USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 957 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 MET CE :methyl -109:sc= -2.65! (180deg=-4.69!) USER MOD Set 1.2: A 145 MET CE :methyl -154:sc= -5.99! (180deg=-8.63!) USER MOD Set 2.1: A 26 THR OG1 : rot -150:sc= 1.03 USER MOD Set 2.2: A 62 THR OG1 : rot 145:sc= 1.23 USER MOD Set 3.1: A 36 MET CE :methyl 140:sc= -1.79 (180deg=-5.09!) USER MOD Set 3.2: A 72 MET CE :methyl 152:sc= -0.386 (180deg=-0.563) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 109:sc= 0.258 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.311 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.00515 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot -170:sc= -0.118 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc= -0.0237 X(o=-0.024,f=-0.0092) USER MOD Single : A 44 THR OG1 : rot -159:sc= 1.26 USER MOD Single : A 49 GLN : amide:sc= -0.115 X(o=-0.12,f=0) USER MOD Single : A 51 MET CE :methyl -173:sc= -0.661 (180deg=-0.805) USER MOD Single : A 53 ASN : amide:sc= -0.0947 X(o=-0.095,f=-0.0042) USER MOD Single : A 70 THR OG1 : rot 1:sc= 0.905 USER MOD Single : A 71 MET CE :methyl -171:sc= -1.56 (180deg=-1.64) USER MOD Single : A 81 SER OG : rot 180:sc= -0.0272 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -2.02! C(o=-2!,f=-2.8!) USER MOD Single : A 99 TYR OH : rot 30:sc= -0.086 USER MOD Single : A 101 SER OG : rot -96:sc= 1.05 USER MOD Single : A 107 HIS : no HD1:sc=-0.00348 X(o=-0.0035,f=0) USER MOD Single : A 110 THR OG1 : rot 122:sc= 0.807 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -110:sc= -5.47! (180deg=-8.96!) USER MOD Single : A 135 GLN : amide:sc= -1.96! C(o=-2!,f=-6.7!) USER MOD Single : A 137 ASN : amide:sc= -0.681 K(o=-0.68,f=-1.7) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 MET CE :methyl -146:sc= -0.671 (180deg=-4.92!) USER MOD Single : A 146 THR OG1 : rot 73:sc= 1.24 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N GLU A 7 9.554 13.168 -6.053 1.00 3.51 N ATOM 91 CA GLU A 7 8.938 14.015 -7.079 1.00 3.59 C ATOM 92 C GLU A 7 7.416 14.086 -6.981 1.00 3.35 C ATOM 93 O GLU A 7 6.833 15.108 -7.351 1.00 3.38 O ATOM 94 CB GLU A 7 9.352 13.558 -8.482 1.00 3.93 C ATOM 95 CG GLU A 7 10.794 13.890 -8.837 1.00 4.45 C ATOM 96 CD GLU A 7 11.171 13.430 -10.232 1.00 5.14 C ATOM 97 OE1 GLU A 7 10.990 14.217 -11.185 1.00 5.54 O ATOM 98 OE2 GLU A 7 11.648 12.284 -10.371 1.00 5.58 O ATOM 0 HA GLU A 7 9.310 15.023 -6.895 1.00 3.59 H new ATOM 0 HB2 GLU A 7 9.208 12.480 -8.560 1.00 3.93 H new ATOM 0 HB3 GLU A 7 8.692 14.022 -9.214 1.00 3.93 H new ATOM 0 HG2 GLU A 7 10.945 14.967 -8.760 1.00 4.45 H new ATOM 0 HG3 GLU A 7 11.460 13.422 -8.112 1.00 4.45 H new ATOM 105 N GLN A 8 6.761 13.012 -6.506 1.00 3.16 N ATOM 106 CA GLN A 8 5.304 13.034 -6.345 1.00 2.96 C ATOM 107 C GLN A 8 4.929 14.072 -5.315 1.00 2.69 C ATOM 108 O GLN A 8 3.917 14.758 -5.449 1.00 2.63 O ATOM 109 CB GLN A 8 4.744 11.651 -5.985 1.00 2.87 C ATOM 110 CG GLN A 8 4.141 10.896 -7.168 1.00 3.23 C ATOM 111 CD GLN A 8 5.183 10.226 -8.046 1.00 3.13 C ATOM 112 OE1 GLN A 8 5.514 9.057 -7.853 1.00 3.27 O ATOM 113 NE2 GLN A 8 5.705 10.967 -9.017 1.00 3.29 N ATOM 0 H GLN A 8 7.209 12.137 -6.233 1.00 3.16 H new ATOM 0 HA GLN A 8 4.854 13.304 -7.300 1.00 2.96 H new ATOM 0 HB2 GLN A 8 5.543 11.049 -5.552 1.00 2.87 H new ATOM 0 HB3 GLN A 8 3.981 11.769 -5.216 1.00 2.87 H new ATOM 0 HG2 GLN A 8 3.451 10.140 -6.794 1.00 3.23 H new ATOM 0 HG3 GLN A 8 3.557 11.589 -7.773 1.00 3.23 H new ATOM 0 HE21 GLN A 8 5.401 11.933 -9.141 1.00 3.29 H new ATOM 0 HE22 GLN A 8 6.410 10.570 -9.639 1.00 3.29 H new ATOM 122 N ILE A 9 5.764 14.164 -4.288 1.00 2.59 N ATOM 123 CA ILE A 9 5.650 15.181 -3.270 1.00 2.41 C ATOM 124 C ILE A 9 5.767 16.549 -3.941 1.00 2.64 C ATOM 125 O ILE A 9 5.004 17.463 -3.629 1.00 2.55 O ATOM 126 CB ILE A 9 6.743 14.956 -2.206 1.00 2.42 C ATOM 127 CG1 ILE A 9 6.299 13.812 -1.296 1.00 2.20 C ATOM 128 CG2 ILE A 9 7.071 16.227 -1.431 1.00 2.45 C ATOM 129 CD1 ILE A 9 6.776 12.459 -1.771 1.00 2.35 C ATOM 0 H ILE A 9 6.545 13.524 -4.144 1.00 2.59 H new ATOM 0 HA ILE A 9 4.686 15.131 -2.763 1.00 2.41 H new ATOM 0 HB ILE A 9 7.676 14.681 -2.698 1.00 2.42 H new ATOM 0 HG12 ILE A 9 6.675 13.990 -0.288 1.00 2.20 H new ATOM 0 HG13 ILE A 9 5.211 13.806 -1.234 1.00 2.20 H new ATOM 0 HG21 ILE A 9 7.846 16.014 -0.695 1.00 2.45 H new ATOM 0 HG22 ILE A 9 7.426 16.992 -2.121 1.00 2.45 H new ATOM 0 HG23 ILE A 9 6.176 16.584 -0.922 1.00 2.45 H new ATOM 0 HD11 ILE A 9 6.428 11.688 -1.083 1.00 2.35 H new ATOM 0 HD12 ILE A 9 6.379 12.262 -2.767 1.00 2.35 H new ATOM 0 HD13 ILE A 9 7.865 12.449 -1.806 1.00 2.35 H new ATOM 141 N ALA A 10 6.738 16.664 -4.876 1.00 2.97 N ATOM 142 CA ALA A 10 6.913 17.882 -5.676 1.00 3.26 C ATOM 143 C ALA A 10 5.630 18.213 -6.431 1.00 3.27 C ATOM 144 O ALA A 10 5.364 19.379 -6.738 1.00 3.43 O ATOM 145 CB ALA A 10 8.092 17.749 -6.629 1.00 3.61 C ATOM 0 H ALA A 10 7.408 15.925 -5.089 1.00 2.97 H new ATOM 0 HA ALA A 10 7.132 18.707 -4.997 1.00 3.26 H new ATOM 0 HB1 ALA A 10 8.197 18.666 -7.208 1.00 3.61 H new ATOM 0 HB2 ALA A 10 9.004 17.574 -6.058 1.00 3.61 H new ATOM 0 HB3 ALA A 10 7.921 16.911 -7.305 1.00 3.61 H new ATOM 151 N GLU A 11 4.842 17.167 -6.725 1.00 3.14 N ATOM 152 CA GLU A 11 3.539 17.335 -7.366 1.00 3.18 C ATOM 153 C GLU A 11 2.493 17.655 -6.317 1.00 2.87 C ATOM 154 O GLU A 11 1.515 18.360 -6.582 1.00 2.94 O ATOM 155 CB GLU A 11 3.128 16.069 -8.098 1.00 3.24 C ATOM 156 CG GLU A 11 3.284 16.148 -9.608 1.00 3.63 C ATOM 157 CD GLU A 11 2.868 14.868 -10.306 1.00 3.78 C ATOM 158 OE1 GLU A 11 1.677 14.745 -10.661 1.00 4.13 O ATOM 159 OE2 GLU A 11 3.734 13.989 -10.498 1.00 3.90 O ATOM 0 H GLU A 11 5.089 16.197 -6.527 1.00 3.14 H new ATOM 0 HA GLU A 11 3.616 18.151 -8.084 1.00 3.18 H new ATOM 0 HB2 GLU A 11 3.724 15.236 -7.725 1.00 3.24 H new ATOM 0 HB3 GLU A 11 2.087 15.847 -7.862 1.00 3.24 H new ATOM 0 HG2 GLU A 11 2.685 16.976 -9.988 1.00 3.63 H new ATOM 0 HG3 GLU A 11 4.323 16.368 -9.851 1.00 3.63 H new ATOM 166 N PHE A 12 2.728 17.117 -5.120 1.00 2.56 N ATOM 167 CA PHE A 12 1.847 17.323 -3.977 1.00 2.24 C ATOM 168 C PHE A 12 1.912 18.769 -3.466 1.00 2.30 C ATOM 169 O PHE A 12 0.882 19.326 -3.076 1.00 2.22 O ATOM 170 CB PHE A 12 2.200 16.344 -2.847 1.00 1.94 C ATOM 171 CG PHE A 12 1.785 14.897 -3.081 1.00 1.85 C ATOM 172 CD1 PHE A 12 1.924 13.957 -2.064 1.00 2.28 C ATOM 173 CD2 PHE A 12 1.230 