM 83 N LEU A 5 9.207 -22.610 -3.079 1.00 0.00 N ATOM 84 CA LEU A 5 8.413 -21.387 -3.088 1.00 0.00 C ATOM 85 C LEU A 5 7.194 -21.552 -3.994 1.00 0.00 C ATOM 86 O LEU A 5 6.098 -21.097 -3.666 1.00 0.00 O ATOM 87 CB LEU A 5 9.274 -20.213 -3.577 1.00 0.00 C ATOM 88 CG LEU A 5 8.844 -18.920 -2.876 1.00 0.00 C ATOM 89 CD1 LEU A 5 9.653 -17.746 -3.432 1.00 0.00 C ATOM 90 CD2 LEU A 5 7.351 -18.673 -3.119 1.00 0.00 C ATOM 0 H LEU A 5 10.211 -22.466 -3.190 1.00 0.00 H new ATOM 0 HA LEU A 5 8.069 -21.183 -2.074 1.00 0.00 H new ATOM 0 HB2 LEU A 5 10.326 -20.414 -3.374 1.00 0.00 H new ATOM 0 HB3 LEU A 5 9.173 -20.102 -4.657 1.00 0.00 H new ATOM 0 HG LEU A 5 9.024 -19.012 -1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.348 -16.826 -2.934 1.00 0.00 H new ATOM 0 HD12 LEU A 5 10.714 -17.920 -3.255 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.474 -17.655 -4.503 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.048 -17.753 -2.619 1.00 0.00 H new ATOM 0 HD22 LEU A 5 7.167 -18.582 -4.189 1.00 0.00 H new ATOM 0 HD23 LEU A 5 6.775 -19.508 -2.721 1.00 0.00 H new ATOM 102 N ASN A 6 7.393 -22.209 -5.133 1.00 0.00 N ATOM 103 CA ASN A 6 6.304 -22.432 -6.076 1.00 0.00 C ATOM 104 C ASN A 6 5.297 -23.416 -5.494 1.00 0.00 C ATOM 105 O ASN A 6 4.137 -23.452 -5.902 1.00 0.00 O ATOM 106 CB ASN A 6 6.855 -22.977 -7.395 1.00 0.00 C ATOM 107 CG ASN A 6 5.727 -23.131 -8.408 1.00 0.00 C ATOM 108 OD1 ASN A 6 4.622 -22.455 -8.249 1.00 0.00 O flip ATOM 109 ND2 ASN A 6 5.854 -23.889 -9.370 1.00 0.00 N flip ATOM 0 H ASN A 6 8.292 -22.594 -5.423 1.00 0.00 H new ATOM 0 HA ASN A 6 5.804 -21.481 -6.263 1.00 0.00 H new ATOM 0 HB2 ASN A 6 7.617 -22.303 -7.787 1.00 0.00 H new ATOM 0 HB3 ASN A 6 7.338 -23.940 -7.227 1.00 0.00 H new ATOM 0 HD21 ASN A 6 6.718 -24.417 -9.493 1.00 0.00 H new ATOM 0 HD22 ASN A 6 5.095 -23.989 -10.044 1.00 0.00 H new ATOM 116 N GLN A 7 5.755 -24.213 -4.538 1.00 0.00 N ATOM 117 CA GLN A 7 4.897 -25.202 -3.897 1.00 0.00 C ATOM 118 C GLN A 7 4.023 -24.546 -2.836 1.00 0.00 C ATOM 119 O GLN A 7 2.815 -24.777 -2.779 1.00 0.00 O ATOM 120 CB GLN A 7 5.750 -26.297 -3.253 1.00 0.00 C ATOM 121 CG GLN A 7 4.872 -27.508 -2.930 1.00 0.00 C ATOM 122 CD GLN A 7 4.547 -28.271 -4.209 1.00 0.00 C ATOM 123 OE1 GLN A 7 5.005 -27.838 -5.352 1.00 0.00 O flip ATOM 124 NE2 GLN A 7 3.856 -29.290 -4.167 1.00 0.00 N flip ATOM 0 H GLN A 7 6.713 -24.195 -4.189 1.00 0.00 H new ATOM 0 HA GLN A 7 4.254 -25.644 -4.658 1.00 0.00 H new ATOM 0 HB2 GLN A 7 6.555 -26.588 -3.927 1.00 0.00 H new ATOM 0 HB3 GLN A 7 6.217 -25.920 -2.343 1.00 0.00 H new ATOM 0 HG2 GLN A 7 5.386 -28.163 -2.226 1.00 0.00 H new ATOM 0 HG3 GLN A 7 3.951 -27.182 -2.447 1.00 0.00 H new ATOM 0 HE21 GLN A 7 3.499 -29.627 -3.273 1.00 0.00 H new ATOM 0 HE22 GLN A 7 3.641 -29.796 -5.026 1.00 0.00 H new ATOM 133 N ALA A 8 4.644 -23.726 -1.994 1.00 0.00 N ATOM 134 CA ALA A 8 3.914 -23.040 -0.934 1.00 0.00 C ATOM 135 C ALA A 8 2.854 -22.115 -1.524 1.00 0.00 C ATOM 136 O ALA A 8 1.750 -22.000 -0.989 1.00 0.00 O ATOM 137 CB ALA A 8 4.885 -22.227 -0.075 1.00 0.00 C ATOM 0 H ALA A 8 5.643 -23.521 -2.024 1.00 0.00 H new ATOM 0 HA ALA A 8 3.420 -23.789 -0.314 1.00 0.00 H new ATOM 0 HB1 ALA A 8 4.333 -21.717 0.715 1.00 0.00 H new ATOM 0 HB2 ALA A 8 5.623 -22.894 0.371 1.00 0.00 H new ATOM 0 HB3 ALA A 8 5.392 -21.490 -0.698 1.00 0.00 H new ATOM 143 N SER A 9 3.192 -21.459 -2.628 1.00 0.00 N ATOM 144 CA SER A 9 2.258 -20.545 -3.276 1.00 0.00 C ATOM 145 C SER A 9 1.204 -21.323 -4.057 1.00 0.00 C ATOM 146 O SER A 9 0.030 -20.953 -4.074 1.00 0.00 O ATOM 147 CB SER A 9 3.010 -19.612 -4.223 1.00 0.00 C ATOM 148 OG SER A 9 3.576 -20.373 -5.281 1.00 0.00 O ATOM 0 H SER A 9 4.098 -21.541 -3.090 1.00 0.00 H new ATOM 0 HA SER A 9 1.763 -19.955 -2.505 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.332 -18.859 -4.624 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.793 -19.081 -3.682 1.00 0.00 H new ATOM 0 HG SER A 9 4.358 -20.863 -4.950 1.00 0.00 H new ATOM 154 N GLN A 10 1.630 -22.403 -4.702 1.00 0.00 N ATOM 155 CA GLN A 10 0.715 -23.227 -5.480 1.00 0.00 C ATOM 156 C GLN A 10 -0.319 -23.882 -4.570 1.00 0.00 C ATOM 157 O GLN A 10 -1.175 -24.640 -5.027 1.00 0.00 O ATOM 158 CB GLN A 10 1.498 -24.304 -6.238 1.00 0.00 C ATOM 159 CG GLN A 10 0.526 -25.277 -6.917 1.00 0.00 C ATOM 160 CD GLN A 10 1.196 -25.932 -8.122 1.00 0.00 C ATOM 161 OE1 GLN A 10 1.581 -25.191 -9.125 1.00 0.00 O flip ATOM 162 NE2 GLN A 10 1.373 -27.150 -8.149 1.00 0.00 N flip ATOM 0 H GLN A 10 2.597 -22.726 -4.702 1.00 0.00 H new ATOM 0 HA GLN A 10 0.196 -22.589 -6.196 1.00 0.00 H new ATOM 0 HB2 GLN A 10 2.142 -23.840 -6.985 1.00 0.00 H new ATOM 0 HB3 GLN A 10 2.147 -24.846 -5.550 1.00 0.00 H new ATOM 0 HG2 GLN A 10 0.209 -26.041 -6.207 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -0.371 -24.745 -7.234 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.071 -27.727 -7.364 1.00 0.00 H new ATOM 0 HE22 GLN A 10 1.822 -27.582 -8.957 1.00 0.00 H new ATOM 171 N GLY A 11 -0.248 -23.562 -3.280 1.00 0.00 N ATOM 172 CA GLY A 11 -1.196 -24.100 -2.310 1.00 0.00 C ATOM 173 C GLY A 11 -2.286 -23.074 -2.032 1.00 0.00 C ATOM 174 O GLY A 11 -2.040 -21.867 -2.047 1.00 0.00 O ATOM 0 H GLY A 11 0.453 -22.936 -2.884 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -1.638 -25.020 -2.692 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -0.679 -24.355 -1.385 1.00 0.00 H new ATOM 178 N ARG A 12 -3.496 -23.562 -1.776 1.00 0.00 N ATOM 179 CA ARG A 12 -4.621 -22.682 -1.497 1.00 0.00 C ATOM 180 C ARG A 12 -4.427 -21.969 -0.162 1.00 0.00 C ATOM 181 O ARG A 12 -4.594 -20.753 -0.072 1.00 0.00 O ATOM 182 CB ARG A 12 -5.924 -23.493 -1.468 1.00 0.00 C ATOM 183 CG ARG A 12 -5.632 -24.916 -0.981 1.00 0.00 C ATOM 184 CD ARG A 12 -6.936 -25.590 -0.549 1.00 0.00 C ATOM 185 NE ARG A 12 -7.315 -25.142 0.787 1.00 0.00 N ATOM 186 CZ ARG A 12 -8.529 -25.377 1.272 1.00 0.00 C ATOM 187 NH1 ARG A 12 -9.409 -26.015 0.550 1.00 0.00 N ATOM 188 NH2 ARG A 12 -8.843 -24.969 2.472 1.00 0.00 N ATOM 0 H ARG A 12 -3.720 -24.557 -1.756 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.679 -21.933 -2.287 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.648 -23.014 -0.809 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -6.368 -23.522 -2.463 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.159 -25.493 -1.776 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.931 -24.889 -0.146 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.729 -25.353 -1.259 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.814 -26.673 -0.557 1.00 0.00 H new ATOM 0 HE ARG A 12 -6.636 -24.640 1.358 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -9.165 -26.334 -0.388 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -10.341 -26.195 0.923 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.156 -24.470 3.037 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.775 -25.149 2.844 1.00 0.00 H new ATOM 202 N GLY A 13 -4.078 -22.728 0.871 1.00 0.00 N ATOM 203 CA GLY A 13 -3.865 -22.161 2.196 1.00 0.00 C ATOM 204 C GLY A 13 -3.078 -20.864 2.103 1.00 0.00 C ATOM 205 O GLY A 13 -3.425 -19.863 2.731 1.00 0.00 O ATOM 0 H GLY A 13 -3.937 -23.737 0.816 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -4.826 -21.976 2.677 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.328 -22.875 2.821 1.00 0.00 H new ATOM 209 N ALA A 14 -2.015 -20.891 1.307 1.00 0.00 N ATOM 210 CA ALA A 14 -1.179 -19.714 1.126 1.00 0.00 C ATOM 211 C ALA A 14 -1.993 -18.587 0.506 1.00 0.00 C ATOM 212 O ALA A 14 -1.955 -17.450 0.975 1.00 0.00 O ATOM 213 CB ALA A 14 0.009 -20.048 0.222 1.00 0.00 C ATOM 0 H ALA A 14 -1.714 -21.711 0.780 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.808 -19.394 2.100 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.629 -19.161 0.093 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.602 -20.841 0.678 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.356 -20.381 -0.750 1.00 0.00 H new ATOM 219 N TRP A 15 -2.734 -18.909 -0.549 1.00 0.00 N ATOM 220 CA TRP A 15 -3.556 -17.907 -1.218 1.00 0.00 C ATOM 221 C TRP A 15 -4.573 -17.324 -0.239 1.00 0.00 C ATOM 222 O TRP A 15 -4.842 -16.122 -0.249 1.00 0.00 O ATOM 223 CB TRP A 15 -4.284 -18.533 -2.410 1.00 0.00 C ATOM 224 CG TRP A 15 -3.331 -18.686 -3.555 1.00 0.00 C ATOM 225 CD1 TRP A 15 -2.936 -19.866 -4.086 1.00 0.00 C ATOM 226 CD2 TRP A 15 -2.651 -17.647 -4.318 1.00 0.00 C ATOM 227 NE1 TRP A 15 -2.056 -19.618 -5.123 1.00 0.00 N ATOM 228 CE2 TRP A 15 -1.849 -18.265 -5.306 1.00 0.00 C ATOM 229 CE3 TRP A 15 -2.653 -16.242 -4.249 1.00 0.00 C ATOM 230 CZ2 TRP A 15 -1.076 -17.517 -6.194 1.00 0.00 C ATOM 231 CZ3 TRP A 15 -1.876 -15.485 -5.142 1.00 0.00 C ATOM 232 CH2 TRP A 15 -1.089 -16.121 -6.112 1.00 0.00 C ATOM 0 H TRP A 15 -2.783 -19.843 -0.955 1.00 0.00 H new ATOM 0 HA TRP A 15 -2.909 -17.107 -1.577 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -4.692 -19.504 -2.131 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -5.126 -17.907 -2.705 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -3.256 -20.843 -3.754 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -1.614 -20.346 -5.684 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -3.255 -15.742 -3.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -0.472 -18.012 -6.940 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -1.885 -14.407 -5.081 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -0.493 -15.534 -6.795 1.00 0.00 H new ATOM 243 N LEU A 16 -5.129 -18.183 0.610 1.00 0.00 N ATOM 244 CA LEU A 16 -6.109 -17.742 1.596 1.00 0.00 C ATOM 245 C LEU A 16 -5.441 -16.838 2.629 1.00 0.00 C ATOM 246 O LEU A 16 -6.072 -15.936 3.180 1.00 0.00 O ATOM 247 CB LEU A 16 -6.737 -18.964 2.291 1.00 0.00 C ATOM 248 CG LEU A 16 -8.252 -18.993 2.049 1.00 0.00 C ATOM 249 CD1 LEU A 16 -8.807 -20.359 2.459 1.00 0.00 C ATOM 250 CD2 LEU A 16 -8.929 -17.901 2.882 1.00 0.00 C ATOM 0 H LEU A 16 -4.920 -19.181 0.635 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.893 -17.179 1.091 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.284 -19.880 1.912 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.533 -18.927 3.361 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.451 -18.818 0.992 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.883 -20.381 2.288 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.329 -21.139 1.866 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.604 -20.532 3.516 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.005 -17.925 2.708 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -8.729 -18.074 3.940 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.536 -16.926 2.593 1.00 0.00 H new ATOM 262 N LEU A 17 -4.162 -17.091 2.890 1.00 0.00 N ATOM 263 CA LEU A 17 -3.419 -16.299 3.864 1.00 0.00 C ATOM 264 C LEU A 17 -3.175 -14.886 3.338 1.00 0.00 C ATOM 265 O LEU A 17 -3.145 -13.926 4.108 1.00 0.00 O ATOM 266 CB LEU A 17 -2.075 -16.973 4.176 1.00 0.00 C ATOM 267 CG LEU A 17 -2.261 -18.032 5.274 1.00 0.00 C ATOM 268 CD1 LEU A 17 -1.143 -19.075 5.175 1.00 0.00 C ATOM 269 CD2 LEU A 17 -2.212 -17.365 6.655 1.00 0.00 C ATOM 0 H LEU A 17 -3.622 -17.833 2.444 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.012 -16.235 4.776 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.674 -17.438 3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -1.350 -16.226 4.499 1.00 0.00 H new ATOM 0 HG LEU A 17 -3.228 -18.517 5.142 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.276 -19.826 5.954 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.180 -19.556 4.198 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -0.177 -18.586 5.303 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -2.344 -18.121 7.429 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.248 -16.874 6.788 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -3.009 -16.625 6.730 1.00 0.00 H new ATOM 281 N MET A 18 -3.001 -14.761 2.025 1.00 0.00 N ATOM 282 CA MET A 18 -2.761 -13.456 1.421 1.00 0.00 C ATOM 283 C MET A 18 -4.027 -12.611 1.469 1.00 0.00 C ATOM 284 O MET A 18 -3.961 -11.390 1.612 1.00 0.00 O ATOM 285 CB MET A 18 -2.308 -13.621 -0.032 1.00 0.00 C ATOM 286 CG MET A 18 -0.955 -14.336 -0.074 1.00 0.00 C ATOM 287 SD MET A 18 -0.168 -14.040 -1.677 1.00 0.00 S ATOM 288 CE MET A 18 1.299 -15.063 -1.402 1.00 0.00 C ATOM 0 H MET A 18 -3.021 -15.539 1.366 1.00 0.00 H new ATOM 0 HA MET A 18 -1.976 -12.953 1.986 1.00 0.00 H new ATOM 0 HB2 MET A 18 -3.049 -14.192 -0.591 1.00 0.00 H new ATOM 0 HB3 MET A 18 -2.229 -12.645 -0.511 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.315 -13.974 0.730 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.091 -15.406 0.085 1.00 0.00 H new ATOM 0 HE1 MET A 18 1.939 -15.026 -2.284 1.00 0.00 H new ATOM 0 HE2 MET A 18 1.848 -14.687 -0.539 1.00 0.00 H new ATOM 0 HE3 MET A 18 0.995 -16.093 -1.218 1.00 0.00 H new ATOM 298 N ALA A 19 -5.181 -13.259 1.344 1.00 0.00 N ATOM 299 CA ALA A 19 -6.449 -12.548 1.370 1.00 0.00 C ATOM 300 C ALA A 19 -6.720 -11.988 2.759 1.00 0.00 C ATOM 301 O ALA A 19 -7.016 -10.804 2.914 1.00 0.00 O ATOM 302 CB ALA A 19 -7.585 -13.491 0.969 1.00 0.00 C ATOM 0 H ALA A 19 -5.262 -14.269 1.225 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.395 -11.722 0.661 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -8.531 -12.951 0.991 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.406 -13.869 -0.038 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.628 -14.327 1.668 1.00 0.00 H new ATOM 308 N PHE A 20 -6.623 -12.848 3.769 1.00 0.00 N ATOM 309 CA PHE A 20 -6.866 -12.431 5.144 1.00 0.00 C ATOM 310 C PHE A 20 -5.980 -11.247 5.517 1.00 0.00 C ATOM 311 O PHE A 20 -6.386 -10.378 6.287 1.00 0.00 O ATOM 312 CB PHE A 20 -6.588 -13.595 6.096 1.00 0.00 C ATOM 313 CG PHE A 20 -6.856 -13.158 7.516 1.00 0.00 C ATOM 314 CD1 PHE A 20 -8.174 -13.037 7.972 1.00 0.00 C ATOM 315 CD2 PHE A 20 -5.788 -12.873 8.375 1.00 0.00 C ATOM 316 CE1 PHE A 20 -8.424 -12.632 9.288 1.00 0.00 C ATOM 317 CE2 PHE A 20 -6.039 -12.467 9.691 1.00 0.00 C ATOM 318 CZ PHE A 20 -7.356 -12.347 10.149 1.00 0.00 C ATOM 0 H PHE A 20 -6.379 -13.833 3.661 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.909 -12.127 5.230 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -7.219 -14.446 5.841 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -5.554 -13.923 5.994 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -8.997 -13.256 7.308 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -4.771 -12.966 8.023 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.441 -12.539 9.640 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -5.215 -12.246 10.354 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.549 -12.035 11.165 1.00 0.00 H new ATOM 328 N THR A 21 -4.769 -11.219 4.972 1.00 0.00 N ATOM 329 CA THR A 21 -3.839 -10.133 5.262 1.00 0.00 C ATOM 330 C THR A 21 -4.392 -8.801 4.762 1.00 0.00 C ATOM 331 O THR A 21 -4.545 -7.854 5.531 1.00 0.00 O ATOM 332 CB THR A 21 -2.488 -10.411 4.600 1.00 0.00 C ATOM 333 OG1 THR A 21 -2.000 -11.670 5.038 1.00 0.00 O ATOM 334 CG2 THR A 21 -1.493 -9.314 4.984 1.00 0.00 C ATOM 0 H THR A 21 -4.410 -11.928 4.333 1.00 0.00 H new ATOM 0 HA THR A 21 -3.708 -10.073 6.342 1.00 0.00 H new ATOM 0 HB THR A 21 -2.609 -10.424 3.517 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.496 -12.387 4.590 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.531 -9.514 4.512 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.869 -8.348 4.648 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.369 -9.298 6.067 1.00 0.00 H new ATOM 342 N ALA A 22 -4.690 -8.738 3.468 1.00 0.00 N ATOM 343 CA ALA A 22 -5.222 -7.516 2.875 1.00 0.00 C ATOM 344 C ALA A 22 -6.538 -7.124 3.541 1.00 0.00 C ATOM 345 O ALA A 22 -6.937 -5.959 3.509 1.00 0.00 O ATOM 346 CB ALA A 22 -5.446 -7.717 1.375 1.00 0.00 C ATOM 0 H ALA A 22 -4.573 -9.512 2.814 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.498 -6.716 3.030 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.843 -6.800 0.940 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.499 -7.965 0.896 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.156 -8.530 1.219 1.00 0.00 H new ATOM 352 N LEU A 23 -7.207 -8.100 4.142 1.00 0.00 N ATOM 353 CA LEU A 23 -8.478 -7.841 4.812 1.00 0.00 C ATOM 354 C LEU A 23 -8.238 -7.326 6.228 1.00 0.00 C ATOM 355 O LEU A 23 -8.907 -6.400 6.685 1.00 0.00 O ATOM 356 CB LEU A 23 -9.307 -9.127 4.867 1.00 0.00 C ATOM 357 CG LEU A 23 -10.729 -8.808 5.343 1.00 0.00 C ATOM 358 CD1 LEU A 23 -11.495 -8.050 4.250 1.00 0.00 C ATOM 359 CD2 LEU A 23 -11.457 -10.117 5.665 1.00 0.00 C ATOM 0 H LEU A 23 -6.895 -9.070 4.180 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.021 -7.082 4.248 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.339 -9.592 3.882 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.840 -9.843 5.543 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.678 -8.184 6.235 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -12.504 -7.829 4.599 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.977 -7.118 4.022 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.549 -8.664 3.351 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.469 -9.897 6.004 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.501 -10.738 4.770 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.919 -10.649 6.450 1.00 0.00 H new ATOM 371 N ALA A 24 -7.279 -7.937 6.916 1.00 0.00 N ATOM 372 CA ALA A 24 -6.956 -7.539 