14.474 -4.289 1.00 2.07 C ATOM 174 CE1 PHE A 12 1.519 12.647 -2.244 1.00 2.34 C ATOM 175 CE2 PHE A 12 0.839 13.167 -4.463 1.00 2.03 C ATOM 176 CZ PHE A 12 0.974 12.257 -3.455 1.00 1.90 C ATOM 0 H PHE A 12 3.535 16.527 -4.919 1.00 2.56 H new ATOM 0 HA PHE A 12 0.826 17.133 -4.308 1.00 2.24 H new ATOM 0 HB2 PHE A 12 3.278 16.374 -2.687 1.00 1.94 H new ATOM 0 HB3 PHE A 12 1.732 16.694 -1.927 1.00 1.94 H new ATOM 0 HD1 PHE A 12 2.355 14.255 -1.120 1.00 2.28 H new ATOM 0 HD2 PHE A 12 1.106 15.181 -5.096 1.00 2.07 H new ATOM 0 HE1 PHE A 12 1.628 11.931 -1.443 1.00 2.34 H new ATOM 0 HE2 PHE A 12 0.420 12.857 -5.409 1.00 2.03 H new ATOM 0 HZ PHE A 12 0.656 11.235 -3.602 1.00 1.90 H new ATOM 186 N LYS A 13 3.124 19.380 -3.467 1.00 2.51 N ATOM 187 CA LYS A 13 3.278 20.774 -3.006 1.00 2.67 C ATOM 188 C LYS A 13 2.812 21.773 -4.059 1.00 2.96 C ATOM 189 O LYS A 13 2.530 22.925 -3.731 1.00 3.07 O ATOM 190 CB LYS A 13 4.710 21.107 -2.545 1.00 2.86 C ATOM 191 CG LYS A 13 5.838 20.472 -3.365 1.00 3.04 C ATOM 192 CD LYS A 13 6.743 19.592 -2.499 1.00 2.93 C ATOM 193 CE LYS A 13 7.729 20.408 -1.663 1.00 3.15 C ATOM 194 NZ LYS A 13 8.604 19.537 -0.830 1.00 3.58 N ATOM 0 H LYS A 13 3.989 18.936 -3.776 1.00 2.51 H new ATOM 0 HA LYS A 13 2.633 20.864 -2.132 1.00 2.67 H new ATOM 0 HB2 LYS A 13 4.836 22.190 -2.566 1.00 2.86 H new ATOM 0 HB3 LYS A 13 4.820 20.793 -1.507 1.00 2.86 H new ATOM 0 HG2 LYS A 13 5.410 19.873 -4.169 1.00 3.04 H new ATOM 0 HG3 LYS A 13 6.433 21.256 -3.833 1.00 3.04 H new ATOM 0 HD2 LYS A 13 6.127 18.984 -1.837 1.00 2.93 H new ATOM 0 HD3 LYS A 13 7.296 18.905 -3.139 1.00 2.93 H new ATOM 0 HE2 LYS A 13 8.346 21.018 -2.322 1.00 3.15 H new ATOM 0 HE3 LYS A 13 7.178 21.093 -1.018 1.00 3.15 H new ATOM 0 HZ1 LYS A 13 9.258 20.128 -0.278 1.00 3.58 H new ATOM 0 HZ2 LYS A 13 8.017 18.973 -0.183 1.00 3.58 H new ATOM 0 HZ3 LYS A 13 9.149 18.901 -1.447 1.00 3.58 H new ATOM 208 N GLU A 14 2.740 21.335 -5.325 1.00 3.12 N ATOM 209 CA GLU A 14 2.251 22.198 -6.404 1.00 3.43 C ATOM 210 C GLU A 14 0.730 22.369 -6.291 1.00 3.34 C ATOM 211 O GLU A 14 0.181 23.407 -6.672 1.00 3.56 O ATOM 212 CB GLU A 14 2.613 21.613 -7.773 1.00 3.67 C ATOM 213 CG GLU A 14 4.078 21.781 -8.146 1.00 4.07 C ATOM 214 CD GLU A 14 4.405 21.194 -9.504 1.00 4.36 C ATOM 215 OE1 GLU A 14 4.311 21.931 -10.508 1.00 4.71 O ATOM 216 OE2 GLU A 14 4.757 19.997 -9.565 1.00 4.52 O ATOM 0 H GLU A 14 3.012 20.398 -5.622 1.00 3.12 H new ATOM 0 HA GLU A 14 2.729 23.173 -6.309 1.00 3.43 H new ATOM 0 HB2 GLU A 14 2.365 20.552 -7.781 1.00 3.67 H new ATOM 0 HB3 GLU A 14 1.997 22.090 -8.535 1.00 3.67 H new ATOM 0 HG2 GLU A 14 4.331 22.841 -8.142 1.00 4.07 H new ATOM 0 HG3 GLU A 14 4.699 21.303 -7.389 1.00 4.07 H new ATOM 223 N ALA A 15 0.070 21.327 -5.759 1.00 3.04 N ATOM 224 CA ALA A 15 -1.382 21.316 -5.574 1.00 2.97 C ATOM 225 C ALA A 15 -1.819 21.897 -4.231 1.00 2.76 C ATOM 226 O ALA A 15 -2.554 22.881 -4.197 1.00 2.91 O ATOM 227 CB ALA A 15 -1.923 19.892 -5.740 1.00 2.84 C ATOM 0 H ALA A 15 0.531 20.472 -5.447 1.00 3.04 H new ATOM 0 HA ALA A 15 -1.803 21.962 -6.344 1.00 2.97 H new ATOM 0 HB1 ALA A 15 -3.004 19.895 -5.600 1.00 2.84 H new ATOM 0 HB2 ALA A 15 -1.687 19.527 -6.740 1.00 2.84 H new ATOM 0 HB3 ALA A 15 -1.463 19.239 -4.998 1.00 2.84 H new ATOM 233 N PHE A 16 -1.376 21.276 -3.126 1.00 2.45 N ATOM 234 CA PHE A 16 -1.724 21.720 -1.764 1.00 2.28 C ATOM 235 C PHE A 16 -1.541 23.229 -1.608 1.00 2.56 C ATOM 236 O PHE A 16 -2.388 23.915 -1.038 1.00 2.60 O ATOM 237 CB PHE A 16 -0.838 20.984 -0.751 1.00 2.02 C ATOM 238 CG PHE A 16 -1.208 21.149 0.711 1.00 1.86 C ATOM 239 CD1 PHE A 16 -1.086 22.378 1.356 1.00 2.18 C ATOM 240 CD2 PHE A 16 -1.636 20.053 1.447 1.00 2.17 C ATOM 241 CE1 PHE A 16 -1.392 22.497 2.699 1.00 2.21 C ATOM 242 CE2 PHE A 16 -1.945 20.172 2.780 1.00 2.07 C ATOM 243 CZ PHE A 16 -1.825 21.389 3.406 1.00 1.79 C ATOM 0 H PHE A 16 -0.770 20.456 -3.149 1.00 2.45 H new ATOM 0 HA PHE A 16 -2.773 21.488 -1.583 1.00 2.28 H new ATOM 0 HB2 PHE A 16 -0.855 19.921 -0.990 1.00 2.02 H new ATOM 0 HB3 PHE A 16 0.189 21.324 -0.884 1.00 2.02 H new ATOM 0 HD1 PHE A 16 -0.750 23.243 0.803 1.00 2.18 H new ATOM 0 HD2 PHE A 16 -1.728 19.091 0.964 1.00 2.17 H new ATOM 0 HE1 PHE A 16 -1.293 23.451 3.195 1.00 2.21 H new ATOM 0 HE2 PHE A 16 -2.282 19.309 3.336 1.00 2.07 H new ATOM 0 HZ PHE A 16 -2.070 21.481 4.454 1.00 1.79 H new ATOM 253 N SER A 17 -0.433 23.722 -2.147 1.00 2.80 N ATOM 254 CA SER A 17 -0.088 25.124 -2.071 1.00 3.11 C ATOM 255 C SER A 17 -0.989 26.015 -2.910 1.00 3.36 C ATOM 256 O SER A 17 -1.045 27.226 -2.673 1.00 3.59 O ATOM 257 CB SER A 17 1.366 25.333 -2.473 1.00 3.33 C ATOM 258 OG SER A 17 2.249 24.770 -1.518 1.00 3.30 O ATOM 0 H SER A 17 0.249 23.154 -2.649 1.00 2.80 H new ATOM 0 HA SER A 17 -0.235 25.418 -1.032 1.00 3.11 H new ATOM 0 HB2 SER A 17 1.545 24.880 -3.448 1.00 3.33 H new ATOM 0 HB3 SER A 17 1.568 26.399 -2.575 1.00 3.33 H new ATOM 0 HG SER A 17 2.673 23.972 -1.896 1.00 3.30 H new ATOM 264 N LEU A 18 -1.698 25.433 -3.892 1.00 3.35 N ATOM 265 CA LEU A 18 -2.576 26.216 -4.746 1.00 3.63 C ATOM 266 C LEU A 18 -3.760 26.755 -3.953 1.00 3.56 C ATOM 267 O LEU A 18 -4.463 27.676 -4.379 1.00 3.81 O ATOM 268 CB LEU A 18 -3.009 25.396 -5.968 1.00 3.72 C ATOM 269 CG LEU A 18 -4.304 24.615 -5.809 1.00 3.54 C ATOM 270 CD1 LEU A 18 -5.502 25.432 -6.279 1.00 3.79 C ATOM 271 CD2 LEU A 18 -4.250 23.283 -6.541 1.00 3.53 C ATOM 0 H LEU A 18 -1.675 24.436 -4.104 1.00 3.35 H new ATOM 0 HA LEU A 18 -2.028 27.081 -5.120 1.00 3.63 H new ATOM 0 HB2 LEU A 18 -3.115 26.071 -6.817 1.00 3.72 H new ATOM 0 HB3 LEU A 18 -2.211 24.696 -6.215 1.00 3.72 H new ATOM 0 HG LEU A 18 -4.424 24.408 -4.746 1.00 3.54 H new ATOM 0 HD11 LEU A 18 -6.413 24.847 -6.153 1.00 3.79 H new ATOM 0 HD12 LEU A 18 -5.573 26.346 -5.689 1.00 3.79 H new ATOM 0 HD13 LEU A 18 -5.378 25.688 -7.331 1.00 3.79 H new ATOM 0 HD21 LEU A 18 -5.193 22.754 -6.404 1.00 3.53 H new ATOM 0 HD22 LEU A 18 -4.083 23.458 -7.604 1.00 3.53 H new ATOM 0 HD23 LEU A 18 -3.435 22.681 -6.141 1.00 3.53 H new ATOM 283 N PHE A 19 -3.949 26.131 -2.813 1.00 3.24 N ATOM 284 CA PHE A 19 -4.999 26.490 -1.872 1.00 3.16 C ATOM 285 C PHE A 19 -4.376 27.065 -0.599 1.00 3.11 C ATOM 286 O PHE A 19 -5.085 27.403 0.356 1.00 3.07 O ATOM 287 CB PHE A 19 -5.844 25.259 -1.529 1.00 2.89 C ATOM 288 CG PHE A 19 -6.547 24.623 -2.707 1.00 3.01 C ATOM 289 CD1 PHE A 19 -6.130 23.393 -3.193 1.00 3.31 C ATOM 290 CD2 PHE A 19 -7.624 25.250 -3.323 1.00 3.27 C ATOM 291 CE1 PHE A 19 -6.769 22.800 -4.264 1.00 3.50 C ATOM 292 CE2 PHE A 19 -8.265 24.661 -4.398 1.00 3.41 C ATOM 293 CZ PHE A 19 -7.837 23.434 -4.868 1.00 3.37 C ATOM 0 H PHE A 19 -3.373 25.348 -2.504 1.00 3.24 H new ATOM 0 HA PHE A 19 -5.643 27.242 -2.328 1.00 3.16 H new ATOM 0 HB2 PHE A 19 -5.201 24.513 -1.062 1.00 2.89 H new ATOM 0 HB3 PHE A 19 -6.591 25.544 -0.789 1.00 2.89 H new ATOM 0 HD1 PHE A 19 -5.294 22.892 -2.728 1.00 3.31 H new ATOM 0 HD2 PHE A 19 -7.964 26.208 -2.958 1.00 3.27 H new ATOM 0 HE1 PHE A 19 -6.434 21.841 -4.629 1.00 3.50 H new ATOM 0 HE2 PHE A 19 -9.099 25.160 -4.869 1.00 3.41 H new ATOM 0 HZ PHE A 19 -8.337 22.972 -5.706 1.00 3.37 H new ATOM 303 N ALA A 20 -3.035 27.188 -0.607 1.00 3.18 N ATOM 304 CA ALA A 20 -2.283 27.709 0.561 1.00 3.22 C ATOM 305 C ALA A 20 -2.571 29.196 0.856 1.00 3.51 C ATOM 306 O ALA A 20 -1.843 30.092 0.410 1.00 3.80 O ATOM 307 CB ALA A 20 -0.786 27.482 0.379 1.00 3.38 C ATOM 0 H ALA A 20 -2.449 26.936 -1.403 1.00 3.18 H new ATOM 0 HA ALA A 20 -2.632 27.147 1.428 1.00 3.22 H new ATOM 0 HB1 ALA A 20 -0.251 27.871 1.246 1.00 3.38 H new ATOM 0 HB2 ALA A 20 -0.589 26.414 0.280 1.00 3.38 H new ATOM 0 HB3 ALA A 20 -0.446 27.998 -0.519 1.00 3.38 H new ATOM 354 N ASP A 24 -0.782 28.776 8.614 1.00 3.98 N ATOM 355 CA ASP A 24 0.205 27.799 9.126 1.00 3.89 C ATOM 356 C ASP A 24 0.736 26.900 7.996 1.00 3.62 C ATOM 357 O ASP A 24 1.656 26.100 8.194 1.00 3.56 O ATOM 358 CB ASP A 24 -0.422 26.938 10.229 1.00 3.77 C ATOM 359 CG ASP A 24 -0.684 27.719 11.503 1.00 4.13 C ATOM 360 OD1 ASP A 24 -1.789 28.285 11.636 1.00 4.50 O ATOM 361 OD2 ASP A 24 0.217 27.764 12.367 1.00 4.32 O ATOM 0 HA ASP A 24 1.044 28.357 9.541 1.00 3.89 H new ATOM 0 HB2 ASP A 24 -1.360 26.517 9.867 1.00 3.77 H new ATOM 0 HB3 ASP A 24 0.239 26.100 10.451 1.00 3.77 H new ATOM 366 N GLY A 25 0.131 27.069 6.817 1.00 3.50 N ATOM 367 CA GLY A 25 0.497 26.329 5.622 1.00 3.30 C ATOM 368 C GLY A 25 -0.353 25.104 5.522 1.00 2.90 C ATOM 369 O GLY A 25 0.141 23.977 5.424 1.00 2.69 O ATOM 0 H GLY A 25 -0.632 27.730 6.671 1.00 3.50 H new ATOM 0 HA2 GLY A 25 0.362 26.953 4.738 1.00 3.30 H new ATOM 0 HA3 GLY A 25 1.551 26.053 5.659 1.00 3.30 H new ATOM 373 N THR A 26 -1.662 25.365 5.547 1.00 2.85 N ATOM 374 CA THR A 26 -2.658 24.321 5.519 1.00 2.53 C ATOM 375 C THR A 26 -3.706 24.528 4.430 1.00 2.45 C ATOM 376 O THR A 26 -3.725 25.564 3.758 1.00 2.66 O ATOM 377 CB THR A 26 -3.380 24.211 6.868 1.00 2.59 C ATOM 378 OG1 THR A 26 -4.139 25.392 7.157 1.00 2.84 O ATOM 379 CG2 THR A 26 -2.383 23.965 7.950 1.00 2.74 C ATOM 0 H THR A 26 -2.049 26.308 5.587 1.00 2.85 H new ATOM 0 HA THR A 26 -2.113 23.402 5.303 1.00 2.53 H new ATOM 0 HB THR A 26 -4.077 23.375 6.814 1.00 2.59 H new ATOM 0 HG1 THR A 26 -4.184 25.523 8.127 1.00 2.84 H new ATOM 0 HG21 THR A 26 -2.897 23.887 8.908 1.00 2.74 H new ATOM 0 HG22 THR A 26 -1.849 23.036 7.748 1.00 2.74 H new ATOM 0 HG23 THR A 26 -1.673 24.791 7.986 1.00 2.74 H new ATOM 387 N ILE A 27 -4.585 23.523 4.280 1.00 2.21 N ATOM 388 CA ILE A 27 -5.677 23.555 3.289 1.00 2.22 C ATOM 389 C ILE A 27 -6.871 22.763 3.830 1.00 2.15 C ATOM 390 O ILE A 27 -6.859 22.347 4.979 1.00 2.13 O ATOM 391 CB ILE A 27 -5.262 23.021 1.875 1.00 2.13 C ATOM 392 CG1 ILE A 27 -4.892 21.529 1.940 1.00 1.82 C ATOM 393 CG2 ILE A 27 -4.138 23.874 1.278 1.00 2.31 C ATOM 394 CD1 ILE A 27 -4.767 20.869 0.582 1.00 1.79 C ATOM 0 H ILE A 27 -4.560 22.670 4.838 1.00 2.21 H new ATOM 0 HA ILE A 27 -5.945 24.601 3.143 1.00 2.22 H new ATOM 0 HB ILE A 27 -6.118 23.108 1.206 1.00 2.13 H new ATOM 0 HG12 ILE A 27 -3.948 21.422 2.474 1.00 1.82 H new ATOM 0 HG13 ILE A 27 -5.649 21.002 2.521 1.00 1.82 H new ATOM 0 HG21 ILE A 27 -3.867 23.484 0.297 1.00 2.31 H new ATOM 0 HG22 ILE A 27 -4.478 24.905 1.178 1.00 2.31 H new ATOM 0 HG23 ILE A 27 -3.268 23.841 1.934 1.00 2.31 H new ATOM 0 HD11 ILE A 27 -4.504 19.819 0.711 1.00 1.79 H new ATOM 0 HD12 ILE A 27 -5.717 20.943 0.053 1.00 1.79 H new ATOM 0 HD13 ILE A 27 -3.990 21.369 0.004 1.00 1.79 H new ATOM 406 N THR A 28 -7.904 22.594 3.023 1.00 2.23 N ATOM 407 CA THR A 28 -9.088 21.832 3.434 1.00 2.29 C ATOM 408 C THR A 28 -9.131 20.504 2.677 1.00 2.17 C ATOM 409 O THR A 28 -8.406 20.309 1.696 1.00 2.04 O ATOM 410 CB THR A 28 -10.414 22.654 3.281 1.00 2.57 C ATOM 411 OG1 THR A 28 -11.565 21.797 3.304 1.00 2.86 O ATOM 412 CG2 THR A 28 -10.432 23.497 2.010 1.00 3.10 C ATOM 0 H THR A 28 -7.954 22.972 2.077 1.00 2.23 H new ATOM 0 HA THR A 28 -9.006 21.618 4.500 1.00 2.29 H new ATOM 0 HB THR A 28 -10.452 23.329 4.136 1.00 2.57 H new ATOM 0 HG1 THR A 28 -12.377 22.337 3.208 1.00 2.86 H new ATOM 0 HG21 THR A 28 -11.371 24.047 1.951 1.00 3.10 H new ATOM 0 HG22 THR A 28 -9.600 24.201 2.029 1.00 3.10 H new ATOM 0 HG23 THR A 28 -10.337 22.846 1.141 1.00 3.10 H new ATOM 420 N THR A 29 -9.992 19.604 3.146 1.00 2.30 N ATOM 421 CA THR A 29 -10.105 18.251 2.601 1.00 2.30 C ATOM 422 C THR A 29 -10.621 18.154 1.166 1.00 2.50 C ATOM 423 O THR A 29 -9.997 17.486 0.336 1.00 2.44 O ATOM 424 CB THR A 29 -10.978 17.377 3.493 1.00 2.48 C ATOM 425 OG1 THR A 29 -12.205 18.046 3.813 1.00 2.75 O ATOM 426 CG2 THR A 29 -10.217 17.037 4.754 1.00 2.32 C ATOM 0 H THR A 29 -10.633 19.792 3.917 1.00 2.30 H new ATOM 0 HA THR A 29 -9.075 17.895 2.578 1.00 2.30 H new ATOM 0 HB THR A 29 -11.226 16.459 2.961 1.00 2.48 H new ATOM 0 HG1 THR A 29 -12.753 17.469 4.385 1.00 2.75 H new ATOM 0 HG21 THR A 29 -10.837 16.412 5.396 1.00 2.32 H new ATOM 0 HG22 THR A 29 -9.305 16.499 4.495 1.00 2.32 H new ATOM 0 HG23 THR A 29 -9.959 17.955 5.282 1.00 2.32 H new ATOM 434 N LYS A 30 -11.759 18.803 0.878 1.00 2.77 N ATOM 435 CA LYS A 30 -12.369 18.772 -0.467 1.00 3.04 C ATOM 436 C LYS A 30 -11.368 19.159 -1.564 1.00 2.98 C ATOM 437 O LYS A 30 -11.383 18.587 -2.658 1.00 3.14 O ATOM 438 CB LYS A 30 -13.592 19.701 -0.525 1.00 3.33 C ATOM 439 CG LYS A 30 -14.815 19.183 0.232 1.00 3.42 C ATOM 440 CD LYS A 30 -14.781 19.571 1.705 1.00 3.38 C ATOM 441 CE LYS A 30 -16.021 19.086 2.437 1.00 3.68 C ATOM 442 NZ LYS A 30 -15.997 19.460 3.878 1.00 3.70 N ATOM 0 H LYS A 30 -12.279 19.358 1.558 1.00 2.77 H new ATOM 0 HA LYS A 30 -12.684 17.745 -0.652 1.00 3.04 H new ATOM 0 HB2 LYS A 30 -13.314 20.674 -0.119 1.00 3.33 H new ATOM 0 HB3 LYS A 30 -13.865 19.857 -1.569 1.00 3.33 H new ATOM 0 HG2 LYS A 30 -15.720 19.580 -0.227 1.00 3.42 H new ATOM 0 HG3 