8.281 1.00 0.00 C ATOM 373 C ALA A 24 -6.725 -6.034 8.367 1.00 0.00 C ATOM 374 O ALA A 24 -7.170 -5.382 9.311 1.00 0.00 O ATOM 375 CB ALA A 24 -5.702 -8.279 8.754 1.00 0.00 C ATOM 0 H ALA A 24 -6.715 -8.705 6.553 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.798 -7.798 8.923 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.465 -7.978 9.774 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.881 -9.354 8.725 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.866 -8.033 8.100 1.00 0.00 H new ATOM 381 N LEU A 25 -6.024 -5.488 7.377 1.00 0.00 N ATOM 382 CA LEU A 25 -5.736 -4.057 7.352 1.00 0.00 C ATOM 383 C LEU A 25 -6.996 -3.259 7.029 1.00 0.00 C ATOM 384 O LEU A 25 -7.182 -2.147 7.522 1.00 0.00 O ATOM 385 CB LEU A 25 -4.652 -3.760 6.310 1.00 0.00 C ATOM 386 CG LEU A 25 -3.270 -4.046 6.905 1.00 0.00 C ATOM 387 CD1 LEU A 25 -3.254 -5.447 7.525 1.00 0.00 C ATOM 388 CD2 LEU A 25 -2.215 -3.968 5.799 1.00 0.00 C ATOM 0 H LEU A 25 -5.647 -6.011 6.586 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.380 -3.760 8.338 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.810 -4.373 5.422 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.714 -2.719 5.994 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.049 -3.308 7.676 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.269 -5.647 7.947 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.005 -5.505 8.313 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.476 -6.187 6.757 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.230 -4.171 6.220 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.440 -4.706 5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.222 -2.971 5.359 1.00 0.00 H new ATOM 400 N GLU A 26 -7.860 -3.833 6.199 1.00 0.00 N ATOM 401 CA GLU A 26 -9.099 -3.163 5.821 1.00 0.00 C ATOM 402 C GLU A 26 -9.974 -2.929 7.049 1.00 0.00 C ATOM 403 O GLU A 26 -10.559 -1.857 7.211 1.00 0.00 O ATOM 404 CB GLU A 26 -9.862 -4.010 4.800 1.00 0.00 C ATOM 405 CG GLU A 26 -11.058 -3.217 4.271 1.00 0.00 C ATOM 406 CD GLU A 26 -11.659 -3.925 3.062 1.00 0.00 C ATOM 407 OE1 GLU A 26 -11.451 -5.122 2.938 1.00 0.00 O ATOM 408 OE2 GLU A 26 -12.318 -3.263 2.278 1.00 0.00 O ATOM 0 H GLU A 26 -7.727 -4.753 5.778 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.850 -2.200 5.376 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.203 -4.287 3.977 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.202 -4.937 5.262 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.810 -3.113 5.053 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.744 -2.211 3.994 1.00 0.00 H new ATOM 415 N LEU A 27 -10.058 -3.938 7.909 1.00 0.00 N ATOM 416 CA LEU A 27 -10.865 -3.833 9.119 1.00 0.00 C ATOM 417 C LEU A 27 -10.151 -2.981 10.165 1.00 0.00 C ATOM 418 O LEU A 27 -10.775 -2.167 10.848 1.00 0.00 O ATOM 419 CB LEU A 27 -11.131 -5.232 9.689 1.00 0.00 C ATOM 420 CG LEU A 27 -12.062 -5.138 10.911 1.00 0.00 C ATOM 421 CD1 LEU A 27 -13.071 -6.288 10.880 1.00 0.00 C ATOM 422 CD2 LEU A 27 -11.238 -5.232 12.201 1.00 0.00 C ATOM 0 H LEU A 27 -9.581 -4.832 7.792 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.812 -3.357 8.865 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.584 -5.864 8.925 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.190 -5.702 9.975 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.589 -4.184 10.882 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -13.729 -6.219 11.747 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.665 -6.227 9.968 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -12.539 -7.239 10.903 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -11.902 -5.165 13.063 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -10.707 -6.184 12.225 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -10.518 -4.414 12.233 1.00 0.00 H new ATOM 434 N THR A 28 -8.843 -3.174 10.285 1.00 0.00 N ATOM 435 CA THR A 28 -8.054 -2.420 11.252 1.00 0.00 C ATOM 436 C THR A 28 -8.249 -0.922 11.051 1.00 0.00 C ATOM 437 O THR A 28 -8.454 -0.180 12.012 1.00 0.00 O ATOM 438 CB THR A 28 -6.572 -2.769 11.108 1.00 0.00 C ATOM 439 OG1 THR A 28 -6.416 -4.179 11.163 1.00 0.00 O ATOM 440 CG2 THR A 28 -5.782 -2.121 12.245 1.00 0.00 C ATOM 0 H THR A 28 -8.309 -3.842 9.729 1.00 0.00 H new ATOM 0 HA THR A 28 -8.392 -2.688 12.253 1.00 0.00 H new ATOM 0 HB THR A 28 -6.199 -2.398 10.153 1.00 0.00 H new ATOM 0 HG1 THR A 28 -6.441 -4.547 10.255 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.726 -2.370 12.142 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.906 -1.039 12.203 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.151 -2.492 13.201 1.00 0.00 H new ATOM 448 N ALA A 29 -8.186 -0.482 9.799 1.00 0.00 N ATOM 449 CA ALA A 29 -8.358 0.930 9.489 1.00 0.00 C ATOM 450 C ALA A 29 -9.815 1.344 9.669 1.00 0.00 C ATOM 451 O ALA A 29 -10.108 2.496 9.995 1.00 0.00 O ATOM 452 CB ALA A 29 -7.923 1.206 8.048 1.00 0.00 C ATOM 0 H ALA A 29 -8.018 -1.079 8.989 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.739 1.510 10.173 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.055 2.265 7.825 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.873 0.938 7.927 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.530 0.612 7.365 1.00 0.00 H new ATOM 458 N LEU A 30 -10.725 0.399 9.452 1.00 0.00 N ATOM 459 CA LEU A 30 -12.151 0.669 9.586 1.00 0.00 C ATOM 460 C LEU A 30 -12.506 0.991 11.035 1.00 0.00 C ATOM 461 O LEU A 30 -13.537 1.605 11.307 1.00 0.00 O ATOM 462 CB LEU A 30 -12.956 -0.545 9.112 1.00 0.00 C ATOM 463 CG LEU A 30 -14.452 -0.206 9.074 1.00 0.00 C ATOM 464 CD1 LEU A 30 -14.718 0.886 8.031 1.00 0.00 C ATOM 465 CD2 LEU A 30 -15.242 -1.466 8.707 1.00 0.00 C ATOM 0 H LEU A 30 -10.500 -0.559 9.183 1.00 0.00 H new ATOM 0 HA LEU A 30 -12.399 1.533 8.969 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -12.619 -0.850 8.121 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.784 -1.389 9.780 1.00 0.00 H new ATOM 0 HG LEU A 30 -14.765 0.156 10.053 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -15.783 1.119 8.012 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -14.155 1.782 8.291 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -14.406 0.534 7.048 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -16.306 -1.233 8.678 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -14.922 -1.824 7.728 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -15.060 -2.240 9.453 1.00 0.00 H new ATOM 477 N TRP A 31 -11.648 0.577 11.966 1.00 0.00 N ATOM 478 CA TRP A 31 -11.891 0.828 13.383 1.00 0.00 C ATOM 479 C TRP A 31 -11.263 2.151 13.809 1.00 0.00 C ATOM 480 O TRP A 31 -11.865 2.920 14.558 1.00 0.00 O ATOM 481 CB TRP A 31 -11.310 -0.313 14.225 1.00 0.00 C ATOM 482 CG TRP A 31 -11.932 -0.301 15.586 1.00 0.00 C ATOM 483 CD1 TRP A 31 -13.260 -0.385 15.835 1.00 0.00 C ATOM 484 CD2 TRP A 31 -11.279 -0.205 16.885 1.00 0.00 C ATOM 485 NE1 TRP A 31 -13.463 -0.343 17.202 1.00 0.00 N ATOM 486 CE2 TRP A 31 -12.272 -0.232 17.893 1.00 0.00 C ATOM 487 CE3 TRP A 31 -9.934 -0.095 17.283 1.00 0.00 C ATOM 488 CZ2 TRP A 31 -11.944 -0.154 19.247 1.00 0.00 C ATOM 489 CZ3 TRP A 31 -9.600 -0.016 18.646 1.00 0.00 C ATOM 490 CH2 TRP A 31 -10.604 -0.045 19.625 1.00 0.00 C ATOM 0 H TRP A 31 -10.786 0.070 11.766 1.00 0.00 H new ATOM 0 HA TRP A 31 -12.968 0.883 13.543 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -11.497 -1.270 13.737 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -10.229 -0.203 14.308 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -14.035 -0.471 15.088 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -14.380 -0.388 17.646 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -9.154 -0.071 16.537 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -12.721 -0.178 19.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -8.564 0.068 18.941 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -10.341 0.017 20.671 1.00 0.00 H new ATOM 501 N PHE A 32 -10.054 2.416 13.323 1.00 0.00 N ATOM 502 CA PHE A 32 -9.368 3.657 13.662 1.00 0.00 C ATOM 503 C PHE A 32 -10.287 4.847 13.401 1.00 0.00 C ATOM 504 O PHE A 32 -10.304 5.811 14.165 1.00 0.00 O ATOM 505 CB PHE A 32 -8.082 3.788 12.832 1.00 0.00 C ATOM 506 CG PHE A 32 -6.895 3.341 13.655 1.00 0.00 C ATOM 507 CD1 PHE A 32 -6.275 4.239 14.533 1.00 0.00 C ATOM 508 CD2 PHE A 32 -6.419 2.029 13.546 1.00 0.00 C ATOM 509 CE1 PHE A 32 -5.178 3.826 15.299 1.00 0.00 C ATOM 510 CE2 PHE A 32 -5.322 1.615 14.312 1.00 0.00 C ATOM 511 CZ PHE A 32 -4.703 2.514 15.189 1.00 0.00 C ATOM 0 H PHE A 32 -9.535 1.796 12.701 1.00 0.00 H new ATOM 0 HA PHE A 32 -9.104 3.641 14.719 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -8.158 3.183 11.928 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -7.947 4.822 12.514 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.643 5.251 14.619 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -6.898 1.336 12.871 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.699 4.519 15.974 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.954 0.603 14.226 1.00 0.00 H new ATOM 0 HZ PHE A 32 -3.858 2.195 15.781 1.00 0.00 H new ATOM 521 N GLN A 33 -11.052 4.765 12.318 1.00 0.00 N ATOM 522 CA GLN A 33 -11.979 5.836 11.967 1.00 0.00 C ATOM 523 C GLN A 33 -13.153 5.863 12.944 1.00 0.00 C ATOM 524 O GLN A 33 -13.632 6.929 13.330 1.00 0.00 O ATOM 525 CB GLN A 33 -12.494 5.622 10.535 1.00 0.00 C ATOM 526 CG GLN A 33 -13.868 6.280 10.359 1.00 0.00 C ATOM 527 CD GLN A 33 -14.204 6.393 8.878 1.00 0.00 C ATOM 528 OE1 GLN A 33 -13.293 6.809 8.042 1.00 0.00 O flip ATOM 529 NE2 GLN A 33 -15.327 6.093 8.470 1.00 0.00 N flip ATOM 0 H GLN A 33 -11.050 3.975 11.672 1.00 0.00 H new ATOM 0 HA GLN A 33 -11.456 6.791 12.025 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -11.787 6.044 9.820 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -12.564 4.555 10.322 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -14.630 5.692 10.870 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -13.868 7.269 10.817 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -16.038 5.768 9.125 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -15.546 6.170 7.477 1.00 0.00 H new ATOM 538 N HIS A 34 -13.609 4.677 13.330 1.00 0.00 N ATOM 539 CA HIS A 34 -14.730 4.559 14.256 1.00 0.00 C ATOM 540 C HIS A 34 -14.290 4.868 15.683 1.00 0.00 C ATOM 541 O HIS A 34 -15.115 4.943 16.593 1.00 0.00 O ATOM 542 CB HIS A 34 -15.311 3.145 14.192 1.00 0.00 C ATOM 543 CG HIS A 34 -16.555 3.073 15.033 1.00 0.00 C ATOM 544 ND1 HIS A 34 -16.520 2.736 16.377 1.00 0.00 N ATOM 545 CD2 HIS A 34 -17.878 3.287 14.735 1.00 0.00 C ATOM 546 CE1 HIS A 34 -17.785 2.759 16.835 1.00 0.00 C ATOM 547 NE2 HIS A 34 -18.653 3.088 15.873 1.00 0.00 N ATOM 0 H HIS A 34 -13.222 3.786 13.018 1.00 0.00 H new ATOM 0 HA HIS A 34 -15.493 5.281 13.964 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -15.542 2.882 13.160 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -14.577 2.423 14.548 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -18.259 3.567 13.764 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -18.065 2.539 17.855 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -19.666 3.175 15.956 1.00 0.00 H new ATOM 556 N VAL A 35 -12.984 5.045 15.871 1.00 0.00 N ATOM 557 CA VAL A 35 -12.444 5.344 17.195 1.00 0.00 C ATOM 558 C VAL A 35 -11.951 6.787 17.268 1.00 0.00 C ATOM 559 O VAL A 35 -12.251 7.505 18.221 1.00 0.00 O ATOM 560 CB VAL A 35 -11.290 4.392 17.511 1.00 0.00 C ATOM 561 CG1 VAL A 35 -10.628 4.805 18.827 1.00 0.00 C ATOM 562 CG2 VAL A 35 -11.830 2.965 17.640 1.00 0.00 C ATOM 0 H VAL A 35 -12.285 4.987 15.130 1.00 0.00 H new ATOM 0 HA VAL A 35 -13.240 5.211 17.928 1.00 0.00 H new ATOM 0 HB VAL A 35 -10.555 4.435 16.707 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -9.806 4.125 19.050 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -10.244 5.821 18.738 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -11.362 4.763 19.632 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -11.009 2.284 17.865 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -12.565 2.925 18.444 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -12.301 2.668 16.703 1.00 0.00 H new ATOM 572 N MET A 36 -11.188 7.204 16.260 1.00 0.00 N ATOM 573 CA MET A 36 -10.654 8.564 16.232 1.00 0.00 C ATOM 574 C MET A 36 -11.524 9.475 15.367 1.00 0.00 C ATOM 575 O MET A 36 -11.134 10.598 15.047 1.00 0.00 O ATOM 576 CB MET A 36 -9.221 8.550 15.687 1.00 0.00 C ATOM 577 CG MET A 36 -8.246 8.187 16.810 1.00 0.00 C ATOM 578 SD MET A 36 -6.569 8.069 16.138 1.00 0.00 S ATOM 579 CE MET A 36 -5.683 8.208 17.710 1.00 0.00 C ATOM 0 H MET A 36 -10.928 6.627 15.460 1.00 0.00 H new ATOM 0 HA MET A 36 -10.654 8.952 17.251 1.00 0.00 H new ATOM 0 HB2 MET A 36 -9.138 7.830 14.873 1.00 0.00 H new ATOM 0 HB3 MET A 36 -8.969 9.527 15.275 1.00 0.00 H new ATOM 0 HG2 MET A 36 -8.282 8.942 17.596 1.00 0.00 H new ATOM 0 HG3 MET A 36 -8.535 7.239 17.265 1.00 0.00 H new ATOM 0 HE1 MET A 36 -5.215 9.190 17.778 1.00 0.00 H new ATOM 0 HE2 MET A 36 -6.384 8.082 18.535 1.00 0.00 H new ATOM 0 HE3 MET A 36 -4.915 7.436 17.765 1.00 0.00 H new ATOM 589 N LEU A 37 -12.703 8.989 14.995 1.00 0.00 N ATOM 590 CA LEU A 37 -13.616 9.774 14.170 1.00 0.00 C ATOM 591 C LEU A 37 -12.872 10.407 12.999 1.00 0.00 C ATOM 592 O LEU A 37 -13.013 11.600 12.732 1.00 0.00 O ATOM 593 CB LEU A 37 -14.268 10.874 15.015 1.00 0.00 C ATOM 594 CG LEU A 37 -15.483 11.449 14.272 1.00 0.00 C ATOM 595 CD1 LEU A 37 -16.729 10.616 14.589 1.00 0.00 C ATOM 596 CD2 LEU A 37 -15.718 12.894 14.718 1.00 0.00 C ATOM 0 H LEU A 37 -13.048 8.063 15.249 1.00 0.00 H new ATOM 0 HA LEU A 37 -14.386 9.108 13.780 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -14.577 10.470 15.979 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -13.546 11.665 15.218 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.291 11.421 13.199 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -17.587 11.029 14.059 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -16.568 9.586 14.272 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -16.919 10.640 15.662 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -16.580 13.302 14.191 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -15.905 12.918 15.792 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -14.836 13.493 14.490 1.00 0.00 H new ATOM 608 N LEU A 38 -12.080 9.599 12.304 1.00 0.00 N ATOM 609 CA LEU A 38 -11.319 10.092 11.160 1.00 0.00 C ATOM 610 C LEU A 38 -12.177 10.073 9.901 1.00 0.00 C ATOM 611 O LEU A 38 -13.105 9.273 9.782 1.00 0.00 O ATOM 612 CB LEU A 38 -10.073 9.228 10.941 1.00 0.00 C ATOM 613 CG LEU A 38 -9.302 9.092 12.255 1.00 0.00 C ATOM 614 CD1 LEU A 38 -8.284 7.956 12.136 1.00 0.00 C ATOM 615 CD2 LEU A 38 -8.567 10.402 12.561 1.00 0.00 C ATOM 0 H LEU A 38 -11.948 8.609 12.509 1.00 0.00 H new ATOM 0 HA LEU A 38 -11.015 11.118 11.368 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.362 8.243 10.574 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.436 9.678 10.179 1.00 0.00 H new ATOM 0 HG LEU A 38 -10.002 8.872 13.061 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.735 7.860 13.073 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -8.804 7.022 11.923 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.587 8.176 11.328 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -8.019 10.301 13.498 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.869 10.624 11.754 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -9.290 11.213 12.649 1.00 0.00 H new ATOM 627 N LYS A 39 -11.860 10.960 8.962 1.00 0.00 N ATOM 628 CA LYS A 39 -12.607 11.042 7.709 1.00 0.00 C ATOM 629 C LYS A 39 -11.692 10.719 6.525 1.00 0.00 C ATOM 630 O LYS A 39 -10.580 11.240 6.440 1.00 0.00 O ATOM 631 CB LYS A 39 -13.183 12.450 7.545 1.00 0.00 C ATOM 632 CG LYS A 39 -13.729 12.932 8.891 1.00 0.00 C ATOM 633 CD LYS A 39 -14.480 14.250 8.699 1.00 0.00 C ATOM 634 CE LYS A 39 -14.923 14.786 10.062 1.00 0.00 C ATOM 635 NZ LYS A 39 -15.576 16.114 9.885 1.00 0.00 N ATOM 0 H LYS A 39 -11.095 11.630 9.043 1.00 0.00 H new ATOM 0 HA LYS A 39 -13.420 10.317 7.735 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.411 13.132 7.187 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -13.977 12.446 6.798 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -14.396 12.181 9.314 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -12.911 13.068 9.599 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -13.839 14.977 8.201 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -15.347 14.097 8.057 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -15.616 14.088 10.532 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -14.063 14.877 10.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -15.877 16.479 10.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -14.901 16.778 9.