LYS A 30 -14.863 18.098 0.144 1.00 3.42 H new ATOM 0 HD2 LYS A 30 -13.892 19.148 2.173 1.00 3.38 H new ATOM 0 HD3 LYS A 30 -14.704 20.655 1.795 1.00 3.38 H new ATOM 0 HE2 LYS A 30 -16.909 19.509 1.967 1.00 3.68 H new ATOM 0 HE3 LYS A 30 -16.097 18.003 2.344 1.00 3.68 H new ATOM 0 HZ1 LYS A 30 -16.860 19.111 4.342 1.00 3.70 H new ATOM 0 HZ2 LYS A 30 -15.164 19.036 4.333 1.00 3.70 H new ATOM 0 HZ3 LYS A 30 -15.951 20.495 3.967 1.00 3.70 H new ATOM 456 N GLU A 31 -10.508 20.133 -1.250 1.00 2.81 N ATOM 457 CA GLU A 31 -9.485 20.613 -2.183 1.00 2.81 C ATOM 458 C GLU A 31 -8.163 19.839 -2.074 1.00 2.52 C ATOM 459 O GLU A 31 -7.316 19.969 -2.965 1.00 2.57 O ATOM 460 CB GLU A 31 -9.233 22.113 -1.974 1.00 2.89 C ATOM 461 CG GLU A 31 -10.393 23.006 -2.405 1.00 3.24 C ATOM 462 CD GLU A 31 -11.385 23.266 -1.288 1.00 3.22 C ATOM 463 OE1 GLU A 31 -11.393 24.395 -0.755 1.00 3.26 O ATOM 464 OE2 GLU A 31 -12.153 22.344 -0.948 1.00 3.60 O ATOM 0 H GLU A 31 -10.501 20.608 -0.347 1.00 2.81 H new ATOM 0 HA GLU A 31 -9.874 20.440 -3.187 1.00 2.81 H new ATOM 0 HB2 GLU A 31 -9.023 22.292 -0.919 1.00 2.89 H new ATOM 0 HB3 GLU A 31 -8.341 22.401 -2.530 1.00 2.89 H new ATOM 0 HG2 GLU A 31 -9.999 23.957 -2.763 1.00 3.24 H new ATOM 0 HG3 GLU A 31 -10.911 22.540 -3.243 1.00 3.24 H new ATOM 471 N LEU A 32 -7.968 19.031 -1.004 1.00 2.26 N ATOM 472 CA LEU A 32 -6.708 18.278 -0.865 1.00 1.98 C ATOM 473 C LEU A 32 -6.663 17.066 -1.763 1.00 2.07 C ATOM 474 O LEU A 32 -5.602 16.690 -2.247 1.00 1.98 O ATOM 475 CB LEU A 32 -6.358 17.906 0.577 1.00 1.69 C ATOM 476 CG LEU A 32 -7.229 16.927 1.383 1.00 1.74 C ATOM 477 CD1 LEU A 32 -7.087 15.471 0.952 1.00 1.76 C ATOM 478 CD2 LEU A 32 -6.765 17.032 2.799 1.00 1.59 C ATOM 0 H LEU A 32 -8.643 18.889 -0.252 1.00 2.26 H new ATOM 0 HA LEU A 32 -5.935 18.973 -1.194 1.00 1.98 H new ATOM 0 HB2 LEU A 32 -5.348 17.496 0.563 1.00 1.69 H new ATOM 0 HB3 LEU A 32 -6.317 18.836 1.144 1.00 1.69 H new ATOM 0 HG LEU A 32 -8.275 17.194 1.231 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -7.732 14.845 1.568 1.00 1.76 H new ATOM 0 HD12 LEU A 32 -7.376 15.371 -0.094 1.00 1.76 H new ATOM 0 HD13 LEU A 32 -6.051 15.155 1.074 1.00 1.76 H new ATOM 0 HD21 LEU A 32 -7.349 16.357 3.424 1.00 1.59 H new ATOM 0 HD22 LEU A 32 -5.711 16.761 2.858 1.00 1.59 H new ATOM 0 HD23 LEU A 32 -6.896 18.056 3.150 1.00 1.59 H new ATOM 490 N GLY A 33 -7.809 16.423 -1.938 1.00 2.31 N ATOM 491 CA GLY A 33 -7.886 15.298 -2.859 1.00 2.52 C ATOM 492 C GLY A 33 -7.614 15.755 -4.263 1.00 2.75 C ATOM 493 O GLY A 33 -7.322 14.952 -5.140 1.00 2.91 O ATOM 0 H GLY A 33 -8.682 16.655 -1.465 1.00 2.31 H new ATOM 0 HA2 GLY A 33 -7.164 14.534 -2.572 1.00 2.52 H new ATOM 0 HA3 GLY A 33 -8.874 14.840 -2.803 1.00 2.52 H new ATOM 497 N THR A 34 -7.753 17.076 -4.462 1.00 2.81 N ATOM 498 CA THR A 34 -7.453 17.715 -5.729 1.00 3.07 C ATOM 499 C THR A 34 -5.952 17.683 -5.933 1.00 2.93 C ATOM 500 O THR A 34 -5.427 17.857 -7.036 1.00 3.16 O ATOM 501 CB THR A 34 -8.027 19.153 -5.836 1.00 3.23 C ATOM 502 OG1 THR A 34 -9.328 19.204 -5.236 1.00 3.30 O ATOM 503 CG2 THR A 34 -8.134 19.609 -7.289 1.00 3.60 C ATOM 0 H THR A 34 -8.077 17.721 -3.741 1.00 2.81 H new ATOM 0 HA THR A 34 -7.946 17.161 -6.528 1.00 3.07 H new ATOM 0 HB THR A 34 -7.342 19.820 -5.313 1.00 3.23 H new ATOM 0 HG1 THR A 34 -9.750 20.064 -5.443 1.00 3.30 H new ATOM 0 HG21 THR A 34 -8.540 20.620 -7.324 1.00 3.60 H new ATOM 0 HG22 THR A 34 -7.145 19.599 -7.747 1.00 3.60 H new ATOM 0 HG23 THR A 34 -8.794 18.934 -7.834 1.00 3.60 H new ATOM 511 N VAL A 35 -5.305 17.454 -4.805 1.00 2.56 N ATOM 512 CA VAL A 35 -3.865 17.247 -4.729 1.00 2.39 C ATOM 513 C VAL A 35 -3.642 15.815 -5.149 1.00 2.44 C ATOM 514 O VAL A 35 -2.671 15.515 -5.832 1.00 2.53 O ATOM 515 CB VAL A 35 -3.230 17.403 -3.299 1.00 2.01 C ATOM 516 CG1 VAL A 35 -1.765 16.963 -3.289 1.00 1.92 C ATOM 517 CG2 VAL A 35 -3.306 18.815 -2.767 1.00 2.02 C ATOM 0 H VAL A 35 -5.771 17.405 -3.899 1.00 2.56 H new ATOM 0 HA VAL A 35 -3.395 18.008 -5.352 1.00 2.39 H new ATOM 0 HB VAL A 35 -3.823 16.758 -2.650 1.00 2.01 H new ATOM 0 HG11 VAL A 35 -1.356 17.083 -2.286 1.00 1.92 H new ATOM 0 HG12 VAL A 35 -1.697 15.916 -3.585 1.00 1.92 H new ATOM 0 HG13 VAL A 35 -1.196 17.575 -3.989 1.00 1.92 H new ATOM 0 HG21 VAL A 35 -2.851 18.856 -1.777 1.00 2.02 H new ATOM 0 HG22 VAL A 35 -2.772 19.486 -3.440 1.00 2.02 H new ATOM 0 HG23 VAL A 35 -4.349 19.123 -2.700 1.00 2.02 H new ATOM 527 N MET A 36 -4.576 14.930 -4.733 1.00 2.44 N ATOM 528 CA MET A 36 -4.449 13.527 -5.049 1.00 2.55 C ATOM 529 C MET A 36 -4.955 13.199 -6.458 1.00 2.97 C ATOM 530 O MET A 36 -4.315 12.433 -7.185 1.00 3.11 O ATOM 531 CB MET A 36 -5.197 12.681 -4.019 1.00 2.49 C ATOM 532 CG MET A 36 -4.484 11.391 -3.632 1.00 2.24 C ATOM 533 SD MET A 36 -5.418 10.405 -2.438 1.00 2.48 S ATOM 534 CE MET A 36 -5.119 11.295 -0.907 1.00 1.96 C ATOM 0 H MET A 36 -5.403 15.175 -4.189 1.00 2.44 H new ATOM 0 HA MET A 36 -3.386 13.288 -5.018 1.00 2.55 H new ATOM 0 HB2 MET A 36 -5.356 13.278 -3.121 1.00 2.49 H new ATOM 0 HB3 MET A 36 -6.182 12.434 -4.415 1.00 2.49 H new ATOM 0 HG2 MET A 36 -4.307 10.796 -4.528 1.00 2.24 H new ATOM 0 HG3 MET A 36 -3.508 11.633 -3.212 1.00 2.24 H new ATOM 0 HE1 MET A 36 -6.036 11.326 -0.319 1.00 1.96 H new ATOM 0 HE2 MET A 36 -4.340 10.788 -0.338 1.00 1.96 H new ATOM 0 HE3 MET A 36 -4.799 12.312 -1.134 1.00 1.96 H new ATOM 544 N ARG A 37 -6.094 13.809 -6.848 1.00 3.18 N ATOM 545 CA ARG A 37 -6.741 13.535 -8.132 1.00 3.60 C ATOM 546 C ARG A 37 -5.908 13.981 -9.343 1.00 3.77 C ATOM 547 O ARG A 37 -6.146 13.533 -10.468 1.00 4.10 O ATOM 548 CB ARG A 37 -8.098 14.252 -8.183 1.00 3.78 C ATOM 549 CG ARG A 37 -9.314 13.336 -8.081 1.00 4.18 C ATOM 550 CD ARG A 37 -9.710 12.744 -9.434 1.00 4.52 C ATOM 551 NE ARG A 37 -10.204 13.765 -10.370 1.00 4.90 N ATOM 552 CZ ARG A 37 -10.540 13.531 -11.647 1.00 5.36 C ATOM 553 NH1 ARG A 37 -10.445 12.311 -12.173 1.00 5.45 N ATOM 554 NH2 ARG A 37 -10.975 14.530 -12.403 1.00 5.91 N ATOM 0 H ARG A 37 -6.583 14.501 -6.279 1.00 3.18 H new ATOM 0 HA ARG A 37 -6.856 12.453 -8.196 1.00 3.60 H new ATOM 0 HB2 ARG A 37 -8.139 14.978 -7.371 1.00 3.78 H new ATOM 0 HB3 ARG A 37 -8.161 14.813 -9.116 1.00 3.78 H new ATOM 0 HG2 ARG A 37 -9.099 12.528 -7.382 1.00 4.18 H new ATOM 0 HG3 ARG A 37 -10.155 13.896 -7.672 1.00 4.18 H new ATOM 0 HD2 ARG A 37 -8.849 12.239 -9.873 1.00 4.52 H new ATOM 0 HD3 ARG A 37 -10.481 11.988 -9.285 1.00 4.52 H new ATOM 0 HE ARG A 37 -10.298 14.720 -10.023 1.00 4.90 H new ATOM 0 HH11 ARG A 37 -10.112 11.534 -11.602 1.00 5.45 H new ATOM 0 HH12 ARG A 37 -10.706 12.154 -13.147 1.00 5.45 H new ATOM 0 HH21 ARG A 37 -11.052 15.469 -12.012 1.00 5.91 H new ATOM 0 HH22 ARG A 37 -11.232 14.359 -13.375 1.00 5.91 H new ATOM 568 N SER A 38 -4.937 14.863 -9.090 1.00 3.57 N ATOM 569 CA SER A 38 -4.074 15.429 -10.139 1.00 3.76 C ATOM 570 C SER A 38 -3.003 14.449 -10.640 1.00 3.81 C ATOM 571 O SER A 38 -2.573 14.546 -11.794 1.00 4.08 O ATOM 572 CB SER A 38 -3.402 16.705 -9.622 1.00 3.59 C ATOM 573 OG SER A 38 -2.773 17.422 -10.672 1.00 3.89 O ATOM 0 H SER A 38 -4.724 15.207 -8.154 1.00 3.57 H new ATOM 0 HA SER A 38 -4.719 15.652 -10.989 1.00 3.76 H new ATOM 0 HB2 SER A 38 -4.146 17.340 -9.141 1.00 3.59 H new ATOM 0 HB3 SER A 38 -2.664 16.447 -8.863 1.00 3.59 H new ATOM 0 HG SER A 38 -2.355 18.231 -10.311 1.00 3.89 H new ATOM 579 N LEU A 39 -2.580 13.514 -9.781 1.00 3.59 N ATOM 580 CA LEU A 39 -1.548 12.535 -10.155 1.00 3.65 C ATOM 581 C LEU A 39 -2.159 11.248 -10.719 1.00 3.91 C ATOM 582 O LEU A 39 -1.441 10.389 -11.242 1.00 4.06 O ATOM 583 CB LEU A 39 -0.641 12.204 -8.962 1.00 3.29 C ATOM 584 CG LEU A 39 -0.034 13.416 -8.253 1.00 3.06 C ATOM 585 CD1 LEU A 39 -0.921 13.841 -7.106 1.00 2.78 C ATOM 586 CD2 LEU A 39 1.367 13.121 -7.760 1.00 3.19 C ATOM 0 H LEU A 39 -2.932 13.413 -8.829 1.00 3.59 H new ATOM 0 HA LEU A 39 -0.946 12.996 -10.939 1.00 3.65 H new ATOM 0 HB2 LEU A 39 -1.216 11.629 -8.237 1.00 3.29 H new ATOM 0 HB3 LEU A 39 0.169 11.562 -9.308 1.00 3.29 H new ATOM 0 HG LEU A 39 0.034 14.233 -8.972 1.00 3.06 H new ATOM 0 HD11 LEU A 39 -0.481 14.704 -6.607 1.00 2.78 H new ATOM 0 HD12 LEU A 39 -1.907 14.106 -7.487 1.00 2.78 H new ATOM 0 HD13 LEU A 39 -1.015 13.020 -6.395 1.00 2.78 H new ATOM 0 HD21 LEU A 39 1.770 14.002 -7.261 1.00 3.19 H new ATOM 0 HD22 LEU A 39 1.338 12.288 -7.058 1.00 3.19 H new ATOM 0 HD23 LEU A 39 2.003 12.860 -8.606 1.00 3.19 H new ATOM 598 N GLY A 40 -3.486 11.135 -10.613 1.00 4.01 N ATOM 599 CA GLY A 40 -4.193 9.962 -11.105 1.00 4.30 C ATOM 600 C GLY A 40 -4.650 9.038 -9.990 1.00 4.16 C ATOM 601 O GLY A 40 -4.750 7.824 -10.192 1.00 4.36 O ATOM 0 H GLY A 40 -4.086 11.843 -10.191 1.00 4.01 H new ATOM 0 HA2 GLY A 40 -5.060 10.282 -11.683 1.00 4.30 H new ATOM 0 HA3 GLY A 40 -3.543 9.410 -11.784 1.00 4.30 H new ATOM 605 N GLN A 41 -4.928 9.616 -8.809 1.00 3.86 N ATOM 606 CA GLN A 41 -5.384 8.852 -7.645 1.00 3.74 C ATOM 607 C GLN A 41 -6.371 9.702 -6.862 1.00 3.60 C ATOM 608 O GLN A 41 -6.010 10.757 -6.351 1.00 3.46 O ATOM 609 CB GLN A 41 -4.203 8.471 -6.731 1.00 3.47 C ATOM 610 CG GLN A 41 -3.212 7.491 -7.344 1.00 3.68 C ATOM 611 CD GLN A 41 -2.326 6.833 -6.304 1.00 3.94 C ATOM 612 OE1 GLN A 41 -2.662 5.780 -5.762 1.00 4.34 O ATOM 613 NE2 GLN A 41 -1.186 7.452 -6.021 1.00 4.15 N ATOM 0 H GLN A 41 -4.843 10.618 -8.639 1.00 3.86 H new ATOM 0 HA GLN A 41 -5.856 7.933 -7.991 1.00 3.74 H new ATOM 0 HB2 GLN A 41 -3.669 9.380 -6.453 1.00 3.47 H new ATOM 0 HB3 GLN A 41 -4.598 8.039 -5.811 1.00 3.47 H new ATOM 0 HG2 GLN A 41 -3.758 6.722 -7.891 1.00 3.68 H new ATOM 0 HG3 GLN A 41 -2.589 8.015 -8.068 1.00 3.68 H new ATOM 0 HE21 GLN A 41 -0.948 8.323 -6.495 1.00 4.15 H new ATOM 0 HE22 GLN A 41 -0.549 7.056 -5.330 1.00 4.15 H new ATOM 622 N ASN A 42 -7.604 9.238 -6.740 1.00 3.76 N ATOM 623 CA ASN A 42 -8.611 9.999 -6.034 1.00 3.68 C ATOM 624 C ASN A 42 -8.891 9.392 -4.637 1.00 3.53 C ATOM 625 O ASN A 42 -8.922 8.164 -4.515 1.00 3.67 O ATOM 626 CB ASN A 42 -9.907 10.073 -6.867 1.00 4.06 C ATOM 627 CG ASN A 42 -10.553 8.716 -7.129 1.00 4.60 C ATOM 628 OD1 ASN A 42 -10.256 8.056 -8.124 1.00 4.82 O ATOM 629 ND2 ASN A 42 -11.440 8.299 -6.232 1.00 5.19 N ATOM 0 H ASN A 42 -7.926 8.347 -7.118 1.00 3.76 H new ATOM 0 HA ASN A 42 -8.233 11.011 -5.887 1.00 3.68 H new ATOM 0 HB2 ASN A 42 -10.623 10.711 -6.350 1.00 4.06 H new ATOM 0 HB3 ASN A 42 -9.686 10.550 -7.822 1.00 4.06 H new ATOM 0 HD21 ASN A 42 -11.904 7.399 -6.354 1.00 5.19 H new ATOM 0 HD22 ASN A 42 -11.656 8.879 -5.421 1.00 5.19 H new ATOM 636 N PRO A 43 -9.099 10.218 -3.562 1.00 3.30 N ATOM 637 CA PRO A 43 -9.388 9.708 -2.211 1.00 3.22 C ATOM 638 C PRO A 43 -10.892 9.493 -1.969 1.00 3.54 C ATOM 639 O PRO A 43 -11.717 9.861 -2.812 1.00 3.81 O ATOM 640 CB PRO A 43 -8.841 10.815 -1.291 1.00 2.89 C ATOM 641 CG PRO A 43 -8.458 11.967 -2.178 1.00 2.92 C ATOM 642 CD PRO A 43 -9.045 11.694 -3.537 1.00 3.17 C ATOM 0 HA PRO A 43 -8.938 8.730 -2.039 1.00 3.22 H new ATOM 0 HB2 PRO A 43 -9.594 11.120 -0.564 1.00 2.89 H new ATOM 0 HB3 PRO A 43 -7.979 10.458 -0.727 1.00 2.89 H new ATOM 0 HG2 PRO A 43 -8.839 12.906 -1.776 1.00 2.92 H new ATOM 0 HG3 PRO A 43 -7.374 12.062 -2.239 1.00 2.92 H new ATOM 0 HD2 PRO A 43 -10.033 12.140 -3.651 1.00 3.17 H new ATOM 0 HD3 PRO A 43 -8.422 12.092 -4.337 1.00 3.17 H new ATOM 650 N THR A 44 -11.239 8.898 -0.812 1.00 3.56 N ATOM 651 CA THR A 44 -12.642 8.631 -0.448 1.00 3.90 C ATOM 652 C THR A 44 -13.363 9.921 -0.020 1.00 3.85 C ATOM 653 O THR A 44 -12.723 10.955 0.176 1.00 3.54 O ATOM 654 CB THR A 44 -12.753 7.583 0.687 1.00 4.01 C ATOM 655 OG1 THR A 44 -11.516 6.873 0.843 1.00 3.86 O ATOM 656 CG2 THR A 44 -13.870 6.589 0.396 1.00 4.50 C ATOM 0 H THR A 44 -10.563 8.592 -0.112 1.00 3.56 H new ATOM 0 HA THR A 44 -13.123 8.230 -1.340 1.00 3.90 H new ATOM 0 HB THR A 44 -12.980 8.116 1.610 1.00 4.01 H new ATOM 0 HG1 THR A 44 -11.682 6.024 1.304 1.00 3.86 H new ATOM 0 HG21 THR A 44 -13.930 5.862 1.206 1.00 4.50 H new ATOM 0 HG22 THR A 44 -14.818 7.121 0.314 1.00 4.50 H new ATOM 0 HG23 THR A 44 -13.662 6.072 -0.541 1.00 4.50 H new ATOM 664 N GLU A 45 -14.697 9.844 0.115 1.00 4.21 N ATOM 665 CA GLU A 45 -15.524 11.002 0.495 1.00 4.27 C ATOM 666 C GLU A 45 -15.506 11.289 2.005 1.00 4.16 C ATOM 667 O GLU A 45 -15.396 12.449 2.411 1.00 4.02 O ATOM 668 CB GLU A 45 -16.970 10.796 0.027 1.00 4.73 C ATOM 669 CG GLU A 45 -17.158 10.947 -1.476 1.00 4.87 C ATOM 670 CD GLU A 45 -18.596 10.740 -1.907 1.00 5.41 C ATOM 671 OE1 GLU A 45 -19.353 11.733 -1.946 1.00 5.67 O ATOM 672 OE2 GLU A 45 -18.966 9.585 -2.207 1.00 5.89 O ATOM 0 H GLU A 45 -15.229 8.986 -0.034 1.00 4.21 H new ATOM 0 HA GLU A 45 -15.087 11.869 -0.000 1.00 4.27 H new ATOM 0 HB2 GLU A 45 -17.301 9.802 0.327 1.00 4.73 H new ATOM 0 HB3 GLU A 45 -17.613 11.513 0.538 1.00 4.73 H new ATOM 0 HG2 GLU A 45 -16.831 11.941 -1.781 