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -16.406 16.013 9.266 1.00 0.00 H new ATOM 649 N PRO A 40 -12.128 9.879 5.615 1.00 0.00 N ATOM 650 CA PRO A 40 -11.312 9.501 4.427 1.00 0.00 C ATOM 651 C PRO A 40 -11.326 10.588 3.356 1.00 0.00 C ATOM 652 O PRO A 40 -12.008 11.603 3.499 1.00 0.00 O ATOM 653 CB PRO A 40 -11.990 8.226 3.923 1.00 0.00 C ATOM 654 CG PRO A 40 -13.422 8.369 4.321 1.00 0.00 C ATOM 655 CD PRO A 40 -13.436 9.199 5.610 1.00 0.00 C ATOM 0 HA PRO A 40 -10.259 9.362 4.673 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -11.888 8.125 2.842 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -11.543 7.338 4.369 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -13.995 8.862 3.536 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -13.879 7.393 4.484 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.258 9.915 5.614 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -13.560 8.567 6.489 1.00 0.00 H new ATOM 663 N CYS A 41 -10.572 10.366 2.285 1.00 0.00 N ATOM 664 CA CYS A 41 -10.506 11.331 1.191 1.00 0.00 C ATOM 665 C CYS A 41 -10.693 10.632 -0.151 1.00 0.00 C ATOM 666 O CYS A 41 -10.827 9.410 -0.212 1.00 0.00 O ATOM 667 CB CYS A 41 -9.158 12.051 1.210 1.00 0.00 C ATOM 668 SG CYS A 41 -9.273 13.565 0.225 1.00 0.00 S ATOM 0 H CYS A 41 -10.001 9.532 2.150 1.00 0.00 H new ATOM 0 HA CYS A 41 -11.307 12.058 1.324 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -8.876 12.291 2.235 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -8.380 11.401 0.809 1.00 0.00 H new ATOM 673 N VAL A 42 -10.698 11.415 -1.223 1.00 0.00 N ATOM 674 CA VAL A 42 -10.868 10.862 -2.561 1.00 0.00 C ATOM 675 C VAL A 42 -9.770 9.848 -2.862 1.00 0.00 C ATOM 676 O VAL A 42 -10.034 8.762 -3.380 1.00 0.00 O ATOM 677 CB VAL A 42 -10.827 11.986 -3.596 1.00 0.00 C ATOM 678 CG1 VAL A 42 -11.129 11.418 -4.983 1.00 0.00 C ATOM 679 CG2 VAL A 42 -11.875 13.042 -3.241 1.00 0.00 C ATOM 0 H VAL A 42 -10.587 12.429 -1.193 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.834 10.359 -2.609 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.836 12.440 -3.598 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.099 12.221 -5.719 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -10.384 10.664 -5.238 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.120 10.963 -4.982 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -11.847 13.844 -3.978 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.865 12.586 -3.239 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.661 13.449 -2.253 1.00 0.00 H new ATOM 689 N LEU A 43 -8.535 10.222 -2.547 1.00 0.00 N ATOM 690 CA LEU A 43 -7.388 9.357 -2.796 1.00 0.00 C ATOM 691 C LEU A 43 -7.456 8.088 -1.954 1.00 0.00 C ATOM 692 O LEU A 43 -7.283 6.980 -2.461 1.00 0.00 O ATOM 693 CB LEU A 43 -6.091 10.110 -2.480 1.00 0.00 C ATOM 694 CG LEU A 43 -4.906 9.417 -3.167 1.00 0.00 C ATOM 695 CD1 LEU A 43 -4.746 9.954 -4.593 1.00 0.00 C ATOM 696 CD2 LEU A 43 -3.623 9.698 -2.378 1.00 0.00 C ATOM 0 H LEU A 43 -8.303 11.118 -2.119 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.405 9.072 -3.848 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.167 11.143 -2.820 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.931 10.141 -1.402 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.091 8.343 -3.202 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.904 9.459 -5.076 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.656 9.758 -5.160 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.564 11.028 -4.559 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.781 9.206 -2.865 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.445 10.773 -2.344 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.729 9.315 -1.363 1.00 0.00 H new ATOM 708 N SER A 44 -7.707 8.263 -0.659 1.00 0.00 N ATOM 709 CA SER A 44 -7.794 7.130 0.255 1.00 0.00 C ATOM 710 C SER A 44 -8.705 6.049 -0.314 1.00 0.00 C ATOM 711 O SER A 44 -8.344 4.872 -0.339 1.00 0.00 O ATOM 712 CB SER A 44 -8.332 7.594 1.608 1.00 0.00 C ATOM 713 OG SER A 44 -7.468 8.590 2.140 1.00 0.00 O ATOM 0 H SER A 44 -7.853 9.173 -0.222 1.00 0.00 H new ATOM 0 HA SER A 44 -6.795 6.713 0.384 1.00 0.00 H new ATOM 0 HB2 SER A 44 -9.340 7.993 1.494 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.399 6.750 2.295 1.00 0.00 H new ATOM 0 HG SER A 44 -7.811 8.891 3.007 1.00 0.00 H new ATOM 719 N ILE A 45 -9.884 6.452 -0.775 1.00 0.00 N ATOM 720 CA ILE A 45 -10.827 5.497 -1.345 1.00 0.00 C ATOM 721 C ILE A 45 -10.217 4.830 -2.572 1.00 0.00 C ATOM 722 O ILE A 45 -10.355 3.623 -2.768 1.00 0.00 O ATOM 723 CB ILE A 45 -12.129 6.210 -1.726 1.00 0.00 C ATOM 724 CG1 ILE A 45 -12.790 6.760 -0.458 1.00 0.00 C ATOM 725 CG2 ILE A 45 -13.082 5.223 -2.409 1.00 0.00 C ATOM 726 CD1 ILE A 45 -14.131 7.407 -0.814 1.00 0.00 C ATOM 0 H ILE A 45 -10.207 7.420 -0.766 1.00 0.00 H new ATOM 0 HA ILE A 45 -11.048 4.731 -0.601 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.907 7.027 -2.413 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.943 5.956 0.262 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -12.136 7.492 0.016 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -14.006 5.736 -2.677 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -12.612 4.827 -3.309 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -13.307 4.403 -1.727 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.598 7.797 0.090 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.966 8.223 -1.518 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -14.785 6.663 -1.268 1.00 0.00 H new ATOM 738 N TYR A 46 -9.537 5.626 -3.390 1.00 0.00 N ATOM 739 CA TYR A 46 -8.904 5.098 -4.593 1.00 0.00 C ATOM 740 C TYR A 46 -7.969 3.947 -4.231 1.00 0.00 C ATOM 741 O TYR A 46 -8.003 2.886 -4.855 1.00 0.00 O ATOM 742 CB TYR A 46 -8.114 6.206 -5.299 1.00 0.00 C ATOM 743 CG TYR A 46 -7.939 5.854 -6.759 1.00 0.00 C ATOM 744 CD1 TYR A 46 -7.013 4.875 -7.137 1.00 0.00 C ATOM 745 CD2 TYR A 46 -8.702 6.511 -7.734 1.00 0.00 C ATOM 746 CE1 TYR A 46 -6.851 4.550 -8.490 1.00 0.00 C ATOM 747 CE2 TYR A 46 -8.539 6.186 -9.085 1.00 0.00 C ATOM 748 CZ TYR A 46 -7.613 5.205 -9.464 1.00 0.00 C ATOM 749 OH TYR A 46 -7.454 4.885 -10.797 1.00 0.00 O ATOM 0 H TYR A 46 -9.411 6.628 -3.245 1.00 0.00 H new ATOM 0 HA TYR A 46 -9.679 4.729 -5.265 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.638 7.157 -5.204 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -7.140 6.330 -4.825 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -6.424 4.370 -6.386 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.415 7.268 -7.443 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -6.138 3.793 -8.782 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -9.127 6.692 -9.836 1.00 0.00 H new ATOM 0 HH TYR A 46 -8.060 5.432 -11.339 1.00 0.00 H new ATOM 759 N GLU A 47 -7.136 4.166 -3.218 1.00 0.00 N ATOM 760 CA GLU A 47 -6.198 3.141 -2.778 1.00 0.00 C ATOM 761 C GLU A 47 -6.948 1.918 -2.261 1.00 0.00 C ATOM 762 O GLU A 47 -6.533 0.782 -2.488 1.00 0.00 O ATOM 763 CB GLU A 47 -5.295 3.695 -1.676 1.00 0.00 C ATOM 764 CG GLU A 47 -4.323 4.715 -2.273 1.00 0.00 C ATOM 765 CD GLU A 47 -3.248 3.999 -3.084 1.00 0.00 C ATOM 766 OE1 GLU A 47 -3.225 2.779 -3.053 1.00 0.00 O ATOM 767 OE2 GLU A 47 -2.463 4.680 -3.722 1.00 0.00 O ATOM 0 H GLU A 47 -7.092 5.038 -2.690 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.586 2.845 -3.630 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.899 4.164 -0.899 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.742 2.884 -1.203 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.864 5.416 -2.909 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.861 5.299 -1.477 1.00 0.00 H new ATOM 774 N ARG A 48 -8.055 2.158 -1.566 1.00 0.00 N ATOM 775 CA ARG A 48 -8.854 1.066 -1.024 1.00 0.00 C ATOM 776 C ARG A 48 -9.425 0.214 -2.152 1.00 0.00 C ATOM 777 O ARG A 48 -9.528 -1.005 -2.031 1.00 0.00 O ATOM 778 CB ARG A 48 -9.999 1.623 -0.175 1.00 0.00 C ATOM 779 CG ARG A 48 -10.789 0.464 0.439 1.00 0.00 C ATOM 780 CD ARG A 48 -11.651 0.984 1.591 1.00 0.00 C ATOM 781 NE ARG A 48 -12.319 2.223 1.206 1.00 0.00 N ATOM 782 CZ ARG A 48 -13.077 2.891 2.070 1.00 0.00 C ATOM 783 NH1 ARG A 48 -13.236 2.438 3.283 1.00 0.00 N ATOM 784 NH2 ARG A 48 -13.664 3.997 1.704 1.00 0.00 N ATOM 0 H ARG A 48 -8.417 3.091 -1.366 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.211 0.445 -0.400 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.603 2.265 0.612 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -10.655 2.239 -0.789 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.419 -0.002 -0.319 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.105 -0.304 0.801 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -12.392 0.234 1.867 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -11.030 1.156 2.470 1.00 0.00 H new ATOM 0 HE ARG A 48 -12.202 2.582 0.259 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.779 1.572 3.568 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.817 2.950 3.946 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -13.541 4.349 0.755 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -14.246 4.509 2.367 1.00 0.00 H new ATOM 798 N ALA A 49 -9.799 0.868 -3.247 1.00 0.00 N ATOM 799 CA ALA A 49 -10.363 0.164 -4.393 1.00 0.00 C ATOM 800 C ALA A 49 -9.300 -0.684 -5.083 1.00 0.00 C ATOM 801 O ALA A 49 -9.566 -1.812 -5.498 1.00 0.00 O ATOM 802 CB ALA A 49 -10.939 1.172 -5.390 1.00 0.00 C ATOM 0 H ALA A 49 -9.722 1.878 -3.365 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.157 -0.493 -4.036 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -11.359 0.640 -6.244 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.722 1.756 -4.906 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.147 1.839 -5.732 1.00 0.00 H new ATOM 808 N ALA A 50 -8.096 -0.135 -5.201 1.00 0.00 N ATOM 809 CA ALA A 50 -7.000 -0.851 -5.842 1.00 0.00 C ATOM 810 C ALA A 50 -6.734 -2.173 -5.128 1.00 0.00 C ATOM 811 O ALA A 50 -6.661 -3.227 -5.760 1.00 0.00 O ATOM 812 CB ALA A 50 -5.736 0.008 -5.826 1.00 0.00 C ATOM 0 H ALA A 50 -7.855 0.797 -4.864 1.00 0.00 H new ATOM 0 HA ALA A 50 -7.280 -1.061 -6.874 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.922 -0.534 -6.307 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.921 0.937 -6.364 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.463 0.234 -4.795 1.00 0.00 H new ATOM 818 N LEU A 51 -6.594 -2.110 -3.808 1.00 0.00 N ATOM 819 CA LEU A 51 -6.343 -3.311 -3.018 1.00 0.00 C ATOM 820 C LEU A 51 -7.611 -4.150 -2.926 1.00 0.00 C ATOM 821 O LEU A 51 -7.598 -5.338 -3.246 1.00 0.00 O ATOM 822 CB LEU A 51 -5.880 -2.925 -1.611 1.00 0.00 C ATOM 823 CG LEU A 51 -5.266 -4.147 -0.912 1.00 0.00 C ATOM 824 CD1 LEU A 51 -3.769 -4.223 -1.220 1.00 0.00 C ATOM 825 CD2 LEU A 51 -5.465 -4.025 0.602 1.00 0.00 C ATOM 0 H LEU A 51 -6.649 -1.248 -3.266 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.562 -3.894 -3.506 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.147 -2.120 -1.667 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.723 -2.548 -1.031 1.00 0.00 H new ATOM 0 HG LEU A 51 -5.757 -5.050 -1.275 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.339 -5.092 -0.722 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -3.623 -4.313 -2.296 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.277 -3.319 -0.862 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.029 -4.893 1.097 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.977 -3.119 0.961 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -6.531 -3.977 0.826 1.00 0.00 H new ATOM 837 N PHE A 52 -8.708 -3.536 -2.498 1.00 0.00 N ATOM 838 CA PHE A 52 -9.968 -4.260 -2.391 1.00 0.00 C ATOM 839 C PHE A 52 -10.189 -5.101 -3.644 1.00 0.00 C ATOM 840 O PHE A 52 -10.673 -6.232 -3.575 1.00 0.00 O ATOM 841 CB PHE A 52 -11.127 -3.277 -2.217 1.00 0.00 C ATOM 842 CG PHE A 52 -12.430 -4.038 -2.194 1.00 0.00 C ATOM 843 CD1 PHE A 52 -13.062 -4.380 -3.394 1.00 0.00 C ATOM 844 CD2 PHE A 52 -13.007 -4.402 -0.970 1.00 0.00 C ATOM 845 CE1 PHE A 52 -14.271 -5.086 -3.373 1.00 0.00 C ATOM 846 CE2 PHE A 52 -14.214 -5.107 -0.947 1.00 0.00 C ATOM 847 CZ PHE A 52 -14.847 -5.451 -2.148 1.00 0.00 C ATOM 0 H PHE A 52 -8.751 -2.555 -2.224 1.00 0.00 H new ATOM 0 HA PHE A 52 -9.926 -4.915 -1.521 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -11.005 -2.714 -1.291 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -11.130 -2.553 -3.032 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -12.617 -4.099 -4.337 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -12.519 -4.138 -0.044 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.759 -5.349 -4.300 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -14.658 -5.386 -0.003 1.00 0.00 H new ATOM 0 HZ PHE A 52 -15.779 -5.997 -2.131 1.00 0.00 H new ATOM 857 N GLY A 53 -9.819 -4.537 -4.791 1.00 0.00 N ATOM 858 CA GLY A 53 -9.965 -5.233 -6.061 1.00 0.00 C ATOM 859 C GLY A 53 -9.052 -6.449 -6.108 1.00 0.00 C ATOM 860 O GLY A 53 -9.457 -7.524 -6.552 1.00 0.00 O ATOM 0 H GLY A 53 -9.417 -3.602 -4.864 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.001 -5.543 -6.196 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -9.725 -4.558 -6.882 1.00 0.00 H new ATOM 864 N VAL A 54 -7.820 -6.280 -5.634 1.00 0.00 N ATOM 865 CA VAL A 54 -6.873 -7.384 -5.617 1.00 0.00 C ATOM 866 C VAL A 54 -7.423 -8.513 -4.756 1.00 0.00 C ATOM 867 O VAL A 54 -7.424 -9.677 -5.155 1.00 0.00 O ATOM 868 CB VAL A 54 -5.523 -6.916 -5.063 1.00 0.00 C ATOM 869 CG1 VAL A 54 -4.640 -8.130 -4.759 1.00 0.00 C ATOM 870 CG2 VAL A 54 -4.826 -6.032 -6.100 1.00 0.00 C ATOM 0 H VAL A 54 -7.461 -5.401 -5.262 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.727 -7.743 -6.636 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.688 -6.349 -4.147 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.681 -7.793 -4.365 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.133 -8.763 -4.021 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.477 -8.699 -5.674 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.866 -5.698 -5.707 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.665 -6.602 -7.015 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -5.450 -5.165 -6.317 1.00 0.00 H new ATOM 880 N LEU A 55 -7.909 -8.144 -3.573 1.00 0.00 N ATOM 881 CA LEU A 55 -8.485 -9.122 -2.661 1.00 0.00 C ATOM 882 C LEU A 55 -9.408 -10.058 -3.431 1.00 0.00 C ATOM 883 O LEU A 55 -9.339 -11.278 -3.281 1.00 0.00 O ATOM 884 CB LEU A 55 -9.277 -8.410 -1.558 1.00 0.00 C ATOM 885 CG LEU A 55 -9.664 -9.413 -0.461 1.00 0.00 C ATOM 886 CD1 LEU A 55 -8.550 -9.489 0.585 1.00 0.00 C ATOM 887 CD2 LEU A 55 -10.960 -8.956 0.214 1.00 0.00 C ATOM 0 H LEU A 55 -7.915 -7.184 -3.228 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.681 -9.699 -2.205 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.679 -7.604 -1.132 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.173 -7.954 -1.978 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.810 -10.396 -0.908 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.828 -10.201 1.362 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.625 -9.814 0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.402 -8.506 1.031 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.235 -9.667 0.993 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -10.812 -7.972 0.658 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -11.757 -8.903 -0.527 1.00 0.00 H new ATOM 899 N GLY A 56 -10.262 -9.474 -4.267 1.00 0.00 N ATOM 900 CA GLY A 56 -11.185 -10.264 -5.072 1.00 0.00 C ATOM 901 C GLY A 56 -10.411 -11.154 -6.036 1.00 0.00 C ATOM 902 O GLY A 56 -10.868 -12.231 -6.417 1.00 0.00 O ATOM 0 H GLY A 56 -10.333 -8.466 -4.403 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.812 -10.876 -4.424 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -11.850 -9.604 -5.629 1.00 0.00 H new ATOM 906 N ALA A 57 -9.227 -10.685 -6.419 1.00 0.00 N ATOM 907 CA ALA A 57 -8.378 -11.435 -7.337 1.00 0.00 C ATOM 908 C ALA A 57 -7.793 -12.656 -6.638 1.00 0.00 C ATOM 909 O ALA A 57 -7.684 -13.731 -7.230 1.00 0.00 O ATOM 910 CB ALA A 57 -7.246 -10.540 -7.848 1.00 0.00 C ATOM 0 H ALA A 57 -8.836 -9.795 -6.110 1.00 0.00 H new ATOM 0 HA ALA A 57 -8.983 -11.768 -8.180 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -6.615 -11.106 -8.533 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -7.668 -9.681 -8.369 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -6.647 -10.194 -7.006 1.00 0.00 H new ATOM 916 N ALA A 58 -7.424 -12.484 -5.374 1.00 0.00 N ATOM 917 CA ALA A 58 -6.858 -13.581 -4.599 1.00 0.00 C ATOM 918 C ALA A 58 -7.890 -14.689 -4.433 1.00 0.00 C ATOM 919 O ALA A 58 -7.549 -15.872 -4.403 1.00 0.00 O ATOM 920 CB ALA A 58 -6.418 -13.076 -3.224 1.00 0.00 C ATOM 0 H ALA A 58 -7.506 -11.603 -4.867 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.992 -13.977 -5.129 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -5.996 -13.902 -2.651 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.665 -12.297 -3.346 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.279 -12.669 -2.693 1.00 0.00 H new ATOM 926 N LEU A 59 -9.155 -14.295 -4.333 1.00 0.00 N ATOM 927 CA LEU A 59 -10.235 -15.260 -4.177 1.00 0.00 C ATOM 928 C LEU A 59 -10.490 -15.982 -5.497 1.00 0.00 C ATOM 929 O LEU A 59 -10.942 -17.126 -5.512 1.00 0.00 O ATOM 930 CB LEU A 59 -11.514 -14.542 -3.718 1.00 0.00 C ATOM 931 CG LEU A 59 -11.581 -14.524 -2.183 1.00 0.00 C ATOM 932 CD1 LEU A 59 -12.409 -13.324 -1.716 1.00 0.00 C ATOM 933 CD2 LEU A 59 -12.237 -15.815 -1.685 1.00 0.00 C ATOM 0 H LEU A 59 -9.456 -13.321 -4.357 1.00 0.00 H new ATOM 0 HA LEU A 59 -9.947 -15.994 -3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -11.527 -13.522 -4.103 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.391 -15.047 -4.123 1.00 0.00 H new ATOM 0 HG LEU A 59 -10.571 -14.447 -1.781 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.454 -13.315 -0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -11.945 -12.403 -2.068 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -13.418 -13.399 -2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -12.285 -15.802 -0.596 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -13.246 -15.891 -2.091 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -11.648 -16.672 -2.013 1.00 0.00 H new ATOM 945 N ILE A 60 -10.195 -15.305 -6.604 1.00 0.00 N ATOM 946 CA ILE A 60 -10.394 -15.890 -7.927 1.00 0.00 C ATOM 947 C ILE A 60 -9.219 -16.790 -8.300 1.00 0.00 C ATOM 948 O ILE A 60 -9.401 -17.848 -8.900 1.00 0.00 O ATOM 949 CB ILE A 60 -10.548 -14.782 -8.971 1.00 0.00 C ATOM 950 CG1 ILE A 60 -11.862 -14.034 -8.731 1.00 0.00 C ATOM 951 CG2 ILE A 60 -10.565 -15.394 -10.374 1.00 0.00 C ATOM 952 CD1 ILE A 60 -11.850 -12.716 -9.508 1.00 0.00 C ATOM 0 H ILE A 60 -9.820 -14.357 -6.612 1.00 0.00 H new ATOM 0 HA ILE A 60 -11.302 -16.493 -7.904 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.710 -14.090 -8.887 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -12.705 -14.648 -9.049 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -11.993 -13.839 -7.666 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.675 -14.602 -11.115 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -9.631 -15.928 -10.549 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -11.401 -16.088 -10.458 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -12.786 -12.184 -9.337 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -11.016 -12.101 -9.169 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -11.740 -12.922 -10.573 1.00 0.00 H new ATOM 964 N GLY A 61 -8.012 -16.361 -7.946 1.00 0.00 N ATOM 965 CA GLY A 61 -6.816 -17.137 -8.254 1.00 0.00 C ATOM 966 C GLY A 61 -6.744 -18.396 -7.394 1.00 0.00 C ATOM 967 O GLY A 61 -6.061 -19.359 -7.742 1.00 0.00 O ATOM 0 H GLY A 61 -7.836 -15.487 -7.450 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.819 -17.412 -9.309 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -5.929 -16.526 -8.086 1.00 0.00 H new ATOM 971 N ALA A 62 -7.450 -18.377 -6.269 1.00 0.00 N ATOM 972 CA ALA A 62 -7.455 -19.521 -5.362 1.00 0.00 C ATOM 973 C ALA A 62 -8.359 -20.631 -5.891 1.00 0.00 C ATOM 974 O ALA A 62 -8.610 -21.619 -5.202 1.00 0.00 O ATOM 975 CB ALA A 62 -7.936 -19.085 -3.977 1.00 0.00 C ATOM 0 H ALA A 62 -8.022 -17.590 -5.964 1.00 0.00 H new ATOM 0 HA ALA A 62 -6.437 -19.905 -5.292 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -7.937 -19.943 -3.305 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.268 -18.318 -3.585 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.946 -18.682 -4.053 1.00 0.00 H new ATOM 981 N ILE A 63 -8.846 -20.462 -7.116 1.00 0.00 N ATOM 982 CA ILE A 63 -9.721 -21.462 -7.722 1.00 0.00 C ATOM 983 C ILE A 63 -8.899 -22.579 -8.366 1.00 0.00 C ATOM 984 O ILE A 63 -9.296 -23.744 -8.334 1.00 0.00 O ATOM 985 CB ILE A 63 -10.624 -20.800 -8.777 1.00 0.00 C ATOM 986 CG1 ILE A 63 -11.872 -20.214 -8.101 1.00 0.00 C ATOM 987 CG2 ILE A 63 -11.063 -21.839 -9.818 1.00 0.00 C ATOM 988 CD1 ILE A 63 -11.465 -19.358 -6.898 1.00 0.00 C ATOM 0 H ILE A 63 -8.653 -19.651 -7.704 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.343 -21.897 -6.939 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.063 -20.005 -9.268 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -12.432 -19.610 -8.815 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -12.532 -21.019 -7.778 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -11.702 -21.362 -10.561 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -10.184 -22.256 -10.309 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -11.615 -22.638 -9.324 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -12.357 -18.947 -6.425 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -10.925 -19.974 -6.179 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -10.823 -18.543 -7.232 1.00 0.00 H new ATOM 1000 N ALA A 64 -7.753 -22.222 -8.944 1.00 0.00 N ATOM 1001 CA ALA A 64 -6.895 -23.213 -9.587 1.00 0.00 C ATOM 1002 C ALA A 64 -5.598 -22.567 -10.073 1.00 0.00 C ATOM 1003 O ALA A 64 -5.393 -22.397 -11.274 1.00 0.00 O ATOM 1004 CB ALA A 64 -7.620 -23.844 -10.779 1.00 0.00 C ATOM 0 H ALA A 64 -7.401 -21.265 -8.980 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.657 -23.984 -8.854 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -6.971 -24.581 -11.251 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.532 -24.331 -10.434 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.874 -23.069 -11.502 1.00 0.00 H new ATOM 1010 N PRO A 65 -4.726 -22.208 -9.167 1.00 0.00 N ATOM 1011 CA PRO A 65 -3.424 -21.569 -9.516 1.00 0.00 C ATOM 1012 C PRO A 65 -2.436 -22.576 -10.101 1.00 0.00 C ATOM 1013 O PRO A 65 -1.243 -22.298 -10.219 1.00 0.00 O ATOM 1014 CB PRO A 65 -2.926 -21.011 -8.180 1.00 0.00 C ATOM 1015 CG PRO A 65 -3.556 -21.872 -7.133 1.00 0.00 C ATOM 1016 CD PRO A 65 -4.883 -22.373 -7.712 1.00 0.00 C ATOM 0 HA PRO A 65 -3.529 -20.802 -10.283 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -1.838 -21.050 -8.119 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.215 -19.967 -8.057 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -2.905 -22.708 -6.877 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.723 -21.306 -6.216 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -5.066 -23.414 -7.446 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.726 -21.795 -7.334 1.00 0.00 H new ATOM 1024 N LYS A 66 -2.951 -23.747 -10.465 1.00 0.00 N ATOM 1025 CA LYS A 66 -2.121 -24.802 -11.042 1.00 0.00 C ATOM 1026 C LYS A 66 -2.396 -24.925 -12.535 1.00 0.00 C ATOM 1027 O LYS A 66 -1.693 -25.633 -13.255 1.00 0.00 O ATOM 1028 CB LYS A 66 -2.419 -26.135 -10.351 1.00 0.00 C ATOM 1029 CG LYS A 66 -1.438 -27.202 -10.843 1.00 0.00 C ATOM 1030 CD LYS A 66 -1.485 -28.410 -9.903 1.00 0.00 C ATOM 1031 CE LYS A 66 -0.540 -29.496 -10.418 1.00 0.00 C ATOM 1032 NZ LYS A 66 -0.659 -30.708 -9.557 1.00 0.00 N ATOM 0 H LYS A 66 -3.937 -23.990 -10.371 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.072 -24.547 -10.893 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -2.336 -26.022 -9.270 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -3.443 -26.444 -10.562 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.694 -27.507 -11.858 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -0.428 -26.794 -10.878 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.197 -28.111 -8.895 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.502 -28.797 -9.842 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -0.784 -29.745 -11.451 1.00 0.00 H new ATOM 0 HE3 LYS A 66 0.487 -29.132 -10.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -0.016 -31.447 -9.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -0.406 -30.465 -8.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.638 -31.059 -9.585 1.00 0.00 H new ATOM 1046 N THR A 67 -3.427 -24.219 -12.988 1.00 0.00 N ATOM 1047 CA THR A 67 -3.809 -24.234 -14.397 1.00 0.00 C ATOM 1048 C THR A 67 -3.584 -22.850 -15.004 1.00 0.00 C ATOM 1049 O THR A 67 -3.466 -21.863 -14.279 1.00 0.00 O ATOM 1050 CB THR A 67 -5.290 -24.628 -14.522 1.00 0.00 C ATOM 1051 OG1 THR A 67 -5.941 -24.388 -13.282 1.00 0.00 O ATOM 1052 CG2 THR A 67 -5.407 -26.113 -14.879 1.00 0.00 C ATOM 0 H THR A 67 -4.014 -23.628 -12.399 1.00 0.00 H new ATOM 0 HA THR A 67 -3.198 -24.961 -14.933 1.00 0.00 H new ATOM 0 HB THR A 67 -5.757 -24.035 -15.308 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.910 -24.482 -13.398 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.459 -26.385 -14.966 1.00 0.00 H new ATOM 0 HG22 THR A 67 -4.905 -26.300 -15.828 1.00 0.00 H new ATOM 0 HG23 THR A 67 -4.941 -26.713 -14.097 1.00 0.00 H new ATOM 1060 N PRO A 68 -3.523 -22.759 -16.308 1.00 0.00 N ATOM 1061 CA PRO A 68 -3.314 -21.463 -17.010 1.00 0.00 C ATOM 1062 C PRO A 68 -4.094 -20.321 -16.359 1.00 0.00 C ATOM 1063 O PRO A 68 -3.837 -19.148 -16.630 1.00 0.00 O ATOM 1064 CB PRO A 68 -3.823 -21.747 -18.423 1.00 0.00 C ATOM 1065 CG PRO A 68 -3.578 -23.207 -18.640 1.00 0.00 C ATOM 1066 CD PRO A 68 -3.642 -23.879 -17.260 1.00 0.00 C ATOM 0 HA PRO A 68 -2.275 -21.136 -16.982 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -4.882 -21.507 -18.516 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -3.294 -21.145 -19.161 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -4.327 -23.629 -19.310 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -2.606 -23.371 -19.105 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -4.578 -24.420 -17.123 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -2.835 -24.600 -17.130 1.00 0.00 H new ATOM 1074 N LEU A 69 -5.044 -20.674 -15.498 1.00 0.00 N ATOM 1075 CA LEU A 69 -5.855 -19.675 -14.810 1.00 0.00 C ATOM 1076 C LEU A 69 -4.986 -18.510 -14.334 1.00 0.00 C ATOM 1077 O LEU A 69 -5.431 -17.365 -14.314 1.00 0.00 O ATOM 1078 CB LEU A 69 -6.568 -20.320 -13.609 1.00 0.00 C ATOM 1079 CG LEU A 69 -8.008 -19.798 -13.507 1.00 0.00 C ATOM 1080 CD1 LEU A 69 -8.913 -20.596 -14.450 1.00 0.00 C ATOM 1081 CD2 LEU A 69 -8.511 -19.960 -12.070 1.00 0.00 C ATOM 0 H LEU A 69 -5.270 -21.640 -15.261 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.598 -19.290 -15.508 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.573 -21.404 -13.719 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.026 -20.095 -12.691 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.028 -18.745 -13.786 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.935 -20.223 -14.376 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.560 -20.484 -15.475 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.890 -21.650 -14.172 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.533 -19.589 -11.998 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.487 -21.014 -11.793 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.871 -19.392 -11.394 1.00 0.00 H new ATOM 1093 N ARG A 70 -3.748 -18.809 -13.953 1.00 0.00 N ATOM 1094 CA ARG A 70 -2.833 -17.770 -13.481 1.00 0.00 C ATOM 1095 C ARG A 70 -3.013 -16.484 -14.288 1.00 0.00 C ATOM 1096 O ARG A 70 -3.402 -15.459 -13.729 1.00 0.00 O ATOM 1097 CB ARG A 70 -1.387 -18.254 -13.601 1.00 0.00 C ATOM 1098 CG ARG A 70 -1.258 -19.638 -12.960 1.00 0.00 C ATOM 1099 CD ARG A 70 0.219 -19.962 -12.729 1.00 0.00 C ATOM 1100 NE ARG A 70 0.354 -21.277 -12.112 1.00 0.00 N ATOM 1101 CZ ARG A 70 1.461 -21.623 -11.464 1.00 0.00 C ATOM 1102 NH1 ARG A 70 2.456 -20.784 -11.380 1.00 0.00 N ATOM 1103 NH2 ARG A 70 1.555 -22.802 -10.914 1.00 0.00 N ATOM 0 H ARG A 70 -3.356 -19.751 -13.960 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.060 -17.561 -12.436 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -1.093 -18.298 -14.650 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -0.715 -17.550 -13.111 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -1.798 -19.663 -12.014 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -1.709 -20.392 -13.605 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.757 -19.940 -13.677 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.670 -19.204 -12.089 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.416 -21.943 -12.179 1.00 0.00 H new ATOM 0 HH11 ARG A 70 2.384 -19.863 -11.812 1.00 0.00 H new ATOM 0 HH12 ARG A 70 3.306 -21.049 -10.883 1.00 0.00 H new ATOM 0 HH21 ARG A 70 0.778 -23.459 -10.981 1.00 0.00 H new ATOM 0 HH22 ARG A 70 2.405 -23.066 -10.417 1.00 0.00 H new ATOM 1117 N TYR A 71 -2.731 -16.516 -15.587 1.00 0.00 N ATOM 1118 CA TYR A 71 -2.879 -15.316 -16.408 1.00 0.00 C ATOM 1119 C TYR A 71 -4.264 -14.700 -16.225 1.00 0.00 C ATOM 1120 O TYR A 71 -4.423 -13.487 -16.350 1.00 0.00 O ATOM 1121 CB TYR A 71 -2.667 -15.665 -17.881 1.00 0.00 C ATOM 1122 CG TYR A 71 -2.752 -14.408 -18.715 1.00 0.00 C ATOM 1123 CD1 TYR A 71 -1.603 -13.641 -18.942 1.00 0.00 C ATOM 1124 CD2 TYR A 71 -3.979 -14.012 -19.258 1.00 0.00 C ATOM 1125 CE1 TYR A 71 -1.682 -12.476 -19.715 1.00 0.00 C ATOM 1126 CE2 TYR A 71 -4.058 -12.846 -20.031 1.00 0.00 C ATOM 1127 CZ TYR A 71 -2.909 -12.079 -20.259 1.00 0.00 C ATOM 1128 OH TYR A 71 -2.987 -10.931 -21.021 1.00 0.00 O ATOM 0 H TYR A 71 -2.405 -17.343 -16.088 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.130 -14.591 -16.091 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -1.695 -16.139 -18.017 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.420 -16.382 -18.208 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.657 -13.947 -18.521 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -4.865 -14.604 -19.082 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -0.796 -11.884 -19.891 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -5.005 -12.539 -20.451 1.00 0.00 H new ATOM 0 HH TYR A 71 -3.910 -10.801 -21.323 1.00 0.00 H new ATOM 1138 N VAL A 72 -5.268 -15.528 -15.958 1.00 0.00 N ATOM 1139 CA VAL A 72 -6.631 -15.024 -15.798 1.00 0.00 C ATOM 1140 C VAL A 72 -6.789 -14.199 -14.520 1.00 0.00 C ATOM 1141 O VAL A 72 -7.380 -13.120 -14.554 1.00 0.00 O ATOM 1142 CB VAL A 72 -7.622 -16.190 -15.775 1.00 0.00 C ATOM 1143 CG1 VAL A 72 -9.047 -15.649 -15.909 1.00 0.00 C ATOM 1144 CG2 VAL A 72 -7.328 -17.135 -16.943 1.00 0.00 C ATOM 0 H VAL A 72 -5.169 -16.537 -15.849 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.839 -14.374 -16.648 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.522 -16.731 -14.834 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -9.754 -16.478 -15.893 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.260 -14.975 -15.080 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -9.144 -15.108 -16.850 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -8.034 -17.965 -16.926 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.428 -16.593 -17.883 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -6.313 -17.521 -16.852 1.00 0.00 H new ATOM 1154 N ALA A 73 -6.267 -14.682 -13.400 1.00 0.00 N ATOM 1155 CA ALA A 73 -6.373 -13.936 -12.147 1.00 0.00 C ATOM 1156 C ALA A 73 -5.335 -12.813 -12.108 1.00 0.00 C ATOM 1157 O ALA A 73 -5.570 -11.744 -11.535 1.00 0.00 O ATOM 1158 CB ALA A 73 -6.159 -14.878 -10.959 1.00 0.00 C ATOM 0 H ALA A 73 -5.773 -15.572 -13.330 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.369 -13.498 -12.085 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.239 -14.315 -10.029 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.916 -15.662 -10.975 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.169 -15.329 -11.026 1.00 0.00 H new ATOM 1164 N MET A 74 -4.183 -13.067 -12.719 1.00 0.00 N ATOM 1165 CA MET A 74 -3.111 -12.080 -12.747 1.00 0.00 C ATOM 1166 C MET A 74 -3.542 -10.824 -13.502 1.00 0.00 C ATOM 1167 O MET A 74 -2.890 -9.785 -13.410 1.00 0.00 O ATOM 1168 CB MET A 74 -1.868 -12.681 -13.413 1.00 0.00 C ATOM 1169 CG MET A 74 -0.815 -11.589 -13.633 1.00 0.00 C ATOM 1170 SD MET A 74 -1.110 -10.783 -15.228 1.00 0.00 S ATOM 1171 CE MET A 74 0.325 -11.457 -16.103 1.00 0.00 C ATOM 0 H MET A 74 -3.969 -13.942 -13.198 1.00 0.00 H new ATOM 0 HA MET A 74 -2.877 -11.801 -11.720 1.00 0.00 H new ATOM 0 HB2 MET A 74 -1.457 -13.474 -12.788 1.00 0.00 H new ATOM 0 HB3 MET A 74 -2.139 -13.135 -14.366 1.00 0.00 H new ATOM 0 HG2 MET A 74 -0.862 -10.856 -12.828 1.00 0.00 H new ATOM 0 HG3 MET A 74 0.185 -12.023 -13.611 1.00 0.00 H new ATOM 0 HE1 MET A 74 0.337 -11.081 -17.126 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.239 -11.151 -15.593 1.00 0.00 H new ATOM 0 HE3 MET A 74 0.264 -12.545 -16.117 1.00 0.00 H new ATOM 1181 N VAL A 75 -4.640 -10.919 -14.247 1.00 0.00 N ATOM 1182 CA VAL A 75 -5.125 -9.768 -15.003 1.00 0.00 C ATOM 1183 C VAL A 75 -5.387 -8.590 -14.073 1.00 0.00 C ATOM 1184 O VAL A 75 -5.105 -7.436 -14.400 1.00 0.00 O ATOM 1185 CB VAL A 75 -6.412 -10.119 -15.754 1.00 0.00 C ATOM 1186 CG1 VAL A 75 -6.916 -8.878 -16.497 1.00 0.00 C ATOM 1187 CG2 VAL A 75 -6.134 -11.238 -16.765 1.00 0.00 C ATOM 0 H VAL A 75 -5.202 -11.765 -14.343 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.356 -9.492 -15.724 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.166 -10.456 -15.043 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.833 -9.123 -17.034 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.116 -8.081 -15.781 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.158 -8.546 -17.206 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.053 -11.484 -17.297 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.380 -10.905 -17.478 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.771 -12.121 -16.239 1.00 0.00 H new ATOM 1197 N ILE A 76 -5.928 -8.912 -12.901 1.00 0.00 N ATOM 1198 CA ILE A 76 -6.237 -7.901 -11.898 1.00 0.00 C ATOM 1199 C ILE A 76 -5.025 -7.642 -11.015 1.00 0.00 C ATOM 1200 O ILE A 76 -4.822 -6.525 -10.536 1.00 0.00 O ATOM 1201 CB ILE A 76 -7.408 -8.367 -11.031 1.00 0.00 C ATOM 1202 CG1 ILE A 76 -8.562 -8.833 -11.926 1.00 0.00 C ATOM 1203 CG2 ILE A 76 -7.882 -7.215 -10.143 1.00 0.00 C ATOM 1204 CD1 ILE A 76 -8.948 -7.722 -12.907 1.00 0.00 C ATOM 0 H ILE A 76 -6.161 -9.866 -12.624 1.00 0.00 H new ATOM 0 HA ILE A 76 -6.508 -6.977 -12.410 1.00 0.00 H new ATOM 0 HB ILE A 76 -7.081 -9.196 -10.404 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.269 -9.728 -12.475 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -9.422 -9.103 -11.313 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.716 -7.550 -9.527 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.064 -6.890 -9.500 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -8.204 -6.382 -10.768 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -9.769 -8.063 -13.538 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.261 -6.838 -12.351 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.090 -7.473 -13.531 1.00 0.00 H new ATOM 1216 N TRP A 77 -4.213 -8.675 -10.808 1.00 0.00 N ATOM 1217 CA TRP A 77 -3.019 -8.534 -9.984 1.00 0.00 C ATOM 1218 C TRP A 77 -2.026 -7.590 -10.654 1.00 0.00 C ATOM 1219 O TRP A 77 -1.587 -6.610 -10.054 1.00 0.00 O ATOM 1220 CB TRP A 77 -2.363 -9.900 -9.762 1.00 0.00 C ATOM 1221 CG TRP A 77 -1.552 -9.873 -8.504 1.00 0.00 C ATOM 1222 CD1 TRP A 77 -0.293 -9.386 -8.400 1.00 0.00 C ATOM 1223 CD2 TRP A 77 -1.920 -10.341 -7.174 1.00 0.00 C ATOM 1224 NE1 TRP A 77 0.138 -9.533 -7.092 1.00 0.00 N ATOM 1225 CE2 TRP A 77 -0.832 -10.114 -6.298 1.00 0.00 C ATOM 1226 CE3 TRP A 77 -3.081 -10.936 -6.650 1.00 0.00 C ATOM 1227 CZ2 TRP A 77 -0.895 -10.466 -4.949 1.00 0.00 C ATOM 1228 CZ3 TRP A 77 -3.148 -11.290 -5.292 1.00 0.00 C ATOM 1229 CH2 TRP A 77 -2.057 -11.056 -4.444 1.00 0.00 C ATOM 0 H TRP A 77 -4.358 -9.608 -11.195 1.00 0.00 H new ATOM 0 HA TRP A 77 -3.311 -8.119 -9.019 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -3.127 -10.675 -9.697 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -1.727 -10.151 -10.611 1.00 0.00 H new ATOM 0 HD1 TRP A 77 0.282 -8.953 -9.206 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.058 -9.248 -6.756 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -3.927 -11.122 -7.295 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -0.051 -10.284 -4.300 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -4.045 -11.745 -4.899 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -2.114 -11.331 -3.401 1.00 0.00 H new ATOM 1240 N LEU A 78 -1.677 -7.888 -11.901 1.00 0.00 N ATOM 1241 CA LEU A 78 -0.739 -7.056 -12.644 1.00 0.00 C ATOM 1242 C LEU A 78 -1.317 -5.661 -12.857 1.00 0.00 C ATOM 1243 O LEU A 78 -0.643 -4.659 -12.622 1.00 0.00 O ATOM 1244 CB LEU A 78 -0.433 -7.703 -13.999 1.00 0.00 C ATOM 1245 CG LEU A 78 0.697 -6.938 -14.703 1.00 0.00 C ATOM 1246 CD1 LEU A 78 2.052 -7.335 -14.105 1.00 0.00 C ATOM 1247 CD2 LEU A 78 0.686 -7.280 -16.195 1.00 0.00 C ATOM 0 H LEU A 78 -2.028 -8.696 -12.416 1.00 0.00 H new ATOM 0 HA LEU A 78 0.182 -6.968 -12.068 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.145 -8.745 -13.857 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.327 -7.702 -14.622 1.00 0.00 H new ATOM 0 HG LEU A 78 0.544 -5.868 -14.565 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.847 -6.787 -14.611 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.065 -7.095 -13.042 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.208 -8.406 -14.237 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.487 -6.739 -16.698 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.836 -8.352 -16.324 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.273 -6.993 -16.627 1.00 0.00 H new ATOM 1259 N TYR A 79 -2.569 -5.601 -13.302 1.00 0.00 N ATOM 1260 CA TYR A 79 -3.218 -4.317 -13.538 1.00 0.00 C ATOM 1261 C TYR A 79 -2.908 -3.348 -12.401 1.00 0.00 C ATOM 1262 O TYR A 79 -2.620 -2.173 -12.632 1.00 0.00 O ATOM 1263 CB TYR A 79 -4.733 -4.511 -13.651 1.00 0.00 C ATOM 1264 CG TYR A 79 -5.415 -3.165 -13.728 1.00 0.00 C ATOM 1265 CD1 TYR A 79 -5.738 -2.477 -12.553 1.00 0.00 C ATOM 1266 CD2 TYR A 79 -5.722 -2.607 -14.974 1.00 0.00 C ATOM 1267 CE1 TYR A 79 -6.368 -1.228 -12.624 1.00 0.00 C ATOM 1268 CE2 TYR A 79 -6.354 -1.360 -15.045 1.00 0.00 C ATOM 1269 CZ TYR A 79 -6.677 -0.670 -13.870 1.00 0.00 C ATOM 1270 OH TYR A 79 -7.299 0.559 -13.940 1.00 0.00 O ATOM 0 H TYR A 79 -3.148 -6.416 -13.504 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.837 -3.901 -14.470 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.969 -5.100 -14.537 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.103 -5.068 -12.790 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.502 -2.909 -11.592 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -5.471 -3.138 -15.880 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -6.615 -0.696 -11.718 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -6.593 -0.930 -16.006 1.00 0.00 H new ATOM 0 HH TYR A 79 -7.440 0.801 -14.879 1.00 0.00 H new ATOM 1280 N SER A 80 -2.967 -3.851 -11.173 1.00 0.00 N ATOM 1281 CA SER A 80 -2.692 -3.022 -10.003 1.00 0.00 C ATOM 1282 C SER A 80 -1.189 -2.824 -9.817 1.00 0.00 C ATOM 1283 O SER A 80 -0.758 -1.866 -9.179 1.00 0.00 O ATOM 1284 CB SER A 80 -3.282 -3.678 -8.754 1.00 0.00 C ATOM 1285 OG SER A 80 -2.454 -4.761 -8.354 1.00 0.00 O ATOM 0 H SER A 80 -3.201 -4.821 -10.961 1.00 0.00 H new ATOM 0 HA SER A 80 -3.153 -2.046 -10.157 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.359 -2.948 -7.948 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.292 -4.034 -8.959 1.00 0.00 H new ATOM 0 HG SER A 80 -2.370 -5.399 -9.093 1.00 0.00 H new ATOM 1291 N ALA A 81 -0.395 -3.736 -10.360 1.00 0.00 N ATOM 1292 CA ALA A 81 1.054 -3.641 -10.223 1.00 0.00 C ATOM 1293 C ALA A 81 1.589 -2.357 -10.852 1.00 0.00 C ATOM 1294 O ALA A 81 2.211 -1.543 -10.174 1.00 0.00 O ATOM 1295 CB ALA A 81 1.724 -4.848 -10.881 1.00 0.00 C ATOM 0 H ALA A 81 -0.723 -4.541 -10.893 1.00 0.00 H new ATOM 0 HA ALA A 81 1.287 -3.626 -9.158 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.806 -4.767 -10.773 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.379 -5.763 -10.400 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.466 -4.875 -11.940 1.00 0.00 H new ATOM 1301 N PHE A 82 1.362 -2.193 -12.151 1.00 0.00 N ATOM 1302 CA PHE A 82 1.850 -1.010 -12.860 1.00 0.00 C ATOM 1303 C PHE A 82 1.032 0.236 -12.511 1.00 0.00 C ATOM 1304 O PHE A 82 1.597 1.286 -12.209 1.00 0.00 O ATOM 1305 CB PHE A 82 1.798 -1.256 -14.376 1.00 0.00 C ATOM 1306 CG PHE A 82 3.203 -1.372 -14.927 1.00 0.00 C ATOM 1307 CD1 PHE A 82 4.048 -2.395 -14.476 1.00 0.00 C ATOM 1308 CD2 PHE A 82 3.661 -0.457 -15.884 1.00 0.00 C ATOM 1309 CE1 PHE A 82 5.348 -2.502 -14.983 1.00 0.00 C ATOM 1310 CE2 PHE A 82 4.962 -0.565 -16.390 1.00 0.00 C ATOM 1311 CZ PHE A 82 5.805 -1.588 -15.939 1.00 0.00 C ATOM 0 H PHE A 82 0.849 -2.856 -12.732 1.00 0.00 H new ATOM 0 HA PHE A 82 2.879 -0.833 -12.547 1.00 0.00 H new ATOM 0 HB2 PHE A 82 1.239 -2.168 -14.586 1.00 0.00 H new ATOM 0 HB3 PHE A 82 1.271 -0.438 -14.868 1.00 0.00 H new ATOM 0 HD1 PHE A 82 3.696 -3.100 -13.738 1.00 0.00 H new ATOM 0 HD2 PHE A 82 3.010 0.332 -16.231 1.00 0.00 H new ATOM 0 HE1 PHE A 82 5.999 -3.291 -14.636 1.00 0.00 H new ATOM 0 HE2 PHE A 82 5.315 0.140 -17.128 1.00 0.00 H new ATOM 0 HZ PHE A 82 6.809 -1.672 -16.329 1.00 0.00 H new ATOM 1321 N ARG A 83 -0.290 0.141 -12.591 1.00 0.00 N ATOM 1322 CA ARG A 83 -1.140 1.298 -12.313 1.00 0.00 C ATOM 1323 C ARG A 83 -1.166 1.635 -10.823 1.00 0.00 C ATOM 1324 O ARG A 83 -1.153 2.810 -10.453 1.00 0.00 O ATOM 1325 CB ARG A 83 -2.569 1.022 -12.812 1.00 0.00 C ATOM 1326 CG ARG A 83 -3.009 2.119 -13.791 1.00 0.00 C ATOM 1327 CD ARG A 83 -3.217 3.438 -13.040 1.00 0.00 C ATOM 1328 NE ARG A 83 -2.973 4.567 -13.931 1.00 0.00 N ATOM 1329 CZ ARG A 83 -2.872 5.804 -13.457 1.00 0.00 C ATOM 1330 NH1 ARG A 83 -3.000 6.025 -12.177 1.00 0.00 N ATOM 1331 NH2 ARG A 83 -2.647 6.799 -14.272 1.00 0.00 N ATOM 0 H ARG A 83 -0.793 -0.710 -12.842 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.723 2.156 -12.840 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.609 0.049 -13.302 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -3.256 0.982 -11.967 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -2.256 2.248 -14.568 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -3.933 1.825 -14.289 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.233 3.486 -12.649 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.544 3.488 -12.184 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.878 4.404 -14.933 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.178 5.248 -11.541 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.922 6.975 -11.813 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -2.549 6.627 -15.273 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.569 7.749 -13.908 1.00 0.00 H new ATOM 1345 N GLY A 84 -1.192 0.622 -9.970 1.00 0.00 N ATOM 1346 CA GLY A 84 -1.206 0.872 -8.534 1.00 0.00 C ATOM 1347 C GLY A 84 0.040 1.646 -8.113 1.00 0.00 C ATOM 1348 O GLY A 84 -0.054 2.643 -7.395 1.00 0.00 O ATOM 0 H GLY A 84 -1.204 -0.362 -10.238 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -2.099 1.436 -8.266 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.253 -0.074 -7.995 1.00 0.00 H new ATOM 1352 N VAL A 85 1.208 1.190 -8.561 1.00 0.00 N ATOM 1353 CA VAL A 85 2.453 1.869 -8.209 1.00 0.00 C ATOM 1354 C VAL A 85 2.576 3.191 -8.964 1.00 0.00 C ATOM 1355 O VAL A 85 2.865 4.230 -8.369 1.00 0.00 O ATOM 1356 CB VAL A 85 3.662 0.978 -8.512 1.00 0.00 C ATOM 1357 CG1 VAL A 85 3.484 -0.379 -7.828 1.00 0.00 C ATOM 1358 CG2 VAL A 85 3.790 0.779 -10.024 1.00 0.00 C ATOM 0 H VAL A 85 1.319 0.370 -9.157 1.00 0.00 H new ATOM 0 HA VAL A 85 2.433 2.076 -7.139 1.00 0.00 H new ATOM 0 HB VAL A 85 4.566 1.457 -8.135 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.345 -1.011 -8.045 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.401 -0.235 -6.751 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.579 -0.858 -8.201 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.651 0.145 -10.236 1.00 0.00 H new ATOM 0 HG22 VAL A 85 2.886 0.304 -10.406 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.924 1.746 -10.508 1.00 0.00 H new ATOM 1368 N GLN A 86 2.345 3.157 -10.272 1.00 0.00 N ATOM 1369 CA GLN A 86 2.427 4.375 -11.071 1.00 0.00 C ATOM 1370 C GLN A 86 1.637 5.487 -10.392 1.00 0.00 C ATOM 1371 O GLN A 86 1.957 6.668 -10.528 1.00 0.00 O ATOM 1372 CB GLN A 86 1.870 4.123 -12.474 1.00 0.00 C ATOM 1373 CG GLN A 86 1.974 5.405 -13.309 1.00 0.00 C ATOM 1374 CD GLN A 86 0.809 6.338 -12.989 1.00 0.00 C ATOM 1375 OE1 GLN A 86 -0.137 5.941 -12.307 1.00 0.00 O ATOM 1376 NE2 GLN A 86 0.822 7.562 -13.441 1.00 0.00 N ATOM 0 H GLN A 86 2.103 2.315 -10.795 1.00 0.00 H new ATOM 0 HA GLN A 86 3.471 4.675 -11.156 1.00 0.00 H new ATOM 0 HB2 GLN A 86 2.424 3.317 -12.956 1.00 0.00 H new ATOM 0 HB3 GLN A 86 0.830 3.802 -12.411 1.00 0.00 H new ATOM 0 HG2 GLN A 86 2.919 5.907 -13.102 1.00 0.00 H new ATOM 0 HG3 GLN A 86 1.970 5.158 -14.371 1.00 0.00 H new ATOM 0 HE21 GLN A 86 1.606 7.889 -14.005 1.00 0.00 H new ATOM 0 HE22 GLN A 86 0.048 8.192 -13.230 1.00 0.00 H new ATOM 1385 N LEU A 87 0.607 5.091 -9.654 1.00 0.00 N ATOM 1386 CA LEU A 87 -0.226 6.054 -8.945 1.00 0.00 C ATOM 1387 C LEU A 87 0.507 6.582 -7.715 1.00 0.00 C ATOM 1388 O LEU A 87 0.466 7.778 -7.426 1.00 0.00 O ATOM 1389 CB LEU A 87 -1.543 5.397 -8.522 1.00 0.00 C ATOM 1390 CG LEU A 87 -2.445 6.429 -7.830 1.00 0.00 C ATOM 1391 CD1 LEU A 87 -2.818 7.542 -8.817 1.00 0.00 C ATOM 1392 CD2 LEU A 87 -3.718 5.735 -7.339 1.00 0.00 C ATOM 0 H LEU A 87 0.330 4.117 -9.531 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.441 6.888 -9.613 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.050 4.985 -9.394 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.344 4.565 -7.847 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.913 6.866 -6.985 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.458 8.270 -8.319 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.912 8.035 -9.168 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.350 7.112 -9.666 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.363 6.463 -6.847 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.245 5.299 -8.188 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.454 4.948 -6.633 1.00 0.00 H new ATOM 1404 N THR A 88 1.177 5.686 -6.994 1.00 0.00 N ATOM 1405 CA THR A 88 1.911 6.089 -5.798 1.00 0.00 C ATOM 1406 C THR A 88 2.825 7.269 -6.106 1.00 0.00 C ATOM 1407 O THR A 88 3.089 8.104 -5.242 1.00 0.00 O ATOM 1408 CB THR A 88 2.746 4.924 -5.259 1.00 0.00 C ATOM 1409 OG1 THR A 88 3.625 4.459 -6.273 1.00 0.00 O ATOM 1410 CG2 THR A 88 1.822 3.791 -4.817 1.00 0.00 C ATOM 0 H THR A 88 1.227 4.691 -7.213 1.00 0.00 H new ATOM 0 HA THR A 88 1.185 6.386 -5.041 1.00 0.00 H new ATOM 0 HB THR A 88 3.331 5.264 -4.404 1.00 0.00 H new ATOM 0 HG1 THR A 88 3.255 4.679 -7.153 1.00 0.00 H new ATOM 0 HG21 THR A 88 2.419 2.963 -4.434 1.00 0.00 H new ATOM 0 HG22 THR A 88 1.155 4.150 -4.034 1.00 0.00 H new ATOM 0 HG23 THR A 88 1.232 3.450 -5.668 1.00 0.00 H new ATOM 1418 N TYR A 89 3.308 7.325 -7.343 1.00 0.00 N ATOM 1419 CA TYR A 89 4.200 8.404 -7.757 1.00 0.00 C ATOM 1420 C TYR A 89 3.542 9.763 -7.548 1.00 0.00 C ATOM 1421 O TYR A 89 4.125 10.657 -6.935 1.00 0.00 O ATOM 1422 CB TYR A 89 4.571 8.238 -9.232 1.00 0.00 C ATOM 1423 CG TYR A 89 5.580 9.294 -9.618 1.00 0.00 C ATOM 1424 CD1 TYR A 89 6.875 9.252 -9.086 1.00 0.00 C ATOM 1425 CD2 TYR A 89 5.221 10.316 -10.506 1.00 0.00 C ATOM 1426 CE1 TYR A 89 7.810 10.231 -9.443 1.00 0.00 C ATOM 1427 CE2 TYR A 89 6.156 11.295 -10.862 1.00 0.00 C ATOM 1428 CZ TYR A 89 7.450 11.253 -10.330 1.00 0.00 C ATOM 1429 OH TYR A 89 8.372 12.218 -10.682 1.00 0.00 O ATOM 0 H TYR A 89 3.099 6.642 -8.072 1.00 0.00 H new ATOM 0 HA TYR A 89 5.101 8.355 -7.145 1.00 0.00 H new ATOM 0 HB2 TYR A 89 4.984 7.244 -9.405 1.00 0.00 H new ATOM 0 HB3 TYR A 89 3.680 8.326 -9.854 1.00 0.00 H new ATOM 0 HD1 TYR A 89 7.152 8.465 -8.401 1.00 0.00 H new ATOM 0 HD2 TYR A 89 4.222 10.349 -10.916 1.00 0.00 H new ATOM 0 HE1 TYR A 89 8.809 10.198 -9.034 1.00 0.00 H new ATOM 0 HE2 TYR A 89 5.879 12.083 -11.547 1.00 0.00 H new ATOM 0 HH TYR A 89 7.960 12.852 -11.306 1.00 0.00 H new ATOM 1439 N GLU A 90 2.328 9.915 -8.065 1.00 0.00 N ATOM 1440 CA GLU A 90 1.605 11.176 -7.932 1.00 0.00 C ATOM 1441 C GLU A 90 1.384 11.520 -6.462 1.00 0.00 C ATOM 1442 O GLU A 90 1.436 12.686 -6.074 1.00 0.00 O ATOM 1443 CB GLU A 90 0.254 11.080 -8.644 1.00 0.00 C ATOM 1444 CG GLU A 90 0.481 10.797 -10.130 1.00 0.00 C ATOM 1445 CD GLU A 90 -0.851 10.825 -10.874 1.00 0.00 C ATOM 1446 OE1 GLU A 90 -1.445 11.889 -10.945 1.00 0.00 O ATOM 1447 OE2 GLU A 90 -1.257 9.784 -11.360 1.00 0.00 O ATOM 0 H GLU A 90 1.827 9.188 -8.576 1.00 0.00 H new ATOM 0 HA GLU A 90 2.203 11.964 -8.389 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -0.348 10.287 -8.200 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -0.301 12.010 -8.520 1.00 0.00 H new ATOM 0 HG2 GLU A 90 1.158 11.540 -10.551 1.00 0.00 H new ATOM 0 HG3 GLU A 90 0.957 9.824 -10.255 1.00 0.00 H new ATOM 1454 N HIS A 91 1.133 10.499 -5.650 1.00 0.00 N ATOM 1455 CA HIS A 91 0.902 10.708 -4.224 1.00 0.00 C ATOM 1456 C HIS A 91 2.198 11.089 -3.515 1.00 0.00 C ATOM 1457 O HIS A 91 2.203 11.937 -2.624 1.00 0.00 O ATOM 1458 CB HIS A 91 0.330 9.434 -3.598 1.00 0.00 C ATOM 1459 CG HIS A 91 0.043 9.677 -2.142 1.00 0.00 C ATOM 1460 ND1 HIS A 91 0.211 10.920 -1.553 1.00 0.00 N ATOM 1461 CD2 HIS A 91 -0.402 8.846 -1.144 1.00 0.00 C ATOM 1462 CE1 HIS A 91 -0.128 10.804 -0.256 1.00 0.00 C ATOM 1463 NE2 HIS A 91 -0.510 9.559 0.046 1.00 0.00 N ATOM 0 H HIS A 91 1.084 9.526 -5.951 1.00 0.00 H new ATOM 0 HA HIS A 91 0.189 11.524 -4.108 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -0.583 9.140 -4.116 1.00 0.00 H new ATOM 0 HB3 HIS A 91 1.038 8.612 -3.708 1.00 0.00 H new ATOM 0 HD1 HIS A 91 0.533 11.769 -2.018 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -0.633 7.798 -1.264 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -0.095 11.617 0.454 1.00 0.00 H new ATOM 1472 N THR A 92 3.295 10.453 -3.913 1.00 0.00 N ATOM 1473 CA THR A 92 4.591 10.729 -3.304 1.00 0.00 C ATOM 1474 C THR A 92 5.129 12.083 -3.762 1.00 0.00 C ATOM 1475 O THR A 92 5.501 12.920 -2.941 1.00 0.00 O ATOM 1476 CB THR A 92 5.588 9.631 -3.680 1.00 0.00 C ATOM 1477 OG1 THR A 92 5.533 9.404 -5.081 1.00 0.00 O ATOM 1478 CG2 THR A 92 5.236 8.342 -2.937 1.00 0.00 C ATOM 0 H THR A 92 3.313 9.748 -4.650 1.00 0.00 H new ATOM 0 HA THR A 92 4.462 10.752 -2.222 1.00 0.00 H new ATOM 0 HB THR A 92 6.595 9.943 -3.402 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.778 8.814 -5.287 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.947 7.561 -3.206 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.280 8.518 -1.862 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.230 8.027 -3.212 1.00 0.00 H new ATOM 1486 N MET A 93 5.169 12.286 -5.074 1.00 0.00 N ATOM 1487 CA MET A 93 5.667 13.541 -5.626 1.00 0.00 C ATOM 1488 C MET A 93 4.960 14.727 -4.980 1.00 0.00 C ATOM 1489 O MET A 93 5.604 15.642 -4.472 1.00 0.00 O ATOM 1490 CB MET A 93 5.445 13.574 -7.139 1.00 0.00 C ATOM 1491 CG MET A 93 6.280 14.698 -7.754 1.00 0.00 C ATOM 1492 SD MET A 93 5.726 15.005 -9.450 1.00 0.00 S ATOM 1493 CE MET A 93 4.588 16.361 -9.077 1.00 0.00 C ATOM 0 H MET A 93 4.866 11.605 -5.770 1.00 0.00 H new ATOM 0 HA MET A 93 6.734 13.609 -5.416 1.00 0.00 H new ATOM 0 HB2 MET A 93 5.725 12.617 -7.579 1.00 0.00 H new ATOM 0 HB3 MET A 93 4.389 13.730 -7.359 1.00 0.00 H new ATOM 0 HG2 MET A 93 6.182 15.606 -7.158 1.00 0.00 H new ATOM 0 HG3 MET A 93 7.335 14.426 -7.749 1.00 0.00 H new ATOM 0 HE1 MET A 93 4.125 16.711 -9.999 1.00 0.00 H new ATOM 0 HE2 MET A 93 3.815 16.010 -8.393 1.00 0.00 H new ATOM 0 HE3 MET A 93 5.138 17.180 -8.613 1.00 0.00 H new ATOM 1503 N LEU A 94 3.633 14.700 -5.003 1.00 0.00 N ATOM 1504 CA LEU A 94 2.846 15.779 -4.416 1.00 0.00 C ATOM 1505 C LEU A 94 3.224 15.976 -2.953 1.00 0.00 C ATOM 1506 O LEU A 94 3.473 17.098 -2.511 1.00 0.00 O ATOM 1507 CB LEU A 94 1.352 15.456 -4.525 1.00 0.00 C ATOM 1508 CG LEU A 94 0.528 16.547 -3.818 1.00 0.00 C ATOM 1509 CD1 LEU A 94 -0.701 16.896 -4.662 1.00 0.00 C ATOM 1510 CD2 LEU A 94 0.068 16.042 -2.445 1.00 0.00 C ATOM 0 H LEU A 94 3.082 13.949 -5.418 1.00 0.00 H new ATOM 0 HA LEU A 94 3.056 16.699 -4.961 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.061 15.390 -5.573 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.147 14.484 -4.075 1.00 0.00 H new ATOM 0 HG LEU A 94 1.149 17.434 -3.692 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.281 17.669 -4.158 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.381 17.262 -5.638 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.317 16.006 -4.792 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.515 16.818 -1.949 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.547 15.151 -2.572 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.939 15.797 -1.837 1.00 0.00 H new ATOM 1522 N GLN A 95 3.265 14.878 -2.206 1.00 0.00 N ATOM 1523 CA GLN A 95 3.617 14.942 -0.793 1.00 0.00 C ATOM 1524 C GLN A 95 4.961 15.639 -0.616 1.00 0.00 C ATOM 1525 O GLN A 95 5.171 16.373 0.350 1.00 0.00 O ATOM 1526 CB GLN A 95 3.690 13.531 -0.205 1.00 0.00 C ATOM 1527 CG GLN A 95 4.027 13.616 1.286 1.00 0.00 C ATOM 1528 CD GLN A 95 3.932 12.233 1.921 1.00 0.00 C ATOM 1529 OE1 GLN A 95 4.828 11.407 1.748 1.00 0.00 O ATOM 1530 NE2 GLN A 95 2.894 11.930 2.652 1.00 0.00 N ATOM 0 H GLN A 95 3.061 13.940 -2.552 1.00 0.00 H new ATOM 0 HA GLN A 95 2.848 15.510 -0.269 1.00 0.00 H new ATOM 0 HB2 GLN A 95 2.739 13.018 -0.345 1.00 0.00 H new ATOM 0 HB3 GLN A 95 4.448 12.947 -0.727 1.00 0.00 H new ATOM 0 HG2 GLN A 95 5.032 14.018 1.418 1.00 0.00 H new ATOM 0 HG3 GLN A 95 3.342 14.302 1.784 1.00 0.00 H new ATOM 0 HE21 GLN A 95 2.153 12.616 2.794 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.824 11.007 3.081 1.00 0.00 H new ATOM 1796 N GLU A 112 -20.720 8.312 -15.020 1.00 0.00 N ATOM 1797 CA GLU A 112 -22.121 8.044 -14.714 1.00 0.00 C ATOM 1798 C GLU A 112 -22.573 6.724 -15.332 1.00 0.00 C ATOM 1799 O GLU A 112 -23.769 6.493 -15.507 1.00 0.00 O ATOM 1800 CB GLU A 112 -22.990 9.184 -15.246 1.00 0.00 C ATOM 1801 CG GLU A 112 -22.644 10.475 -14.503 1.00 0.00 C ATOM 1802 CD GLU A 112 -23.558 11.604 -14.965 1.00 0.00 C ATOM 1803 OE1 GLU A 112 -24.692 11.642 -14.517 1.00 0.00 O ATOM 1804 OE2 GLU A 112 -23.111 12.413 -15.761 1.00 0.00 O ATOM 0 HA GLU A 112 -22.229 7.972 -13.632 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -22.826 9.312 -16.316 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -24.045 8.945 -15.111 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -22.751 10.326 -13.429 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -21.603 10.741 -14.685 1.00 0.00 H new ATOM 1811 N TRP A 113 -21.613 5.861 -15.659 1.00 0.00 N ATOM 1812 CA TRP A 113 -21.932 4.565 -16.257 1.00 0.00 C ATOM 1813 C TRP A 113 -21.378 3.422 -15.406 1.00 0.00 C ATOM 1814 O TRP A 113 -21.388 2.265 -15.825 1.00 0.00 O ATOM 1815 CB TRP A 113 -21.365 4.492 -17.685 1.00 0.00 C ATOM 1816 CG TRP A 113 -20.032 3.808 -17.686 1.00 0.00 C ATOM 1817 CD1 TRP A 113 -18.841 4.428 -17.521 1.00 0.00 C ATOM 1818 CD2 TRP A 113 -19.735 2.392 -17.858 1.00 0.00 C ATOM 1819 NE1 TRP A 113 -17.833 3.483 -17.581 1.00 0.00 N ATOM 1820 CE2 TRP A 113 -18.333 2.212 -17.786 1.00 0.00 C ATOM 1821 CE3 TRP A 113 -20.538 1.255 -18.066 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 -17.749 0.952 -17.916 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 -19.954 -0.015 -18.198 1.00 0.00 C ATOM 1824 CH2 TRP A 113 -18.562 -0.167 -18.124 1.00 0.00 C ATOM 0 H TRP A 113 -20.617 6.032 -15.522 1.00 0.00 H new ATOM 0 HA TRP A 113 -23.016 4.461 -16.299 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -22.058 3.952 -18.331 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -21.265 5.497 -18.095 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -18.700 5.488 -17.368 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -16.841 3.699 -17.485 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -21.611 1.360 -18.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -16.676 0.841 -17.856 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -20.581 -0.880 -18.357 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -18.118 -1.146 -18.227 1.00 0.00 H new ATOM 1835 N LEU A 114 -20.901 3.752 -14.206 1.00 0.00 N ATOM 1836 CA LEU A 114 -20.353 2.743 -13.303 1.00 0.00 C ATOM 1837 C LEU A 114 -21.111 2.751 -11.979 1.00 0.00 C ATOM 1838 O LEU A 114 -20.657 3.339 -10.998 1.00 0.00 O ATOM 1839 CB LEU A 114 -18.869 3.022 -13.042 1.00 0.00 C ATOM 1840 CG LEU A 114 -18.039 2.608 -14.264 1.00 0.00 C ATOM 1841 CD1 LEU A 114 -16.630 3.189 -14.137 1.00 0.00 C ATOM 1842 CD2 LEU A 114 -17.954 1.077 -14.350 1.00 0.00 C ATOM 0 H LEU A 114 -20.883 4.704 -13.839 1.00 0.00 H new ATOM 0 HA LEU A 114 -20.460 1.764 -13.771 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -18.720 4.081 -12.832 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -18.536 2.473 -12.162 1.00 0.00 H new ATOM 0 HG LEU A 114 -18.517 2.989 -15.167 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -16.037 2.897 -15.004 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -16.688 4.276 -14.086 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -16.160 2.808 -13.230 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -17.363 0.794 -15.221 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -17.481 0.688 -13.448 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -18.957 0.661 -14.442 1.00 0.00 H new ATOM 1854 N PRO A 115 -22.252 2.114 -11.936 1.00 0.00 N ATOM 1855 CA PRO A 115 -23.092 2.049 -10.704 1.00 0.00 C ATOM 1856 C PRO A 115 -22.299 1.576 -9.487 1.00 0.00 C ATOM 1857 O PRO A 115 -22.842 1.456 -8.392 1.00 0.00 O ATOM 1858 CB PRO A 115 -24.196 1.046 -11.063 1.00 0.00 C ATOM 1859 CG PRO A 115 -24.275 1.062 -12.555 1.00 0.00 C ATOM 1860 CD PRO A 115 -22.869 1.387 -13.058 1.00 0.00 C ATOM 0 HA PRO A 115 -23.478 3.029 -10.424 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -23.957 0.049 -10.693 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -25.148 1.332 -10.616 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -24.611 0.098 -12.936 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -24.992 1.808 -12.898 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -22.313 0.482 -13.302 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -22.899 1.996 -13.961 1.00 0.00 H new ATOM 1868 N LEU A 116 -21.013 1.307 -9.682 1.00 0.00 N ATOM 1869 CA LEU A 116 -20.162 0.848 -8.595 1.00 0.00 C ATOM 1870 C LEU A 116 -20.106 1.892 -7.486 1.00 0.00 C ATOM 1871 O LEU A 116 -19.984 1.560 -6.307 1.00 0.00 O ATOM 1872 CB LEU A 116 -18.744 0.573 -9.121 1.00 0.00 C ATOM 1873 CG LEU A 116 -18.555 -0.930 -9.371 1.00 0.00 C ATOM 1874 CD1 LEU A 116 -17.444 -1.143 -10.400 1.00 0.00 C ATOM 1875 CD2 LEU A 116 -18.171 -1.625 -8.061 1.00 0.00 C ATOM 0 H LEU A 116 -20.540 1.399 -10.581 1.00 0.00 H new ATOM 0 HA LEU A 116 -20.581 -0.073 -8.190 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -18.577 1.127 -10.045 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.006 0.925 -8.400 1.00 0.00 H new ATOM 0 HG LEU A 116 -19.487 -1.351 -9.748 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -17.311 -2.210 -10.576 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -17.715 -0.652 -11.335 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -16.513 -0.719 -10.024 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -18.037 -2.692 -8.241 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -17.240 -1.201 -7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -18.962 -1.477 -7.325 1.00 0.00 H new ATOM 1887 N ASP A 117 -20.198 3.161 -7.879 1.00 0.00 N ATOM 1888 CA ASP A 117 -20.162 4.261 -6.923 1.00 0.00 C ATOM 1889 C ASP A 117 -21.575 4.714 -6.572 1.00 0.00 C ATOM 1890 O ASP A 117 -21.876 5.002 -5.413 1.00 0.00 O ATOM 1891 CB ASP A 117 -19.379 5.436 -7.512 1.00 0.00 C ATOM 1892 CG ASP A 117 -20.101 5.980 -8.740 1.00 0.00 C ATOM 1893 OD1 ASP A 117 -20.833 5.222 -9.356 1.00 0.00 O ATOM 1894 OD2 ASP A 117 -19.910 7.145 -9.048 1.00 0.00 O ATOM 0 H ASP A 117 -20.298 3.451 -8.852 1.00 0.00 H new ATOM 0 HA ASP A 117 -19.670 3.913 -6.015 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -19.271 6.223 -6.765 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -18.374 5.114 -7.784 1.00 0.00 H new ATOM 1899 N LYS A 118 -22.438 4.782 -7.583 1.00 0.00 N ATOM 1900 CA LYS A 118 -23.817 5.210 -7.368 1.00 0.00 C ATOM 1901 C LYS A 118 -24.607 4.135 -6.627 1.00 0.00 C ATOM 1902 O LYS A 118 -25.342 4.431 -5.685 1.00 0.00 O ATOM 1903 CB LYS A 118 -24.488 5.499 -8.713 1.00 0.00 C ATOM 1904 CG LYS A 118 -25.775 6.294 -8.483 1.00 0.00 C ATOM 1905 CD LYS A 118 -26.636 6.252 -9.747 1.00 0.00 C ATOM 1906 CE LYS A 118 -27.760 7.284 -9.636 1.00 0.00 C ATOM 1907 NZ LYS A 118 -28.430 7.150 -8.311 1.00 0.00 N ATOM 0 H LYS A 118 -22.210 4.549 -8.549 1.00 0.00 H new ATOM 0 HA LYS A 118 -23.804 6.116 -6.762 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -23.811 6.062 -9.355 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -24.713 4.565 -9.227 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -26.327 5.877 -7.641 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -25.536 7.326 -8.227 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -26.023 6.460 -10.624 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -27.056 5.255 -9.880 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -27.357 8.290 -9.751 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -28.484 7.137 -10.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -29.373 7.587 -8.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -28.525 6.143 -8.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -27.860 7.627 -7.584 1.00 0.00 H new ATOM 1921 N TRP A 119 -24.449 2.890 -7.059 1.00 0.00 N ATOM 1922 CA TRP A 119 -25.151 1.777 -6.431 1.00 0.00 C ATOM 1923 C TRP A 119 -24.527 1.445 -5.081 1.00 0.00 C ATOM 1924 O TRP A 119 -25.137 0.764 -4.256 1.00 0.00 O ATOM 1925 CB TRP A 119 -25.097 0.542 -7.339 1.00 0.00 C ATOM 1926 CG TRP A 119 -26.244 -0.367 -7.026 1.00 0.00 C ATOM 1927 CD1 TRP A 119 -27.550 -0.056 -7.199 1.00 0.00 C ATOM 1928 CD2 TRP A 119 -26.212 -1.723 -6.494 1.00 0.00 C ATOM 1929 NE1 TRP A 119 -28.321 -1.135 -6.807 1.00 0.00 N ATOM 1930 CE2 TRP A 119 -27.543 -2.188 -6.366 1.00 0.00 C ATOM 1931 CE3 TRP A 119 -25.170 -2.588 -6.116 1.00 0.00 C ATOM 1932 CZ2 TRP A 119 -27.829 -3.463 -5.879 1.00 0.00 C ATOM 1933 CZ3 TRP A 119 -25.454 -3.873 -5.625 1.00 0.00 C ATOM 1934 CH2 TRP A 119 -26.781 -4.309 -5.508 1.00 0.00 C ATOM 0 H TRP A 119 -23.845 2.626 -7.837 1.00 0.00 H new ATOM 0 HA TRP A 119 -26.190 2.068 -6.278 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -25.137 0.846 -8.385 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -24.154 0.015 -7.196 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -27.928 0.881 -7.581 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -29.340 -1.151 -6.840 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -24.144 -2.262 -6.204 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -28.853 -3.794 -5.789 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -24.646 -4.528 -5.336 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -26.993 -5.299 -5.131 1.00 0.00 H new ATOM 1945 N VAL A 120 -23.309 1.932 -4.858 1.00 0.00 N ATOM 1946 CA VAL A 120 -22.617 1.677 -3.596 1.00 0.00 C ATOM 1947 C VAL A 120 -21.855 2.916 -3.130 1.00 0.00 C ATOM 1948 O VAL A 120 -20.626 2.954 -3.177 1.00 0.00 O ATOM 1949 CB VAL A 120 -21.640 0.510 -3.763 1.00 0.00 C ATOM 1950 CG1 VAL A 120 -21.275 -0.053 -2.388 1.00 0.00 C ATOM 1951 CG2 VAL A 120 -22.297 -0.586 -4.604 1.00 0.00 C ATOM 0 H VAL A 120 -22.785 2.499 -5.525 1.00 0.00 H new ATOM 0 HA VAL A 120 -23.365 1.425 -2.844 1.00 0.00 H new ATOM 0 HB VAL A 120 -20.737 0.861 -4.262 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -20.580 -0.884 -2.508 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -20.808 0.728 -1.788 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -22.177 -0.405 -1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -21.603 -1.418 -4.724 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -23.200 -0.936 -4.104 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -22.557 -0.186 -5.584 1.00 0.00 H new ATOM 1961 N PRO A 121 -22.561 3.921 -2.680 1.00 0.00 N ATOM 1962 CA PRO A 121 -21.941 5.184 -2.189 1.00 0.00 C ATOM 1963 C PRO A 121 -21.375 5.029 -0.777 1.00 0.00 C ATOM 1964 O PRO A 121 -20.554 5.828 -0.332 1.00 0.00 O ATOM 1965 CB PRO A 121 -23.101 6.181 -2.215 1.00 0.00 C ATOM 1966 CG PRO A 121 -24.334 5.355 -2.023 1.00 0.00 C ATOM 1967 CD PRO A 121 -24.031 3.963 -2.591 1.00 0.00 C ATOM 0 HA PRO A 121 -21.093 5.497 -2.798 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -22.999 6.925 -1.425 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -23.133 6.723 -3.160 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -24.596 5.292 -0.967 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -25.184 5.805 -2.536 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -24.413 3.176 -1.941 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -24.493 3.822 -3.568 1.00 0.00 H new ATOM 1975 N GLN A 122 -21.832 3.995 -0.081 1.00 0.00 N ATOM 1976 CA GLN A 122 -21.380 3.736 1.282 1.00 0.00 C ATOM 1977 C GLN A 122 -19.859 3.755 1.356 1.00 0.00 C ATOM 1978 O GLN A 122 -19.275 4.460 2.180 1.00 0.00 O ATOM 1979 CB GLN A 122 -21.895 2.374 1.753 1.00 0.00 C ATOM 1980 CG GLN A 122 -23.415 2.431 1.917 1.00 0.00 C ATOM 1981 CD GLN A 122 -23.777 3.298 3.118 1.00 0.00 C ATOM 1982 OE1 GLN A 122 -23.523 2.916 4.261 1.00 0.00 O ATOM 1983 NE2 GLN A 122 -24.360 4.449 2.928 1.00 0.00 N ATOM 0 H GLN A 122 -22.513 3.324 -0.436 1.00 0.00 H new ATOM 0 HA GLN A 122 -21.775 4.520 1.929 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -21.625 1.602 1.032 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -21.427 2.104 2.699 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -23.872 2.837 1.014 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -23.813 1.425 2.051 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -24.570 4.764 1.981 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -24.606 5.034 3.727 1.00 0.00 H new ATOM 1992 N VAL A 123 -19.223 2.974 0.489 1.00 0.00 N ATOM 1993 CA VAL A 123 -17.765 2.900 0.460 1.00 0.00 C ATOM 1994 C VAL A 123 -17.224 3.498 -0.834 1.00 0.00 C ATOM 1995 O VAL A 123 -16.481 2.849 -1.569 1.00 0.00 O ATOM 1996 CB VAL A 123 -17.315 1.444 0.581 1.00 0.00 C ATOM 1997 CG1 VAL A 123 -17.636 0.926 1.985 1.00 0.00 C ATOM 1998 CG2 VAL A 123 -18.052 0.592 -0.454 1.00 0.00 C ATOM 0 H VAL A 123 -19.691 2.385 -0.200 1.00 0.00 H new ATOM 0 HA VAL A 123 -17.373 3.472 1.301 1.00 0.00 H new ATOM 0 HB VAL A 123 -16.241 1.382 0.405 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -17.315 -0.112 2.072 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -17.112 1.531 2.725 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -18.710 0.990 2.160 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -17.730 -0.446 -0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -19.126 0.655 -0.279 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -17.826 0.959 -1.455 1.00 0.00 H new ATOM 2008 N PHE A 124 -17.606 4.744 -1.103 1.00 0.00 N ATOM 2009 CA PHE A 124 -17.160 5.431 -2.309 1.00 0.00 C ATOM 2010 C PHE A 124 -17.194 6.944 -2.101 1.00 0.00 C ATOM 2011 O PHE A 124 -16.289 7.660 -2.528 1.00 0.00 O ATOM 2012 CB PHE A 124 -18.060 5.049 -3.490 1.00 0.00 C ATOM 2013 CG PHE A 124 -17.286 5.174 -4.783 1.00 0.00 C ATOM 2014 CD1 PHE A 124 -17.102 6.430 -5.371 1.00 0.00 C ATOM 2015 CD2 PHE A 124 -16.756 4.030 -5.393 1.00 0.00 C ATOM 2016 CE1 PHE A 124 -16.387 6.543 -6.571 1.00 0.00 C ATOM 2017 CE2 PHE A 124 -16.042 4.143 -6.591 1.00 0.00 C ATOM 2018 CZ PHE A 124 -15.857 5.400 -7.180 1.00 0.00 C ATOM 0 H PHE A 124 -18.221 5.295 -0.504 1.00 0.00 H new ATOM 0 HA PHE A 124 -16.135 5.129 -2.525 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -18.421 4.028 -3.369 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -18.937 5.696 -3.516 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -17.511 7.312 -4.900 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -16.898 3.061 -4.939 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -16.245 7.512 -7.026 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -15.634 3.261 -7.061 1.00 0.00 H new ATOM 0 HZ PHE A 124 -15.305 5.487 -8.104 1.00 0.00 H new ATOM 2028 N VAL A 125 -18.246 7.420 -1.443 1.00 0.00 N ATOM 2029 CA VAL A 125 -18.387 8.852 -1.186 1.00 0.00 C ATOM 2030 C VAL A 125 -17.180 9.382 -0.420 1.00 0.00 C ATOM 2031 O VAL A 125 -16.771 8.813 0.591 1.00 0.00 O ATOM 2032 CB VAL A 125 -19.658 9.135 -0.388 1.00 0.00 C ATOM 2033 CG1 VAL A 125 -20.878 8.715 -1.207 1.00 0.00 C ATOM 2034 CG2 VAL A 125 -19.620 8.354 0.929 1.00 0.00 C ATOM 0 H VAL A 125 -19.006 6.844 -1.081 1.00 0.00 H new ATOM 0 HA VAL A 125 -18.450 9.359 -2.149 1.00 0.00 H new ATOM 0 HB VAL A 125 -19.723 10.201 -0.170 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -21.785 8.917 -0.638 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -20.902 9.279 -2.140 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -20.818 7.649 -1.429 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -20.527 