1.00 4.87 H new ATOM 0 HG3 GLU A 45 -16.521 10.229 -1.992 1.00 4.87 H new ATOM 679 N ALA A 46 -15.613 10.233 2.825 1.00 4.29 N ATOM 680 CA ALA A 46 -15.641 10.381 4.288 1.00 4.30 C ATOM 681 C ALA A 46 -14.262 10.271 4.930 1.00 3.96 C ATOM 682 O ALA A 46 -13.989 10.945 5.928 1.00 3.93 O ATOM 683 CB ALA A 46 -16.553 9.337 4.909 1.00 4.70 C ATOM 0 H ALA A 46 -15.681 9.268 2.501 1.00 4.29 H new ATOM 0 HA ALA A 46 -16.018 11.385 4.481 1.00 4.30 H new ATOM 0 HB1 ALA A 46 -16.563 9.460 5.992 1.00 4.70 H new ATOM 0 HB2 ALA A 46 -17.564 9.460 4.521 1.00 4.70 H new ATOM 0 HB3 ALA A 46 -16.188 8.341 4.660 1.00 4.70 H new ATOM 689 N GLU A 47 -13.396 9.424 4.358 1.00 3.76 N ATOM 690 CA GLU A 47 -12.053 9.188 4.901 1.00 3.47 C ATOM 691 C GLU A 47 -11.186 10.441 4.963 1.00 3.09 C ATOM 692 O GLU A 47 -10.263 10.497 5.775 1.00 2.91 O ATOM 693 CB GLU A 47 -11.339 8.065 4.143 1.00 3.43 C ATOM 694 CG GLU A 47 -11.979 6.693 4.324 1.00 3.78 C ATOM 695 CD GLU A 47 -11.150 5.573 3.725 1.00 3.77 C ATOM 696 OE1 GLU A 47 -10.059 5.287 4.263 1.00 3.72 O ATOM 697 OE2 GLU A 47 -11.594 4.977 2.722 1.00 4.19 O ATOM 0 H GLU A 47 -13.604 8.889 3.515 1.00 3.76 H new ATOM 0 HA GLU A 47 -12.203 8.876 5.934 1.00 3.47 H new ATOM 0 HB2 GLU A 47 -11.323 8.310 3.081 1.00 3.43 H new ATOM 0 HB3 GLU A 47 -10.302 8.018 4.475 1.00 3.43 H new ATOM 0 HG2 GLU A 47 -12.124 6.502 5.387 1.00 3.78 H new ATOM 0 HG3 GLU A 47 -12.967 6.694 3.863 1.00 3.78 H new ATOM 704 N LEU A 48 -11.482 11.449 4.127 1.00 3.03 N ATOM 705 CA LEU A 48 -10.738 12.721 4.160 1.00 2.71 C ATOM 706 C LEU A 48 -10.908 13.385 5.523 1.00 2.75 C ATOM 707 O LEU A 48 -10.085 14.180 5.949 1.00 2.53 O ATOM 708 CB LEU A 48 -11.220 13.715 3.108 1.00 2.77 C ATOM 709 CG LEU A 48 -11.465 13.173 1.708 1.00 2.90 C ATOM 710 CD1 LEU A 48 -12.643 13.882 1.057 1.00 3.19 C ATOM 711 CD2 LEU A 48 -10.213 13.355 0.884 1.00 2.63 C ATOM 0 H LEU A 48 -12.223 11.411 3.427 1.00 3.03 H new ATOM 0 HA LEU A 48 -9.697 12.471 3.957 1.00 2.71 H new ATOM 0 HB2 LEU A 48 -12.147 14.163 3.465 1.00 2.77 H new ATOM 0 HB3 LEU A 48 -10.485 14.517 3.037 1.00 2.77 H new ATOM 0 HG LEU A 48 -11.708 12.112 1.768 1.00 2.90 H new ATOM 0 HD11 LEU A 48 -12.802 13.480 0.056 1.00 3.19 H new ATOM 0 HD12 LEU A 48 -13.539 13.725 1.658 1.00 3.19 H new ATOM 0 HD13 LEU A 48 -12.433 14.950 0.990 1.00 3.19 H new ATOM 0 HD21 LEU A 48 -10.380 12.969 -0.122 1.00 2.63 H new ATOM 0 HD22 LEU A 48 -9.964 14.415 0.829 1.00 2.63 H new ATOM 0 HD23 LEU A 48 -9.390 12.813 1.349 1.00 2.63 H new ATOM 723 N GLN A 49 -12.025 13.069 6.174 1.00 3.08 N ATOM 724 CA GLN A 49 -12.332 13.581 7.506 1.00 3.22 C ATOM 725 C GLN A 49 -11.506 12.862 8.577 1.00 3.25 C ATOM 726 O GLN A 49 -11.083 13.489 9.551 1.00 3.25 O ATOM 727 CB GLN A 49 -13.824 13.420 7.811 1.00 3.61 C ATOM 728 CG GLN A 49 -14.719 14.388 7.049 1.00 3.67 C ATOM 729 CD GLN A 49 -16.188 14.202 7.374 1.00 4.10 C ATOM 730 OE1 GLN A 49 -16.715 14.823 8.296 1.00 4.58 O ATOM 731 NE2 GLN A 49 -16.857 13.341 6.615 1.00 4.30 N ATOM 0 H GLN A 49 -12.742 12.451 5.793 1.00 3.08 H new ATOM 0 HA GLN A 49 -12.075 14.640 7.522 1.00 3.22 H new ATOM 0 HB2 GLN A 49 -14.125 12.400 7.574 1.00 3.61 H new ATOM 0 HB3 GLN A 49 -13.983 13.559 8.880 1.00 3.61 H new ATOM 0 HG2 GLN A 49 -14.425 15.411 7.285 1.00 3.67 H new ATOM 0 HG3 GLN A 49 -14.567 14.251 5.978 1.00 3.67 H new ATOM 0 HE21 GLN A 49 -16.379 12.848 5.861 1.00 4.30 H new ATOM 0 HE22 GLN A 49 -17.848 13.173 6.787 1.00 4.30 H new ATOM 740 N ASP A 50 -11.282 11.545 8.392 1.00 3.34 N ATOM 741 CA ASP A 50 -10.518 10.754 9.363 1.00 3.43 C ATOM 742 C ASP A 50 -8.997 10.745 9.113 1.00 3.13 C ATOM 743 O ASP A 50 -8.233 10.985 10.051 1.00 3.13 O ATOM 744 CB ASP A 50 -11.042 9.331 9.440 1.00 3.76 C ATOM 745 CG ASP A 50 -12.415 9.245 10.081 1.00 4.11 C ATOM 746 OD1 ASP A 50 -13.420 9.323 9.343 1.00 4.38 O ATOM 747 OD2 ASP A 50 -12.485 9.100 11.319 1.00 4.38 O ATOM 0 H ASP A 50 -11.617 11.017 7.587 1.00 3.34 H new ATOM 0 HA ASP A 50 -10.668 11.254 10.320 1.00 3.43 H new ATOM 0 HB2 ASP A 50 -11.088 8.910 8.435 1.00 3.76 H new ATOM 0 HB3 ASP A 50 -10.341 8.721 10.009 1.00 3.76 H new ATOM 752 N MET A 51 -8.539 10.437 7.874 1.00 2.93 N ATOM 753 CA MET A 51 -7.084 10.418 7.566 1.00 2.66 C ATOM 754 C MET A 51 -6.451 11.781 7.819 1.00 2.39 C ATOM 755 O MET A 51 -5.303 11.885 8.261 1.00 2.30 O ATOM 756 CB MET A 51 -6.824 9.939 6.126 1.00 2.59 C ATOM 757 CG MET A 51 -7.405 10.840 5.036 1.00 2.35 C ATOM 758 SD MET A 51 -6.994 10.298 3.369 1.00 2.18 S ATOM 759 CE MET A 51 -8.232 9.033 3.144 1.00 2.48 C ATOM 0 H MET A 51 -9.141 10.202 7.085 1.00 2.93 H new ATOM 0 HA MET A 51 -6.612 9.703 8.240 1.00 2.66 H new ATOM 0 HB2 MET A 51 -5.748 9.857 5.974 1.00 2.59 H new ATOM 0 HB3 MET A 51 -7.240 8.938 6.010 1.00 2.59 H new ATOM 0 HG2 MET A 51 -8.489 10.874 5.142 1.00 2.35 H new ATOM 0 HG3 MET A 51 -7.038 11.856 5.181 1.00 2.35 H new ATOM 0 HE1 MET A 51 -8.046 8.504 2.209 1.00 2.48 H new ATOM 0 HE2 MET A 51 -8.188 8.329 3.975 1.00 2.48 H new ATOM 0 HE3 MET A 51 -9.220 9.493 3.111 1.00 2.48 H new ATOM 769 N ILE A 52 -7.233 12.807 7.522 1.00 2.33 N ATOM 770 CA ILE A 52 -6.861 14.191 7.745 1.00 2.15 C ATOM 771 C ILE A 52 -6.912 14.499 9.230 1.00 2.40 C ATOM 772 O ILE A 52 -6.280 15.422 9.705 1.00 2.36 O ATOM 773 CB ILE A 52 -7.802 15.108 6.921 1.00 2.10 C ATOM 774 CG1 ILE A 52 -7.204 15.317 5.541 1.00 1.78 C ATOM 775 CG2 ILE A 52 -8.115 16.448 7.584 1.00 2.22 C ATOM 776 CD1 ILE A 52 -7.581 14.253 4.527 1.00 1.85 C ATOM 0 H ILE A 52 -8.160 12.697 7.112 1.00 2.33 H new ATOM 0 HA ILE A 52 -5.840 14.373 7.411 1.00 2.15 H new ATOM 0 HB ILE A 52 -8.762 14.597 6.853 1.00 2.10 H new ATOM 0 HG12 ILE A 52 -7.521 16.289 5.164 1.00 1.78 H new ATOM 0 HG13 ILE A 52 -6.118 15.348 5.630 1.00 1.78 H new ATOM 0 HG21 ILE A 52 -8.779 17.026 6.941 1.00 2.22 H new ATOM 0 HG22 ILE A 52 -8.601 16.274 8.544 1.00 2.22 H new ATOM 0 HG23 ILE A 52 -7.189 17.001 7.741 1.00 2.22 H new ATOM 0 HD11 ILE A 52 -7.111 14.480 3.570 1.00 1.85 H new ATOM 0 HD12 ILE A 52 -7.239 13.279 4.877 1.00 1.85 H new ATOM 0 HD13 ILE A 52 -8.664 14.235 4.404 1.00 1.85 H new ATOM 788 N ASN A 53 -7.665 13.684 9.946 1.00 2.72 N ATOM 789 CA ASN A 53 -7.809 13.817 11.379 1.00 3.03 C ATOM 790 C ASN A 53 -6.627 13.207 12.083 1.00 3.09 C ATOM 791 O ASN A 53 -6.441 13.330 13.291 1.00 3.36 O ATOM 792 CB ASN A 53 -9.116 13.155 11.819 1.00 3.37 C ATOM 793 CG ASN A 53 -9.513 13.463 13.256 1.00 3.66 C ATOM 794 OD1 ASN A 53 -10.217 14.437 13.522 1.00 3.89 O ATOM 795 ND2 ASN A 53 -9.059 12.631 14.186 1.00 3.98 N ATOM 0 H ASN A 53 -8.195 12.909 9.546 1.00 2.72 H new ATOM 0 HA ASN A 53 -7.844 14.873 11.646 1.00 3.03 H new ATOM 0 HB2 ASN A 53 -9.917 13.479 11.154 1.00 3.37 H new ATOM 0 HB3 ASN A 53 -9.022 12.075 11.702 1.00 3.37 H new ATOM 0 HD21 ASN A 53 -9.291 12.787 15.167 1.00 3.98 H new ATOM 0 HD22 ASN A 53 -8.478 11.836 13.919 1.00 3.98 H new ATOM 802 N GLU A 54 -5.904 12.495 11.291 1.00 2.90 N ATOM 803 CA GLU A 54 -4.669 11.853 11.707 1.00 2.96 C ATOM 804 C GLU A 54 -3.486 12.805 11.523 1.00 2.77 C ATOM 805 O GLU A 54 -2.434 12.628 12.144 1.00 2.93 O ATOM 806 CB GLU A 54 -4.436 10.565 10.904 1.00 2.91 C ATOM 807 CG GLU A 54 -5.434 9.456 11.213 1.00 3.22 C ATOM 808 CD GLU A 54 -5.222 8.225 10.354 1.00 3.25 C ATOM 809 OE1 GLU A 54 -5.820 8.155 9.260 1.00 3.56 O ATOM 810 OE2 GLU A 54 -4.459 7.331 10.776 1.00 3.40 O ATOM 0 H GLU A 54 -6.144 12.329 10.314 1.00 2.90 H new ATOM 0 HA GLU A 54 -4.754 11.597 12.763 1.00 2.96 H new ATOM 0 HB2 GLU A 54 -4.484 10.798 9.840 1.00 2.91 H new ATOM 0 HB3 GLU A 54 -3.429 10.200 11.105 1.00 2.91 H new ATOM 0 HG2 GLU A 54 -5.351 9.180 12.264 1.00 3.22 H new ATOM 0 HG3 GLU A 54 -6.446 9.831 11.061 1.00 3.22 H new ATOM 817 N VAL A 55 -3.681 13.812 10.664 1.00 2.49 N ATOM 818 CA VAL A 55 -2.636 14.795 10.369 1.00 2.36 C ATOM 819 C VAL A 55 -3.085 16.247 10.543 1.00 2.40 C ATOM 820 O VAL A 55 -2.243 17.125 10.768 1.00 2.49 O ATOM 821 CB VAL A 55 -2.043 14.545 8.945 1.00 1.99 C ATOM 822 CG1 VAL A 55 -1.253 15.739 8.400 1.00 2.37 C ATOM 823 CG2 VAL A 55 -1.164 13.302 8.958 1.00 2.07 C ATOM 0 H VAL A 55 -4.555 13.966 10.161 1.00 2.49 H new ATOM 0 HA VAL A 55 -1.853 14.648 11.113 1.00 2.36 H new ATOM 0 HB VAL A 55 -2.890 14.399 8.275 1.00 1.99 H new ATOM 0 HG11 VAL A 55 -0.869 15.499 7.409 1.00 2.37 H new ATOM 0 HG12 VAL A 55 -1.907 16.609 8.335 1.00 2.37 H new ATOM 0 HG13 VAL A 55 -0.420 15.960 9.068 1.00 2.37 H new ATOM 0 HG21 VAL A 55 -0.755 13.135 7.962 1.00 2.07 H new ATOM 0 HG22 VAL A 55 -0.348 13.441 9.667 1.00 2.07 H new ATOM 0 HG23 VAL A 55 -1.759 12.439 9.255 1.00 2.07 H new ATOM 833 N ALA A 56 -4.381 16.505 10.479 1.00 2.43 N ATOM 834 CA ALA A 56 -4.868 17.871 10.605 1.00 2.53 C ATOM 835 C ALA A 56 -5.492 18.037 11.979 1.00 2.90 C ATOM 836 O ALA A 56 -6.231 18.990 12.255 1.00 3.05 O ATOM 837 CB ALA A 56 -5.838 18.183 9.478 1.00 2.36 C ATOM 0 H ALA A 56 -5.106 15.800 10.343 1.00 2.43 H new ATOM 0 HA ALA A 56 -4.049 18.585 10.517 1.00 2.53 H new ATOM 0 HB1 ALA A 56 -6.197 19.207 9.580 1.00 2.36 H new ATOM 0 HB2 ALA A 56 -5.331 18.070 8.520 1.00 2.36 H new ATOM 0 HB3 ALA A 56 -6.683 17.496 9.524 1.00 2.36 H new ATOM 843 N ALA A 57 -5.142 17.077 12.840 1.00 3.08 N ATOM 844 CA ALA A 57 -5.615 17.028 14.209 1.00 3.45 C ATOM 845 C ALA A 57 -4.735 17.842 15.138 1.00 3.67 C ATOM 846 O ALA A 57 -3.508 17.831 15.025 1.00 3.69 O ATOM 847 CB ALA A 57 -5.715 15.590 14.685 1.00 3.64 C ATOM 0 H ALA A 57 -4.516 16.309 12.595 1.00 3.08 H new ATOM 0 HA ALA A 57 -6.610 17.474 14.231 1.00 3.45 H new ATOM 0 HB1 ALA A 57 -6.072 15.572 15.715 1.00 3.64 H new ATOM 0 HB2 ALA A 57 -6.412 15.044 14.050 1.00 3.64 H new ATOM 0 HB3 ALA A 57 -4.733 15.120 14.633 1.00 3.64 H new ATOM 886 N GLY A 61 -8.617 23.683 12.069 1.00 3.52 N ATOM 887 CA GLY A 61 -9.785 23.525 11.208 1.00 3.44 C ATOM 888 C GLY A 61 -9.440 23.111 9.782 1.00 3.11 C ATOM 889 O GLY A 61 -10.342 22.940 8.956 1.00 3.10 O ATOM 0 HA2 GLY A 61 -10.449 22.778 11.644 1.00 3.44 H new ATOM 0 HA3 GLY A 61 -10.336 24.465 11.181 1.00 3.44 H new ATOM 893 N THR A 62 -8.140 22.952 9.494 1.00 2.91 N ATOM 894 CA THR A 62 -7.679 22.550 8.161 1.00 2.61 C ATOM 895 C THR A 62 -6.483 21.588 8.242 1.00 2.41 C ATOM 896 O THR A 62 -6.065 21.187 9.332 1.00 2.55 O ATOM 897 CB THR A 62 -7.325 23.767 7.271 1.00 2.62 C ATOM 898 OG1 THR A 62 -6.538 24.708 8.007 1.00 2.84 O ATOM 899 CG2 THR A 62 -8.584 24.447 6.743 1.00 2.75 C ATOM 0 H THR A 62 -7.389 23.097 10.169 1.00 2.91 H new ATOM 0 HA THR A 62 -8.514 22.027 7.695 1.00 2.61 H new ATOM 0 HB THR A 62 -6.748 23.403 6.421 1.00 2.62 H new ATOM 0 HG1 THR A 62 -5.889 25.132 7.407 1.00 2.84 H new ATOM 0 HG21 THR A 62 -8.305 25.298 6.122 1.00 2.75 H new ATOM 0 HG22 THR A 62 -9.159 23.737 6.149 1.00 2.75 H new ATOM 0 HG23 THR A 62 -9.189 24.793 7.581 1.00 2.75 H new ATOM 907 N ILE A 63 -5.941 21.247 7.068 1.00 2.14 N ATOM 908 CA ILE A 63 -4.839 20.308 6.914 1.00 1.93 C ATOM 909 C ILE A 63 -3.546 21.003 6.592 1.00 1.95 C ATOM 910 O ILE A 63 -3.514 21.864 5.736 1.00 1.99 O ATOM 911 CB ILE A 63 -4.976 19.396 5.686 1.00 1.63 C ATOM 912 CG1 ILE A 63 -6.231 19.685 4.837 1.00 1.70 C ATOM 913 CG2 ILE A 63 -4.829 17.898 5.984 1.00 1.51 C ATOM 914 CD1 ILE A 63 -7.533 19.185 5.421 1.00 1.95 C ATOM 0 H ILE A 63 -6.269 21.629 6.181 1.00 2.14 H new ATOM 0 HA ILE A 63 -4.854 19.772 7.863 1.00 1.93 H new ATOM 0 HB ILE A 63 -4.113 19.664 5.077 1.00 1.63 H new ATOM 0 HG12 ILE A 63 -6.308 20.762 4.687 1.00 1.70 H new ATOM 0 HG13 ILE A 63 -6.096 19.235 3.853 1.00 1.70 H new ATOM 0 HG21 ILE A 63 -4.940 17.331 5.060 1.00 1.51 H new ATOM 0 HG22 ILE A 63 -3.845 17.707 6.411 1.00 1.51 H new ATOM 0 HG23 ILE A 63 -5.598 17.591 6.693 1.00 1.51 H new ATOM 0 HD11 ILE A 63 -8.354 19.437 4.750 1.00 1.95 H new ATOM 0 HD12 ILE A 63 -7.485 18.103 5.544 1.00 1.95 H new ATOM 0 HD13 ILE A 63 -7.700 19.654 6.391 1.00 1.95 H new ATOM 926 N ASP A 64 -2.481 20.539 7.193 1.00 2.01 N ATOM 927 CA ASP A 64 -1.157 21.052 6.921 1.00 2.12 C ATOM 928 C ASP A 64 -0.458 20.111 5.929 1.00 1.86 C ATOM 929 O ASP A 64 -0.843 18.944 5.816 1.00 1.62 O ATOM 930 CB ASP A 64 -0.318 21.245 8.193 1.00 2.46 C ATOM 931 CG ASP A 64 -0.300 20.034 9.119 1.00 2.46 C ATOM 932 OD1 ASP A 64 0.594 19.177 8.958 1.00 2.68 O ATOM 933 OD2 ASP A 64 -1.180 19.948 10.001 1.00 2.74 O ATOM 0 H ASP A 64 -2.504 19.792 7.888 1.00 2.01 H new ATOM 0 HA ASP A 64 -1.258 22.045 6.484 1.00 2.12 H new ATOM 0 HB2 ASP A 64 0.706 21.485 7.907 1.00 2.46 H new ATOM 0 HB3 ASP A 64 -0.704 22.103 8.743 1.00 2.46 H new ATOM 938 N PHE A 65 0.564 20.606 5.227 1.00 1.97 N ATOM 939 CA PHE A 65 1.258 19.811 4.202 1.00 1.80 C ATOM 940 C PHE A 65 2.249 18.743 4.760 1.00 1.83 C ATOM 941 O PHE A 65 2.186 17.594 4.319 1.00 1.60 O ATOM 942 CB PHE A 65 2.006 20.739 3.226 1.00 2.04 C ATOM 943 CG PHE A 65 2.444 20.070 1.939 1.00 1.95 C ATOM 944 CD1 PHE A 65 3.784 