8.556 1.498 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -19.555 7.287 0.717 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -18.751 8.662 1.510 1.00 0.00 H new ATOM 2044 N ALA A 126 -16.614 10.477 -0.916 1.00 0.00 N ATOM 2045 CA ALA A 126 -15.448 11.088 -0.283 1.00 0.00 C ATOM 2046 C ALA A 126 -15.873 12.189 0.685 1.00 0.00 C ATOM 2047 O ALA A 126 -16.893 12.848 0.481 1.00 0.00 O ATOM 2048 CB ALA A 126 -14.523 11.674 -1.351 1.00 0.00 C ATOM 0 H ALA A 126 -16.942 10.960 -1.753 1.00 0.00 H new ATOM 0 HA ALA A 126 -14.918 10.317 0.276 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -13.656 12.128 -0.872 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -14.193 10.881 -2.022 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -15.060 12.432 -1.922 1.00 0.00 H new ATOM 2054 N SER A 127 -15.081 12.387 1.736 1.00 0.00 N ATOM 2055 CA SER A 127 -15.379 13.415 2.728 1.00 0.00 C ATOM 2056 C SER A 127 -14.130 13.749 3.540 1.00 0.00 C ATOM 2057 O SER A 127 -13.772 13.027 4.471 1.00 0.00 O ATOM 2058 CB SER A 127 -16.487 12.932 3.664 1.00 0.00 C ATOM 2059 OG SER A 127 -16.061 11.749 4.326 1.00 0.00 O ATOM 0 H SER A 127 -14.233 11.852 1.922 1.00 0.00 H new ATOM 0 HA SER A 127 -15.712 14.313 2.208 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.725 13.706 4.394 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.398 12.738 3.098 1.00 0.00 H new ATOM 0 HG SER A 127 -15.118 11.837 4.579 1.00 0.00 H new ATOM 2065 N GLY A 128 -13.471 14.849 3.182 1.00 0.00 N ATOM 2066 CA GLY A 128 -12.260 15.273 3.883 1.00 0.00 C ATOM 2067 C GLY A 128 -11.198 15.749 2.895 1.00 0.00 C ATOM 2068 O GLY A 128 -11.434 15.787 1.688 1.00 0.00 O ATOM 0 H GLY A 128 -13.753 15.460 2.415 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -12.500 16.076 4.580 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.868 14.445 4.474 1.00 0.00 H new ATOM 2072 N ASP A 129 -10.028 16.109 3.415 1.00 0.00 N ATOM 2073 CA ASP A 129 -8.934 16.577 2.568 1.00 0.00 C ATOM 2074 C ASP A 129 -8.042 15.412 2.154 1.00 0.00 C ATOM 2075 O ASP A 129 -8.011 14.377 2.819 1.00 0.00 O ATOM 2076 CB ASP A 129 -8.102 17.620 3.318 1.00 0.00 C ATOM 2077 CG ASP A 129 -7.175 18.342 2.345 1.00 0.00 C ATOM 2078 OD1 ASP A 129 -7.393 18.222 1.151 1.00 0.00 O ATOM 2079 OD2 ASP A 129 -6.261 19.004 2.809 1.00 0.00 O ATOM 0 H ASP A 129 -9.813 16.086 4.412 1.00 0.00 H new ATOM 0 HA ASP A 129 -9.360 17.029 1.672 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -8.759 18.338 3.808 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.517 17.137 4.101 1.00 0.00 H new ATOM 2084 N CYS A 130 -7.322 15.583 1.048 1.00 0.00 N ATOM 2085 CA CYS A 130 -6.437 14.531 0.549 1.00 0.00 C ATOM 2086 C CYS A 130 -4.976 14.846 0.863 1.00 0.00 C ATOM 2087 O CYS A 130 -4.503 15.951 0.606 1.00 0.00 O ATOM 2088 CB CYS A 130 -6.614 14.379 -0.966 1.00 0.00 C ATOM 2089 SG CYS A 130 -7.994 13.257 -1.306 1.00 0.00 S ATOM 0 H CYS A 130 -7.333 16.432 0.483 1.00 0.00 H new ATOM 0 HA CYS A 130 -6.703 13.599 1.047 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -6.803 15.352 -1.420 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -5.698 13.991 -1.412 1.00 0.00 H new ATOM 2094 N ALA A 131 -4.279 13.851 1.417 1.00 0.00 N ATOM 2095 CA ALA A 131 -2.863 13.982 1.774 1.00 0.00 C ATOM 2096 C ALA A 131 -2.696 14.326 3.251 1.00 0.00 C ATOM 2097 O ALA A 131 -1.576 14.374 3.759 1.00 0.00 O ATOM 2098 CB ALA A 131 -2.172 15.049 0.918 1.00 0.00 C ATOM 0 H ALA A 131 -4.677 12.936 1.630 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.393 13.017 1.582 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -1.123 15.123 1.206 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -2.241 14.772 -0.134 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.660 16.011 1.073 1.00 0.00 H new ATOM 2104 N GLU A 132 -3.807 14.559 3.941 1.00 0.00 N ATOM 2105 CA GLU A 132 -3.745 14.887 5.360 1.00 0.00 C ATOM 2106 C GLU A 132 -3.319 13.661 6.162 1.00 0.00 C ATOM 2107 O GLU A 132 -3.565 12.525 5.755 1.00 0.00 O ATOM 2108 CB GLU A 132 -5.113 15.384 5.851 1.00 0.00 C ATOM 2109 CG GLU A 132 -5.173 16.913 5.760 1.00 0.00 C ATOM 2110 CD GLU A 132 -4.217 17.534 6.773 1.00 0.00 C ATOM 2111 OE1 GLU A 132 -3.613 16.787 7.525 1.00 0.00 O ATOM 2112 OE2 GLU A 132 -4.103 18.749 6.782 1.00 0.00 O ATOM 0 H GLU A 132 -4.748 14.528 3.548 1.00 0.00 H new ATOM 0 HA GLU A 132 -3.010 15.679 5.504 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -5.908 14.943 5.249 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -5.278 15.065 6.880 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -4.909 17.236 4.753 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -6.190 17.257 5.949 1.00 0.00 H new ATOM 2119 N ARG A 133 -2.672 13.897 7.300 1.00 0.00 N ATOM 2120 CA ARG A 133 -2.210 12.803 8.148 1.00 0.00 C ATOM 2121 C ARG A 133 -3.283 12.413 9.158 1.00 0.00 C ATOM 2122 O ARG A 133 -4.057 13.255 9.616 1.00 0.00 O ATOM 2123 CB ARG A 133 -0.939 13.223 8.891 1.00 0.00 C ATOM 2124 CG ARG A 133 0.250 13.205 7.925 1.00 0.00 C ATOM 2125 CD ARG A 133 1.414 13.997 8.527 1.00 0.00 C ATOM 2126 NE ARG A 133 1.193 15.428 8.354 1.00 0.00 N ATOM 2127 CZ ARG A 133 1.436 16.025 7.192 1.00 0.00 C ATOM 2128 NH1 ARG A 133 1.883 15.329 6.183 1.00 0.00 N ATOM 2129 NH2 ARG A 133 1.228 17.306 7.061 1.00 0.00 N ATOM 0 H ARG A 133 -2.457 14.829 7.654 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.997 11.943 7.513 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.064 14.221 9.311 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -0.753 12.547 9.725 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.558 12.178 7.731 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.040 13.637 6.967 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.513 13.763 9.587 1.00 0.00 H new ATOM 0 HD3 ARG A 133 2.348 13.705 8.047 1.00 0.00 H new ATOM 0 HE ARG A 133 0.846 15.980 9.138 1.00 0.00 H new ATOM 0 HH11 ARG A 133 2.046 14.327 6.286 1.00 0.00 H new ATOM 0 HH12 ARG A 133 2.070 15.787 5.291 1.00 0.00 H new ATOM 0 HH21 ARG A 133 0.879 17.849 7.850 1.00 0.00 H new ATOM 0 HH22 ARG A 133 1.415 17.764 6.169 1.00 0.00 H new ATOM 2143 N GLN A 134 -3.320 11.129 9.500 1.00 0.00 N ATOM 2144 CA GLN A 134 -4.298 10.623 10.459 1.00 0.00 C ATOM 2145 C GLN A 134 -3.622 9.712 11.480 1.00 0.00 C ATOM 2146 O GLN A 134 -4.047 9.637 12.634 1.00 0.00 O ATOM 2147 CB GLN A 134 -5.393 9.848 9.724 1.00 0.00 C ATOM 2148 CG GLN A 134 -5.839 10.638 8.494 1.00 0.00 C ATOM 2149 CD GLN A 134 -7.064 9.980 7.867 1.00 0.00 C ATOM 2150 OE1 GLN A 134 -8.255 10.396 8.197 1.00 0.00 O flip ATOM 2151 NE2 GLN A 134 -6.930 9.064 7.056 1.00 0.00 N flip ATOM 0 H GLN A 134 -2.686 10.421 9.129 1.00 0.00 H new ATOM 0 HA GLN A 134 -4.742 11.470 10.983 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -5.021 8.868 9.425 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -6.241 9.678 10.387 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -6.072 11.665 8.776 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -5.028 10.683 7.767 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -5.997 8.742 6.800 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -7.752 8.627 6.639 1.00 0.00 H new ATOM 2160 N TRP A 135 -2.568 9.026 11.049 1.00 0.00 N ATOM 2161 CA TRP A 135 -1.841 8.126 11.938 1.00 0.00 C ATOM 2162 C TRP A 135 -0.606 7.559 11.244 1.00 0.00 C ATOM 2163 O TRP A 135 -0.628 7.301 10.041 1.00 0.00 O ATOM 2164 CB TRP A 135 -2.748 6.973 12.375 1.00 0.00 C ATOM 2165 CG TRP A 135 -2.111 6.246 13.515 1.00 0.00 C ATOM 2166 CD1 TRP A 135 -1.522 5.031 13.429 1.00 0.00 C ATOM 2167 CD2 TRP A 135 -1.986 6.664 14.904 1.00 0.00 C ATOM 2168 NE1 TRP A 135 -1.045 4.677 14.679 1.00 0.00 N ATOM 2169 CE2 TRP A 135 -1.306 5.651 15.621 1.00 0.00 C ATOM 2170 CE3 TRP A 135 -2.394 7.813 15.605 1.00 0.00 C ATOM 2171 CZ2 TRP A 135 -1.040 5.775 16.984 1.00 0.00 C ATOM 2172 CZ3 TRP A 135 -2.127 7.941 16.978 1.00 0.00 C ATOM 2173 CH2 TRP A 135 -1.452 6.923 17.667 1.00 0.00 C ATOM 0 H TRP A 135 -2.201 9.075 10.099 1.00 0.00 H new ATOM 0 HA TRP A 135 -1.525 8.696 12.812 1.00 0.00 H new ATOM 0 HB2 TRP A 135 -3.724 7.356 12.673 1.00 0.00 H new ATOM 0 HB3 TRP A 135 -2.915 6.291 11.542 1.00 0.00 H new ATOM 0 HD1 TRP A 135 -1.438 4.435 12.532 1.00 0.00 H new ATOM 0 HE1 TRP A 135 -0.560 3.803 14.880 1.00 0.00 H new ATOM 0 HE3 TRP A 135 -2.916 8.602 15.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 -0.519 4.988 17.509 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 -2.443 8.828 17.506 1.00 0.00 H new ATOM 0 HH2 TRP A 135 -1.251 7.026 18.723 1.00 0.00 H new ATOM 2184 N ASP A 136 0.477 7.387 11.999 1.00 0.00 N ATOM 2185 CA ASP A 136 1.718 6.873 11.425 1.00 0.00 C ATOM 2186 C ASP A 136 2.321 5.763 12.282 1.00 0.00 C ATOM 2187 O ASP A 136 1.964 5.593 13.447 1.00 0.00 O ATOM 2188 CB ASP A 136 2.730 8.014 11.290 1.00 0.00 C ATOM 2189 CG ASP A 136 2.034 9.274 10.787 1.00 0.00 C ATOM 2190 OD1 ASP A 136 1.090 9.142 10.026 1.00 0.00 O ATOM 2191 OD2 ASP A 136 2.454 10.353 11.172 1.00 0.00 O ATOM 0 H ASP A 136 0.521 7.593 12.997 1.00 0.00 H new ATOM 0 HA ASP A 136 1.485 6.455 10.446 1.00 0.00 H new ATOM 0 HB2 ASP A 136 3.201 8.209 12.254 1.00 0.00 H new ATOM 0 HB3 ASP A 136 3.523 7.727 10.600 1.00 0.00 H new ATOM 2196 N PHE A 137 3.251 5.022 11.685 1.00 0.00 N ATOM 2197 CA PHE A 137 3.931 3.931 12.375 1.00 0.00 C ATOM 2198 C PHE A 137 5.384 3.869 11.911 1.00 0.00 C ATOM 2199 O PHE A 137 5.655 3.685 10.725 1.00 0.00 O ATOM 2200 CB PHE A 137 3.221 2.601 12.079 1.00 0.00 C ATOM 2201 CG PHE A 137 3.104 1.786 13.350 1.00 0.00 C ATOM 2202 CD1 PHE A 137 4.254 1.444 14.069 1.00 0.00 C ATOM 2203 CD2 PHE A 137 1.845 1.375 13.806 1.00 0.00 C ATOM 2204 CE1 PHE A 137 4.147 0.690 15.244 1.00 0.00 C ATOM 2205 CE2 PHE A 137 1.738 0.622 14.982 1.00 0.00 C ATOM 2206 CZ PHE A 137 2.890 0.280 15.700 1.00 0.00 C ATOM 0 H PHE A 137 3.552 5.159 10.720 1.00 0.00 H new ATOM 0 HA PHE A 137 3.905 4.107 13.450 1.00 0.00 H new ATOM 0 HB2 PHE A 137 2.230 2.791 11.666 1.00 0.00 H new ATOM 0 HB3 PHE A 137 3.777 2.041 11.327 1.00 0.00 H new ATOM 0 HD1 PHE A 137 5.225 1.762 13.718 1.00 0.00 H new ATOM 0 HD2 PHE A 137 0.957 1.639 13.251 1.00 0.00 H new ATOM 0 HE1 PHE A 137 5.035 0.425 15.798 1.00 0.00 H new ATOM 0 HE2 PHE A 137 0.768 0.305 15.335 1.00 0.00 H new ATOM 0 HZ PHE A 137 2.808 -0.301 16.607 1.00 0.00 H new ATOM 2216 N LEU A 138 6.316 4.068 12.837 1.00 0.00 N ATOM 2217 CA LEU A 138 7.733 4.078 12.492 1.00 0.00 C ATOM 2218 C LEU A 138 8.073 5.429 11.876 1.00 0.00 C ATOM 2219 O LEU A 138 9.106 5.585 11.225 1.00 0.00 O ATOM 2220 CB LEU A 138 8.051 2.953 11.497 1.00 0.00 C ATOM 2221 CG LEU A 138 9.450 2.384 11.776 1.00 0.00 C ATOM 2222 CD1 LEU A 138 9.368 1.329 12.883 1.00 0.00 C ATOM 2223 CD2 LEU A 138 10.001 1.737 10.501 1.00 0.00 C ATOM 0 H LEU A 138 6.118 4.224 13.825 1.00 0.00 H new ATOM 0 HA LEU A 138 8.329 3.916 13.390 1.00 0.00 H new ATOM 0 HB2 LEU A 138 7.305 2.162 11.579 1.00 0.00 H new ATOM 0 HB3 LEU A 138 8.001 3.334 10.477 1.00 0.00 H new ATOM 0 HG LEU A 138 10.110 3.192 12.093 1.00 0.00 H new ATOM 0 HD11 LEU A 138 10.363 0.928 13.078 1.00 0.00 H new ATOM 0 HD12 LEU A 138 8.976 1.785 13.792 1.00 0.00 H new ATOM 0 HD13 LEU A 138 8.707 0.522 12.568 1.00 0.00 H new ATOM 0 HD21 LEU A 138 10.994 1.333 10.698 1.00 0.00 H new ATOM 0 HD22 LEU A 138 9.337 0.932 10.186 1.00 0.00 H new ATOM 0 HD23 LEU A 138 10.064 2.486 9.711 1.00 0.00 H new ATOM 2235 N GLY A 139 7.194 6.401 12.083 1.00 0.00 N ATOM 2236 CA GLY A 139 7.407 7.735 11.540 1.00 0.00 C ATOM 2237 C GLY A 139 6.917 7.821 10.096 1.00 0.00 C ATOM 2238 O GLY A 139 7.183 8.804 9.403 1.00 0.00 O ATOM 0 H GLY A 139 6.333 6.292 12.619 1.00 0.00 H new ATOM 0 HA2 GLY A 139 6.881 8.469 12.151 1.00 0.00 H new ATOM 0 HA3 GLY A 139 8.467 7.985 11.584 1.00 0.00 H new ATOM 2242 N LEU A 140 6.198 6.791 9.644 1.00 0.00 N ATOM 2243 CA LEU A 140 5.677 6.771 8.278 1.00 0.00 C ATOM 2244 C LEU A 140 4.152 6.691 8.292 1.00 0.00 C ATOM 2245 O LEU A 140 3.566 5.951 9.081 1.00 0.00 O ATOM 2246 CB LEU A 140 6.250 5.570 7.519 1.00 0.00 C ATOM 2247 CG LEU A 140 7.702 5.857 7.113 1.00 0.00 C ATOM 2248 CD1 LEU A 140 8.431 4.536 6.858 1.00 0.00 C ATOM 2249 CD2 LEU A 140 7.732 6.703 5.833 1.00 0.00 C ATOM 0 H LEU A 140 5.966 5.967 10.199 1.00 0.00 H new ATOM 0 HA LEU A 140 5.977 7.691 7.777 1.00 0.00 H new ATOM 0 HB2 LEU A 140 6.207 4.678 8.145 1.00 0.00 H new ATOM 0 HB3 LEU A 140 5.648 5.367 6.633 1.00 0.00 H new ATOM 0 HG LEU A 140 8.194 6.403 7.918 1.00 0.00 H new ATOM 0 HD11 LEU A 140 9.462 4.739 6.570 1.00 0.00 H new ATOM 0 HD12 LEU A 140 8.420 3.933 7.766 1.00 0.00 H new ATOM 0 HD13 LEU A 140 7.930 3.993 6.056 1.00 0.00 H new ATOM 0 HD21 LEU A 140 8.766 6.902 5.552 1.00 0.00 H new ATOM 0 HD22 LEU A 140 7.235 6.162 5.028 1.00 0.00 H new ATOM 0 HD23 LEU A 140 7.216 7.647 6.009 1.00 0.00 H new ATOM 2261 N GLU A 141 3.518 7.462 7.414 1.00 0.00 N ATOM 2262 CA GLU A 141 2.062 7.476 7.334 1.00 0.00 C ATOM 2263 C GLU A 141 1.542 6.148 6.791 1.00 0.00 C ATOM 2264 O GLU A 141 2.244 5.446 6.064 1.00 0.00 O ATOM 2265 CB GLU A 141 1.601 8.625 6.431 1.00 0.00 C ATOM 2266 CG GLU A 141 2.577 9.797 6.552 1.00 0.00 C ATOM 2267 CD GLU A 141 1.981 11.041 5.903 1.00 0.00 C ATOM 2268 OE1 GLU A 141 0.878 10.946 5.389 1.00 0.00 O ATOM 2269 OE2 GLU A 141 2.634 12.071 5.929 1.00 0.00 O ATOM 0 H GLU A 141 3.986 8.081 6.752 1.00 0.00 H new ATOM 0 HA GLU A 141 1.660 7.622 8.337 1.00 0.00 H new ATOM 0 HB2 GLU A 141 1.548 8.288 5.396 1.00 0.00 H new ATOM 0 HB3 GLU A 141 0.598 8.943 6.714 1.00 0.00 H new ATOM 0 HG2 GLU A 141 2.794 9.993 7.602 1.00 0.00 H new ATOM 0 HG3 GLU A 141 3.523 9.544 6.073 1.00 0.00 H new ATOM 2276 N MET A 142 0.307 5.809 7.149 1.00 0.00 N ATOM 2277 CA MET A 142 -0.299 4.563 6.694 1.00 0.00 C ATOM 2278 C MET A 142 -0.279 4.480 5.166 1.00 0.00 C ATOM 2279 O MET A 142 0.156 3.477 4.601 1.00 0.00 O ATOM 2280 CB MET A 142 -1.743 4.462 7.217 1.00 0.00 C ATOM 2281 CG MET A 142 -1.868 3.304 8.213 1.00 0.00 C ATOM 2282 SD MET A 142 -3.399 3.485 9.162 1.00 0.00 S ATOM 2283 CE MET A 142 -4.531 3.615 7.756 1.00 0.00 C ATOM 0 H MET A 142 -0.291 6.377 7.750 1.00 0.00 H new ATOM 0 HA MET A 142 0.280 3.728 7.088 1.00 0.00 H new ATOM 0 HB2 MET A 142 -2.029 5.397 7.698 1.00 0.00 H new ATOM 0 HB3 MET A 142 -2.429 4.310 6.384 1.00 0.00 H new ATOM 0 HG2 MET A 142 -1.867 2.352 7.682 1.00 0.00 H new ATOM 0 HG3 MET A 142 -1.010 3.295 8.885 1.00 0.00 H new ATOM 0 HE1 MET A 142 -5.538 3.346 8.074 1.00 0.00 H new ATOM 0 HE2 MET A 142 -4.530 4.639 7.381 1.00 0.00 H new ATOM 0 HE3 MET A 142 -4.208 2.939 6.965 1.00 0.00 H new ATOM 2293 N PRO A 143 -0.734 5.506 4.491 1.00 0.00 N ATOM 2294 CA PRO A 143 -0.760 5.535 3.001 1.00 0.00 C ATOM 2295 C PRO A 143 0.575 5.108 2.395 1.00 0.00 C ATOM 2296 O PRO A 143 0.609 4.397 1.390 1.00 0.00 O ATOM 2297 CB PRO A 143 -1.073 6.997 2.669 1.00 0.00 C ATOM 2298 CG PRO A 143 -1.803 7.523 3.861 1.00 0.00 C ATOM 2299 CD PRO A 143 -1.276 6.748 5.071 1.00 0.00 C ATOM 0 HA PRO A 143 -1.491 4.838 2.591 1.00 0.00 H new ATOM 0 HB2 PRO A 143 -0.160 7.563 2.485 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -1.682 7.074 1.769 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.631 8.593 3.980 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -2.878 7.384 3.750 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -0.507 7.310 5.601 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.070 6.540 5.788 1.00 0.00 H new ATOM 2307 N GLN A 144 1.670 5.530 3.026 1.00 0.00 N ATOM 2308 CA GLN A 144 3.004 5.174 2.550 1.00 0.00 C ATOM 2309 C GLN A 144 3.259 3.689 2.785 1.00 0.00 C ATOM 2310 O GLN A 144 3.799 2.984 1.929 1.00 0.00 O ATOM 2311 CB GLN A 144 4.061 6.003 3.286 1.00 0.00 C ATOM 2312 CG GLN A 144 5.461 5.659 2.755 1.00 0.00 C ATOM 2313 CD GLN A 144 6.053 4.474 3.519 1.00 0.00 C ATOM 2314 OE1 GLN A 144 5.321 3.825 4.383 1.00 0.00 O flip ATOM 2315 NE2 GLN A 144 7.219 4.132 3.321 1.00 0.00 N flip ATOM 0 H GLN A 144 1.660 6.114 3.862 1.00 0.00 H new ATOM 0 HA GLN A 144 3.066 5.384 1.482 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.862 7.066 3.149 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.010 5.805 4.357 1.00 0.00 H new ATOM 0 HG2 GLN A 144 5.404 5.421 1.693 1.00 0.00 H new ATOM 0 HG3 GLN A 144 6.116 6.525 2.853 1.00 0.00 H new ATOM 0 HE21 GLN A 144 7.792 4.639 2.646 1.00 0.00 H new ATOM 0 HE22 GLN A 144 7.612 3.342 3.832 1.00 0.00 H new ATOM 2324 N TRP A 145 2.855 3.223 3.958 1.00 0.00 N ATOM 2325 CA TRP A 145 3.032 1.825 4.309 1.00 0.00 C ATOM 2326 C TRP A 145 2.293 0.934 3.315 1.00 0.00 C ATOM 2327 O TRP A 145 2.889 0.059 2.689 1.00 0.00 O ATOM 2328 CB TRP A 145 2.499 1.576 5.726 1.00 0.00 C ATOM 2329 CG TRP A 145 3.578 1.842 6.729 1.00 0.00 C ATOM 2330 CD1 TRP A 145 3.645 2.929 7.534 1.00 0.00 C ATOM 2331 CD2 TRP A 145 4.741 1.026 7.044 1.00 0.00 C ATOM 2332 NE1 TRP A 145 4.777 2.830 8.326 1.00 0.00 N ATOM 2333 CE2 TRP A 145 5.485 1.672 8.060 1.00 0.00 C ATOM 2334 CE3 TRP A 145 5.216 -0.203 6.552 1.00 0.00 C ATOM 2335 CZ2 TRP A 145 6.660 1.116 8.567 1.00 0.00 C ATOM 2336 CZ3 TRP A 145 6.398 -0.763 7.061 1.00 0.00 C ATOM 2337 CH2 TRP A 145 7.118 -0.105 8.066 1.00 0.00 C ATOM 0 H TRP A 145 2.406 3.790 4.677 1.00 0.00 H new ATOM 0 HA TRP A 145 4.094 1.584 4.275 1.00 0.00 H new ATOM 0 HB2 TRP A 145 1.642 2.221 5.920 1.00 0.00 H new ATOM 0 HB3 TRP A 145 2.151 0.547 5.818 1.00 0.00 H new ATOM 0 HD1 TRP A 145 2.932 3.740 7.555 1.00 0.00 H new ATOM 0 HE1 TRP A 145 5.054 3.525 9.019 1.00 0.00 H new ATOM 0 HE3 TRP A 145 4.668 -0.719 5.778 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 7.212 1.627 9.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 6.754 -1.707 6.675 1.00 0.00 H new ATOM 0 HH2 TRP A 145 8.027 -0.541 8.453 1.00 0.00 H new ATOM 2348 N LEU A 146 0.994 1.171 3.171 1.00 0.00 N ATOM 2349 CA LEU A 146 0.187 0.388 2.240 1.00 0.00 C ATOM 2350 C LEU A 146 0.933 0.198 0.918 1.00 0.00 C ATOM 2351 O LEU A 146 0.952 -0.901 0.365 1.00 0.00 O ATOM 2352 CB LEU A 146 -1.148 1.098 1.983 1.00 0.00 C ATOM 2353 CG LEU A 146 -1.953 0.336 0.924 1.00 0.00 C ATOM 2354 CD1 LEU A 146 -2.143 -1.121 1.362 1.00 0.00 C ATOM 2355 CD2 LEU A 146 -3.323 1.000 0.758 1.00 0.00 C ATOM 0 H LEU A 146 0.481 1.890 3.680 1.00 0.00 H new ATOM 0 HA LEU A 146 -0.003 -0.591 2.681 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -1.719 1.162 2.909 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -0.967 2.120 1.649 1.00 0.00 H new ATOM 0 HG LEU A 146 -1.414 0.357 -0.023 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -2.716 -1.657 0.605 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -1.169 -1.595 1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -2.680 -1.149 2.310 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -3.899 0.462 0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -3.856 0.977 1.709 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -3.190 2.034 0.441 1.00 0.00 H new ATOM 2367 N LEU A 147 1.569 1.263 0.427 1.00 0.00 N ATOM 2368 CA LEU A 147 2.327 1.157 -0.821 1.00 0.00 C ATOM 2369 C LEU A 147 3.373 0.058 -0.667 1.00 0.00 C ATOM 2370 O LEU A 147 3.677 -0.674 -1.609 1.00 0.00 O ATOM 2371 CB LEU A 147 3.016 2.483 -1.164 1.00 0.00 C ATOM 2372 CG LEU A 147 2.169 3.649 -0.662 1.00 0.00 C ATOM 2373 CD1 LEU A 147 2.752 4.963 -1.184 1.00 0.00 C ATOM 2374 CD2 LEU A 147 0.721 3.497 -1.152 1.00 0.00 C ATOM 0 H LEU A 147 1.576 2.186 0.861 1.00 0.00 H new ATOM 0 HA LEU A 147 1.640 0.916 -1.632 1.00 0.00 H new ATOM 0 HB2 LEU A 147 4.006 2.518 -0.709 1.00 0.00 H new ATOM 0 HB3 LEU A 147 3.158 2.562 -2.242 1.00 0.00 H new ATOM 0 HG LEU A 147 2.176 3.653 0.428 1.00 0.00 H new ATOM 0 HD11 LEU A 147 2.148 5.797 -0.826 1.00 0.00 H new ATOM 0 HD12 LEU A 147 3.775 5.075 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 147 2.749 4.955 -2.274 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.124 4.334 -0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 147 0.705 3.486 -2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 147 0.305 2.563 -0.774 1.00 0.00 H new ATOM 2386 N GLY A 148 3.909 -0.040 0.543 1.00 0.00 N ATOM 2387 CA GLY A 148 4.918 -1.053 0.834 1.00 0.00 C ATOM 2388 C GLY A 148 4.365 -2.457 0.590 1.00 0.00 C ATOM 2389 O GLY A 148 5.028 -3.306 -0.012 1.00 0.00 O ATOM 0 H GLY A 148 3.667 0.561 1.331 1.00 0.00 H new ATOM 0 HA2 GLY A 148 5.795 -0.889 0.208 1.00 0.00 H new ATOM 0 HA3 GLY A 148 5.244 -0.961 1.870 1.00 0.00 H new ATOM 2393 N ILE A 149 3.140 -2.690 1.054 1.00 0.00 N ATOM 2394 CA ILE A 149 2.503 -3.991 0.877 1.00 0.00 C ATOM 2395 C ILE A 149 2.152 -4.214 -0.590 1.00 0.00 C ATOM 2396 O ILE A 149 2.129 -5.350 -1.064 1.00 0.00 O ATOM 2397 CB ILE A 149 1.230 -4.082 1.732 1.00 0.00 C ATOM 2398 CG1 ILE A 149 1.599 -4.111 3.228 1.00 0.00 C ATOM 2399 CG2 ILE A 149 0.470 -5.362 1.372 1.00 0.00 C ATOM 2400 CD1 ILE A 149 1.481 -2.704 3.823 1.00 0.00 C ATOM 0 H ILE A 149 2.574 -2.002 1.551 1.00 0.00 H new ATOM 0 HA ILE A 149 3.203 -4.763 1.197 1.00 0.00 H new ATOM 0 HB ILE A 149 0.604 -3.211 1.536 1.00 0.00 H new ATOM 0 HG12 ILE A 149 0.940 -4.797 3.761 1.00 0.00 H new ATOM 0 HG13 ILE A 149 2.616 -4.484 3.353 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -0.434 -5.430 1.977 1.00 0.00 H new ATOM 0 HG22 ILE A 149 0.200 -5.340 0.316 1.00 0.00 H new ATOM 0 HG23 ILE A 149 1.103 -6.228 1.567 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.743 -2.733 4.881 1.00 0.00 H new ATOM 0 HD12 ILE A 149 2.158 -2.030 3.299 1.00 0.00 H new ATOM 0 HD13 ILE A 149 0.457 -2.347 3.713 1.00 0.00 H new ATOM 2412 N PHE A 150 1.881 -3.127 -1.306 1.00 0.00 N ATOM 2413 CA PHE A 150 1.535 -3.228 -2.719 1.00 0.00 C ATOM 2414 C PHE A 150 2.723 -3.766 -3.510 1.00 0.00 C ATOM 2415 O PHE A 150 2.572 -4.638 -4.366 1.00 0.00 O ATOM 2416 CB PHE A 150 1.118 -1.851 -3.259 1.00 0.00 C ATOM 2417 CG PHE A 150 -0.225 -1.956 -3.947 1.00 0.00 C ATOM 2418 CD1 PHE A 150 -0.431 -2.929 -4.933 1.00 0.00 C ATOM 2419 CD2 PHE A 150 -1.265 -1.085 -3.595 1.00 0.00 C ATOM 2420 CE1 PHE A 150 -1.674 -3.030 -5.568 1.00 0.00 C ATOM 2421 CE2 PHE A 150 -2.508 -1.188 -4.230 1.00 0.00 C ATOM 2422 CZ PHE A 150 -2.712 -2.160 -5.217 1.00 0.00 C ATOM 0 H PHE A 150 1.894 -2.177 -0.936 1.00 0.00 H new ATOM 0 HA PHE A 150 0.698 -3.917 -2.830 1.00 0.00 H new ATOM 0 HB2 PHE A 150 1.063 -1.131 -2.442 1.00 0.00 H new ATOM 0 HB3 PHE A 150 1.868 -1.482 -3.959 1.00 0.00 H new ATOM 0 HD1 PHE A 150 0.370 -3.602 -5.203 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -1.107 -0.335 -2.834 1.00 0.00 H new ATOM 0 HE1 PHE A 150 -1.832 -3.780 -6.329 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -3.310 -0.518 -3.959 1.00 0.00 H new ATOM 0 HZ PHE A 150 -3.671 -2.238 -5.708 1.00 0.00 H new ATOM 2432 N ILE A 151 3.904 -3.230 -3.219 1.00 0.00 N ATOM 2433 CA ILE A 151 5.118 -3.648 -3.907 1.00 0.00 C ATOM 2434 C ILE A 151 5.363 -5.139 -3.706 1.00 0.00 C ATOM 2435 O ILE A 151 5.776 -5.838 -4.628 1.00 0.00 O ATOM 2436 CB ILE A 151 6.314 -2.852 -3.382 1.00 0.00 C ATOM 2437 CG1 ILE A 151 6.112 -1.368 -3.697 1.00 0.00 C ATOM 2438 CG2 ILE A 151 7.597 -3.344 -4.056 1.00 0.00 C ATOM 2439 CD1 ILE A 151 7.103 -0.535 -2.883 1.00 0.00 C ATOM 0 H ILE A 151 4.045 -2.507 -2.513 1.00 0.00 H new ATOM 0 HA ILE A 151 4.995 -3.456 -4.973 1.00 0.00 H new ATOM 0 HB ILE A 151 6.396 -2.991 -2.304 1.00 0.00 H new ATOM 0 HG12 ILE A 151 6.258 -1.188 -4.762 1.00 0.00 H new ATOM 0 HG13 ILE A 151 5.090 -1.071 -3.461 1.00 0.00 H new ATOM 0 HG21 ILE A 151 8.447 -2.775 -3.680 1.00 0.00 H new ATOM 0 HG22 ILE A 151 7.742 -4.401 -3.835 1.00 0.00 H new ATOM 0 HG23 ILE A 151 7.517 -3.207 -5.134 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.960 0.522 -3.107 1.00 0.00 H new ATOM 0 HD12 ILE A 151 6.935 -0.707 -1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 151 8.121 -0.826 -3.141 1.00 0.00 H new ATOM 2451 N ALA A 152 5.107 -5.621 -2.497 1.00 0.00 N ATOM 2452 CA ALA A 152 5.309 -7.035 -2.197 1.00 0.00 C ATOM 2453 C ALA A 152 4.273 -7.899 -2.918 1.00 0.00 C ATOM 2454 O ALA A 152 4.615 -8.916 -3.519 1.00 0.00 O ATOM 2455 CB ALA A 152 5.204 -7.270 -0.689 1.00 0.00 C ATOM 0 H ALA A 152 4.763 -5.063 -1.716 1.00 0.00 H new ATOM 0 HA ALA A 152 6.303 -7.316 -2.544 1.00 0.00 H new ATOM 0 HB1 ALA A 152 5.356 -8.328 -0.474 1.00 0.00 H new ATOM 0 HB2 ALA A 152 5.965 -6.682 -0.175 1.00 0.00 H new ATOM 0 HB3 ALA A 152 4.216 -6.968 -0.342 1.00 0.00 H new ATOM 2461 N TYR A 153 3.009 -7.497 -2.835 1.00 0.00 N ATOM 2462 CA TYR A 153 1.923 -8.254 -3.463 1.00 0.00 C ATOM 2463 C TYR A 153 2.190 -8.524 -4.947 1.00 0.00 C ATOM 2464 O TYR A 153 1.935 -9.625 -5.439 1.00 0.00 O ATOM 2465 CB TYR A 153 0.603 -7.485 -3.309 1.00 0.00 C ATOM 2466 CG TYR A 153 -0.083 -7.901 -2.028 1.00 0.00 C ATOM 2467 CD1 TYR A 153 0.650 -7.992 -0.838 1.00 0.00 C ATOM 2468 CD2 TYR A 153 -1.451 -8.200 -2.031 1.00 0.00 C ATOM 2469 CE1 TYR A 153 0.016 -8.380 0.348 1.00 0.00 C ATOM 2470 CE2 TYR A 153 -2.085 -8.588 -0.844 1.00 0.00 C ATOM 2471 CZ TYR A 153 -1.352 -8.678 0.344 1.00 0.00 C ATOM 2472 OH TYR A 153 -1.976 -9.061 1.515 1.00 0.00 O ATOM 0 H TYR A 153 2.708 -6.656 -2.342 1.00 0.00 H new ATOM 0 HA TYR A 153 1.859 -9.218 -2.959 1.00 0.00 H new ATOM 0 HB2 TYR A 153 0.795 -6.412 -3.298 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -0.046 -7.684 -4.162 1.00 0.00 H new ATOM 0 HD1 TYR A 153 1.705 -7.763 -0.836 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -2.017 -8.131 -2.948 1.00 0.00 H new ATOM 0 HE1 TYR A 153 0.582 -8.449 1.265 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -3.140 -8.818 -0.846 1.00 0.00 H new ATOM 0 HH TYR A 153 -2.558 -9.830 1.339 1.00 0.00 H new ATOM 2482 N LEU A 154 2.682 -7.520 -5.664 1.00 0.00 N ATOM 2483 CA LEU A 154 2.947 -7.680 -7.093 1.00 0.00 C ATOM 2484 C LEU A 154 4.207 -8.511 -7.333 1.00 0.00 C ATOM 2485 O LEU A 154 4.327 -9.190 -8.353 1.00 0.00 O ATOM 2486 CB LEU A 154 3.072 -6.302 -7.763 1.00 0.00 C ATOM 2487 CG LEU A 154 4.517 -5.784 -7.668 1.00 0.00 C ATOM 2488 CD1 LEU A 154 5.367 -6.353 -8.820 1.00 0.00 C ATOM 2489 CD2 LEU A 154 4.513 -4.252 -7.744 1.00 0.00 C ATOM 0 H LEU A 154 2.904 -6.598 -5.288 1.00 0.00 H new ATOM 0 HA LEU A 154 2.108 -8.215 -7.538 1.00 0.00 H new ATOM 0 HB2 LEU A 154 2.773 -6.371 -8.809 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.394 -5.596 -7.284 1.00 0.00 H new ATOM 0 HG LEU A 154 4.948 -6.107 -6.720 1.00 0.00 H new ATOM 0 HD11 LEU A 154 6.387 -5.977 -8.739 1.00 0.00 H new ATOM 0 HD12 LEU A 154 5.375 -7.441 -8.763 1.00 0.00 H new ATOM 0 HD13 LEU A 154 4.941 -6.043 -9.774 1.00 0.00 H new ATOM 0 HD21 LEU A 154 5.536 -3.882 -7.677 1.00 0.00 H new ATOM 0 HD22 LEU A 154 4.074 -3.936 -8.690 1.00 0.00 H new ATOM 0 HD23 LEU A 154 3.926 -3.848 -6.919 1.00 0.00 H new ATOM 2501 N ILE A 155 5.146 -8.442 -6.398 1.00 0.00 N ATOM 2502 CA ILE A 155 6.400 -9.181 -6.528 1.00 0.00 C ATOM 2503 C ILE A 155 6.180 -10.684 -6.355 1.00 0.00 C ATOM 2504 O ILE A 155 6.896 -11.492 -6.946 1.00 0.00 O ATOM 2505 CB ILE A 155 7.408 -8.681 -5.487 1.00 0.00 C ATOM 2506 CG1 ILE A 155 7.961 -7.324 -5.930 1.00 0.00 C ATOM 2507 CG2 ILE A 155 8.564 -9.678 -5.356 1.00 0.00 C ATOM 2508 CD1 ILE A 155 8.635 -6.638 -4.743 1.00 0.00 C ATOM 0 H ILE A 155 5.067 -7.887 -5.546 1.00 0.00 H new ATOM 0 HA ILE A 155 6.792 -9.009 -7.530 1.00 0.00 H new ATOM 0 HB ILE A 155 6.908 -8.582 -4.523 1.00 0.00 H new ATOM 0 HG12 ILE A 155 8.677 -7.458 -6.741 1.00 0.00 H new ATOM 0 HG13 ILE A 155 7.155 -6.699 -6.316 1.00 0.00 H new ATOM 0 HG21 ILE A 155 9.275 -9.315 -4.614 1.00 0.00 H new ATOM 0 HG22 ILE A 155 8.175 -10.647 -5.042 1.00 0.00 H new ATOM 0 HG23 ILE A 155 9.065 -9.783 -6.318 1.00 0.00 H new ATOM 0 HD11 ILE A 155 9.029 -5.672 -5.057 1.00 0.00 H new ATOM 0 HD12 ILE A 155 7.906 -6.491 -3.946 1.00 0.00 H new ATOM 0 HD13 ILE A 155 9.451 -7.261 -4.378 1.00 0.00 H new ATOM 2520 N VAL A 156 5.198 -11.059 -5.541 1.00 0.00 N ATOM 2521 CA VAL A 156 4.924 -12.475 -5.311 1.00 0.00 C ATOM 2522 C VAL A 156 4.149 -13.072 -6.481 1.00 0.00 C ATOM 2523 O VAL A 156 4.394 -14.209 -6.879 1.00 0.00 O ATOM 2524 CB VAL A 156 4.137 -12.672 -4.011 1.00 0.00 C ATOM 2525 CG1 VAL A 156 5.039 -12.356 -2.817 1.00 0.00 C ATOM 2526 CG2 VAL A 156 2.925 -11.739 -3.988 1.00 0.00 C ATOM 0 H VAL A 156 4.588 -10.416 -5.037 1.00 0.00 H new ATOM 0 HA VAL A 156 5.880 -12.990 -5.224 1.00 0.00 H new ATOM 0 HB VAL A 156 3.797 -13.706 -3.953 1.00 0.00 H new ATOM 0 HG11 VAL A 156 4.480 -12.496 -1.892 1.00 0.00 H new ATOM 0 HG12 VAL A 156 5.900 -13.024 -2.825 1.00 0.00 H new ATOM 0 HG13 VAL A 156 5.380 -11.323 -2.882 1.00 0.00 H new ATOM 0 HG21 VAL A 156 2.371 -11.885 -3.061 1.00 0.00 H new ATOM 0 HG22 VAL A 156 3.261 -10.704 -4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 156 2.278 -11.962 -4.836 1.00 0.00 H new ATOM 2536 N ALA A 157 3.214 -12.303 -7.030 1.00 0.00 N ATOM 2537 CA ALA A 157 2.420 -12.784 -8.155 1.00 0.00 C ATOM 2538 C ALA A 157 3.306 -13.049 -9.368 1.00 0.00 C ATOM 2539 O ALA A 157 3.292 -14.141 -9.932 1.00 0.00 O ATOM 2540 CB ALA A 157 1.356 -11.753 -8.519 1.00 0.00 C ATOM 0 H ALA A 157 2.990 -11.358 -6.720 1.00 0.00 H new ATOM 0 HA ALA A 157 1.940 -13.717 -7.860 1.00 0.00 H new ATOM 0 HB1 ALA A 157 0.767 -12.119 -9.360 1.00 0.00 H new ATOM 0 HB2 ALA A 157 0.702 -11.587 -7.663 1.00 0.00 H new ATOM 0 HB3 ALA A 157 1.838 -10.815 -8.795 1.00 0.00 H new ATOM 2546 N VAL A 158 4.073 -12.039 -9.765 1.00 0.00 N ATOM 2547 CA VAL A 158 4.957 -12.171 -10.918 1.00 0.00 C ATOM 2548 C VAL A 158 5.903 -13.357 -10.746 1.00 0.00 C ATOM 2549 O VAL A 158 6.100 -14.142 -11.673 1.00 0.00 O ATOM 2550 CB VAL A 158 5.770 -10.890 -11.104 1.00 0.00 C ATOM 2551 CG1 VAL A 158 6.600 -10.620 -9.847 1.00 0.00 C ATOM 2552 CG2 VAL A 158 6.702 -11.050 -12.306 1.00 0.00 C ATOM 0 H VAL A 158 4.101 -11.127 -9.310 1.00 0.00 H new ATOM 0 HA VAL A 158 4.341 -12.342 -11.801 1.00 0.00 H new ATOM 0 HB VAL A 158 5.093 -10.053 -11.276 1.00 0.00 H new ATOM 0 HG11 VAL A 158 7.179 -9.706 -9.982 1.00 0.00 H new ATOM 0 HG12 VAL A 158 5.936 -10.505 -8.990 1.00 0.00 H new ATOM 0 HG13 VAL A 158 7.277 -11.456 -9.672 1.00 0.00 H new ATOM 0 HG21 VAL A 158 7.283 -10.137 -12.440 1.00 0.00 H new ATOM 0 HG22 VAL A 158 7.378 -11.888 -12.134 1.00 0.00 H new ATOM 0 HG23 VAL A 158 6.111 -11.239 -13.202 1.00 0.00 H new ATOM 2562 N LEU A 159 6.489 -13.480 -9.559 1.00 0.00 N ATOM 2563 CA LEU A 159 7.417 -14.573 -9.288 1.00 0.00 C ATOM 2564 C LEU A 159 6.708 -15.921 -9.382 1.00 0.00 C ATOM 2565 O LEU A 159 7.277 -16.900 -9.865 1.00 0.00 O ATOM 2566 CB LEU A 159 8.027 -14.409 -7.891 1.00 0.00 C ATOM 2567 CG LEU A 159 9.339 -15.204 -7.797 1.00 0.00 C ATOM 2568 CD1 LEU A 159 10.502 -14.349 -8.310 1.00 0.00 C ATOM 2569 CD2 LEU A 159 9.601 -15.588 -6.338 1.00 0.00 C ATOM 0 H LEU A 159 6.340 -12.843 -8.776 1.00 0.00 H new ATOM 0 HA LEU A 159 8.209 -14.542 -10.036 1.00 0.00 H new ATOM 0 HB2 LEU A 159 8.215 -13.355 -7.688 1.00 0.00 H new ATOM 0 HB3 LEU A 159 7.325 -14.759 -7.134 1.00 0.00 H new ATOM 0 HG LEU A 159 9.255 -16.105 -8.405 1.00 0.00 H new ATOM 0 HD11 LEU A 159 11.430 -14.917 -8.241 1.00 0.00 H new ATOM 0 HD12 LEU A 159 10.321 -14.074 -9.349 1.00 0.00 H new ATOM 0 HD13 LEU A 159 10.584 -13.446 -7.705 1.00 0.00 H new ATOM 0 HD21 LEU A 159 10.531 -16.152 -6.272 1.00 0.00 H new ATOM 0 HD22 LEU A 159 9.680 -14.685 -5.733 1.00 0.00 H new ATOM 0 HD23 LEU A 159 8.778 -16.201 -5.970 1.00 0.00 H new ATOM 2581 N VAL A 160 5.465 -15.965 -8.917 1.00 0.00 N ATOM 2582 CA VAL A 160 4.690 -17.200 -8.952 1.00 0.00 C ATOM 2583 C VAL A 160 4.285 -17.538 -10.384 1.00 0.00 C ATOM 2584 O VAL A 160 4.153 -18.707 -10.742 1.00 0.00 O ATOM 2585 CB VAL A 160 3.440 -17.057 -8.077 1.00 0.00 C ATOM 2586 CG1 VAL A 160 2.487 -18.226 -8.341 1.00 0.00 C ATOM 2587 CG2 VAL A 160 3.851 -17.062 -6.601 1.00 0.00 C ATOM 0 H VAL A 160 4.975 -15.166 -8.514 1.00 0.00 H new ATOM 0 HA VAL A 160 5.309 -18.009 -8.565 1.00 0.00 H new ATOM 0 HB VAL A 160 2.937 -16.120 -8.317 1.00 0.00 H new ATOM 0 HG11 VAL A 160 1.600 -18.120 -7.717 1.00 0.00 H new ATOM 0 HG12 VAL A 160 2.194 -18.227 -9.391 1.00 0.00 H new ATOM 0 HG13 VAL A 160 2.988 -19.165 -8.104 1.00 0.00 H new ATOM 0 HG21 VAL A 160 2.964 -16.960 -5.976 1.00 0.00 H new ATOM 0 HG22 VAL A 160 4.355 -18.000 -6.367 1.00 0.00 H new ATOM 0 HG23 VAL A 160 4.527 -16.229 -6.409 1.00 0.00 H new ATOM 2597 N VAL A 161 4.097 -16.506 -11.201 1.00 0.00 N ATOM 2598 CA VAL A 161 3.717 -16.710 -12.594 1.00 0.00 C ATOM 2599 C VAL A 161 4.885 -17.310 -13.371 1.00 0.00 C ATOM 2600 O VAL A 161 4.730 -18.307 -14.075 1.00 0.00 O ATOM 2601 CB VAL A 161 3.303 -15.377 -13.223 1.00 0.00 C ATOM 2602 CG1 VAL A 161 3.144 -15.549 -14.737 1.00 0.00 C ATOM 2603 CG2 VAL A 161 1.971 -14.919 -12.621 1.00 0.00 C ATOM 0 H VAL A 161 4.200 -15.529 -10.926 1.00 0.00 H new ATOM 0 HA VAL A 161 2.873 -17.399 -12.633 1.00 0.00 H new ATOM 0 HB VAL A 161 4.071 -14.630 -13.022 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.849 -14.599 -15.182 1.00 0.00 H new ATOM 0 HG12 VAL A 161 4.091 -15.873 -15.168 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.378 -16.298 -14.940 1.00 0.00 H new ATOM 0 HG21 VAL A 161 1.676 -13.970 -13.069 1.00 0.00 H new ATOM 0 HG22 VAL A 161 1.205 -15.668 -12.821 1.00 0.00 H new ATOM 0 HG23 VAL A 161 2.083 -14.793 -11.544 1.00 0.00 H new ATOM 2613 N ILE A 162 6.054 -16.691 -13.236 1.00 0.00 N ATOM 2614 CA ILE A 162 7.247 -17.166 -13.926 1.00 0.00 C ATOM 2615 C ILE A 162 7.552 -18.610 -13.538 1.00 0.00 C ATOM 2616 O ILE A 162 8.092 -19.376 -14.336 1.00 0.00 O ATOM 2617 CB ILE A 162 8.444 -16.278 -13.576 1.00 0.00 C ATOM 2618 CG1 ILE A 162 8.154 -14.837 -14.009 1.00 0.00 C ATOM 2619 CG2 ILE A 162 9.691 -16.787 -14.301 1.00 0.00 C ATOM 2620 CD1 ILE A 162 9.120 -13.884 -13.302 1.00 0.00 C ATOM 0 H ILE A 162 6.200 -15.863 -12.658 1.00 0.00 H new ATOM 0 HA ILE A 162 7.064 -17.121 -15.000 1.00 0.00 H new ATOM 0 HB ILE A 162 8.614 -16.308 -12.500 1.00 0.00 H new ATOM 0 HG12 ILE A 162 8.260 -14.743 -15.090 1.00 0.00 H new ATOM 0 HG13 ILE A 162 7.125 -14.574 -13.766 1.00 0.00 H new ATOM 0 HG21 ILE A 162 10.542 -16.153 -14.050 1.00 0.00 H new ATOM 0 HG22 ILE A 162 9.898 -17.812 -13.993 1.00 0.00 H new ATOM 0 HG23 ILE A 162 9.523 -16.759 -15.378 1.00 0.00 H new ATOM 0 HD11 ILE A 162 8.912 -12.860 -13.611 1.00 0.00 H new ATOM 0 HD12 ILE A 162 8.992 -13.970 -12.223 1.00 0.00 H new ATOM 0 HD13 ILE A 162 10.145 -14.142 -13.567 1.00 0.00 H new ATOM 2632 N SER A 163 7.201 -18.974 -12.309 1.00 0.00 N ATOM 2633 CA SER A 163 7.442 -20.330 -11.828 1.00 0.00 C ATOM 2634 C SER A 163 6.853 -21.350 -12.796 1.00 0.00 C ATOM 2635 O SER A 163 7.225 -22.524 -12.781 1.00 0.00 O ATOM 2636 CB SER A 163 6.813 -20.513 -10.446 1.00 0.00 C ATOM 2637 OG SER A 163 7.330 -19.527 -9.561 1.00 0.00 O ATOM 0 H SER A 163 6.753 -18.356 -11.633 1.00 0.00 H new ATOM 0 HA SER A 163 8.518 -20.487 -11.760 1.00 0.00 H new ATOM 0 HB2 SER A 163 5.729 -20.426 -10.513 1.00 0.00 H new ATOM 0 HB3 SER A 163 7.030 -21.511 -10.064 1.00 0.00 H new ATOM 0 HG SER A 163 6.968 -18.649 -9.802 1.00 0.00 H new