19.863 1.656 1.00 2.40 C ATOM 945 CD2 PHE A 65 1.503 19.653 1.019 1.00 2.11 C ATOM 946 CE1 PHE A 65 4.165 19.252 0.474 1.00 2.45 C ATOM 947 CE2 PHE A 65 1.864 19.047 -0.160 1.00 2.08 C ATOM 948 CZ PHE A 65 3.202 18.846 -0.434 1.00 1.96 C ATOM 0 H PHE A 65 0.931 21.550 5.346 1.00 1.97 H new ATOM 0 HA PHE A 65 0.471 19.255 3.692 1.00 1.80 H new ATOM 0 HB2 PHE A 65 1.362 21.584 2.981 1.00 2.04 H new ATOM 0 HB3 PHE A 65 2.885 21.143 3.729 1.00 2.04 H new ATOM 0 HD1 PHE A 65 4.537 20.181 2.362 1.00 2.40 H new ATOM 0 HD2 PHE A 65 0.455 19.807 1.232 1.00 2.11 H new ATOM 0 HE1 PHE A 65 5.212 19.092 0.260 1.00 2.45 H new ATOM 0 HE2 PHE A 65 1.109 18.731 -0.865 1.00 2.08 H new ATOM 0 HZ PHE A 65 3.498 18.371 -1.358 1.00 1.96 H new ATOM 958 N PRO A 66 3.174 19.094 5.725 1.00 2.16 N ATOM 959 CA PRO A 66 4.217 18.176 6.271 1.00 2.30 C ATOM 960 C PRO A 66 3.828 16.689 6.465 1.00 2.09 C ATOM 961 O PRO A 66 4.486 15.814 5.899 1.00 2.04 O ATOM 962 CB PRO A 66 4.584 18.816 7.629 1.00 2.67 C ATOM 963 CG PRO A 66 3.724 20.033 7.770 1.00 2.78 C ATOM 964 CD PRO A 66 3.306 20.410 6.381 1.00 2.48 C ATOM 0 HA PRO A 66 5.027 18.097 5.546 1.00 2.30 H new ATOM 0 HB2 PRO A 66 4.407 18.118 8.447 1.00 2.67 H new ATOM 0 HB3 PRO A 66 5.641 19.082 7.660 1.00 2.67 H new ATOM 0 HG2 PRO A 66 2.856 19.826 8.396 1.00 2.78 H new ATOM 0 HG3 PRO A 66 4.273 20.845 8.246 1.00 2.78 H new ATOM 0 HD2 PRO A 66 2.367 20.964 6.375 1.00 2.48 H new ATOM 0 HD3 PRO A 66 4.049 21.037 5.889 1.00 2.48 H new ATOM 972 N GLU A 67 2.799 16.401 7.272 1.00 2.04 N ATOM 973 CA GLU A 67 2.386 15.016 7.528 1.00 1.95 C ATOM 974 C GLU A 67 1.331 14.486 6.575 1.00 1.60 C ATOM 975 O GLU A 67 1.066 13.283 6.525 1.00 1.59 O ATOM 976 CB GLU A 67 1.993 14.801 8.996 1.00 2.24 C ATOM 977 CG GLU A 67 3.169 14.810 9.969 1.00 2.61 C ATOM 978 CD GLU A 67 3.648 16.211 10.312 1.00 3.15 C ATOM 979 OE1 GLU A 67 4.696 16.627 9.776 1.00 3.47 O ATOM 980 OE2 GLU A 67 2.973 16.888 11.116 1.00 3.66 O ATOM 0 H GLU A 67 2.240 17.104 7.756 1.00 2.04 H new ATOM 0 HA GLU A 67 3.272 14.415 7.324 1.00 1.95 H new ATOM 0 HB2 GLU A 67 1.288 15.579 9.289 1.00 2.24 H new ATOM 0 HB3 GLU A 67 1.471 13.848 9.084 1.00 2.24 H new ATOM 0 HG2 GLU A 67 2.878 14.297 10.886 1.00 2.61 H new ATOM 0 HG3 GLU A 67 3.995 14.246 9.536 1.00 2.61 H new ATOM 987 N PHE A 68 0.740 15.392 5.838 1.00 1.40 N ATOM 988 CA PHE A 68 -0.311 15.062 4.855 1.00 1.10 C ATOM 989 C PHE A 68 0.256 14.126 3.758 1.00 0.99 C ATOM 990 O PHE A 68 -0.489 13.337 3.175 1.00 0.94 O ATOM 991 CB PHE A 68 -0.934 16.374 4.312 1.00 1.04 C ATOM 992 CG PHE A 68 -1.734 16.307 3.029 1.00 0.89 C ATOM 993 CD1 PHE A 68 -3.055 15.867 3.015 1.00 1.36 C ATOM 994 CD2 PHE A 68 -1.181 16.777 1.847 1.00 1.60 C ATOM 995 CE1 PHE A 68 -3.788 15.903 1.858 1.00 1.57 C ATOM 996 CE2 PHE A 68 -1.916 16.795 0.676 1.00 1.57 C ATOM 997 CZ PHE A 68 -3.225 16.363 0.680 1.00 1.15 C ATOM 0 H PHE A 68 0.960 16.387 5.888 1.00 1.40 H new ATOM 0 HA PHE A 68 -1.121 14.504 5.325 1.00 1.10 H new ATOM 0 HB2 PHE A 68 -1.582 16.781 5.088 1.00 1.04 H new ATOM 0 HB3 PHE A 68 -0.126 17.090 4.164 1.00 1.04 H new ATOM 0 HD1 PHE A 68 -3.505 15.494 3.923 1.00 1.36 H new ATOM 0 HD2 PHE A 68 -0.162 17.134 1.841 1.00 1.60 H new ATOM 0 HE1 PHE A 68 -4.815 15.569 1.865 1.00 1.57 H new ATOM 0 HE2 PHE A 68 -1.465 17.147 -0.240 1.00 1.57 H new ATOM 0 HZ PHE A 68 -3.807 16.383 -0.229 1.00 1.15 H new ATOM 1007 N LEU A 69 1.580 14.230 3.491 1.00 1.15 N ATOM 1008 CA LEU A 69 2.261 13.349 2.516 1.00 1.24 C ATOM 1009 C LEU A 69 2.648 12.014 3.148 1.00 1.42 C ATOM 1010 O LEU A 69 2.633 10.977 2.480 1.00 1.53 O ATOM 1011 CB LEU A 69 3.530 13.965 1.913 1.00 1.51 C ATOM 1012 CG LEU A 69 3.585 15.481 1.818 1.00 1.59 C ATOM 1013 CD1 LEU A 69 4.416 16.019 2.952 1.00 1.82 C ATOM 1014 CD2 LEU A 69 4.181 15.901 0.495 1.00 1.76 C ATOM 0 H LEU A 69 2.194 14.912 3.936 1.00 1.15 H new ATOM 0 HA LEU A 69 1.532 13.205 1.718 1.00 1.24 H new ATOM 0 HB2 LEU A 69 4.382 13.632 2.505 1.00 1.51 H new ATOM 0 HB3 LEU A 69 3.660 13.558 0.910 1.00 1.51 H new ATOM 0 HG LEU A 69 2.574 15.883 1.885 1.00 1.59 H new ATOM 0 HD11 LEU A 69 4.458 17.106 2.888 1.00 1.82 H new ATOM 0 HD12 LEU A 69 3.967 15.729 3.902 1.00 1.82 H new ATOM 0 HD13 LEU A 69 5.425 15.612 2.888 1.00 1.82 H new ATOM 0 HD21 LEU A 69 4.215 16.989 0.440 1.00 1.76 H new ATOM 0 HD22 LEU A 69 5.192 15.502 0.408 1.00 1.76 H new ATOM 0 HD23 LEU A 69 3.567 15.515 -0.319 1.00 1.76 H new ATOM 1026 N THR A 70 3.016 12.052 4.440 1.00 1.58 N ATOM 1027 CA THR A 70 3.426 10.836 5.174 1.00 1.88 C ATOM 1028 C THR A 70 2.256 9.862 5.319 1.00 1.87 C ATOM 1029 O THR A 70 2.441 8.642 5.292 1.00 2.04 O ATOM 1030 CB THR A 70 4.006 11.153 6.571 1.00 2.19 C ATOM 1031 OG1 THR A 70 3.130 12.023 7.292 1.00 2.14 O ATOM 1032 CG2 THR A 70 5.385 11.790 6.462 1.00 2.80 C ATOM 0 H THR A 70 3.039 12.906 4.998 1.00 1.58 H new ATOM 0 HA THR A 70 4.215 10.374 4.580 1.00 1.88 H new ATOM 0 HB THR A 70 4.101 10.211 7.111 1.00 2.19 H new ATOM 0 HG1 THR A 70 2.341 12.220 6.745 1.00 2.14 H new ATOM 0 HG21 THR A 70 5.768 12.002 7.460 1.00 2.80 H new ATOM 0 HG22 THR A 70 6.063 11.106 5.951 1.00 2.80 H new ATOM 0 HG23 THR A 70 5.313 12.719 5.896 1.00 2.80 H new ATOM 1040 N MET A 71 1.056 10.430 5.472 1.00 1.77 N ATOM 1041 CA MET A 71 -0.187 9.659 5.583 1.00 1.91 C ATOM 1042 C MET A 71 -0.702 9.250 4.189 1.00 1.83 C ATOM 1043 O MET A 71 -1.470 8.294 4.057 1.00 2.06 O ATOM 1044 CB MET A 71 -1.253 10.458 6.361 1.00 2.01 C ATOM 1045 CG MET A 71 -1.515 11.865 5.827 1.00 2.31 C ATOM 1046 SD MET A 71 -2.639 11.869 4.429 1.00 2.07 S ATOM 1047 CE MET A 71 -4.195 12.059 5.285 1.00 1.57 C ATOM 0 H MET A 71 0.918 11.439 5.523 1.00 1.77 H new ATOM 0 HA MET A 71 0.021 8.746 6.141 1.00 1.91 H new ATOM 0 HB2 MET A 71 -2.189 9.899 6.346 1.00 2.01 H new ATOM 0 HB3 MET A 71 -0.942 10.532 7.403 1.00 2.01 H new ATOM 0 HG2 MET A 71 -1.929 12.482 6.624 1.00 2.31 H new ATOM 0 HG3 MET A 71 -0.570 12.320 5.531 1.00 2.31 H new ATOM 0 HE1 MET A 71 -5.016 11.921 4.582 1.00 1.57 H new ATOM 0 HE2 MET A 71 -4.267 11.315 6.078 1.00 1.57 H new ATOM 0 HE3 MET A 71 -4.252 13.057 5.719 1.00 1.57 H new ATOM 1057 N MET A 72 -0.262 10.007 3.158 1.00 1.61 N ATOM 1058 CA MET A 72 -0.631 9.775 1.748 1.00 1.69 C ATOM 1059 C MET A 72 -0.389 8.324 1.305 1.00 1.97 C ATOM 1060 O MET A 72 -1.203 7.752 0.574 1.00 2.17 O ATOM 1061 CB MET A 72 0.166 10.728 0.847 1.00 1.60 C ATOM 1062 CG MET A 72 -0.588 11.989 0.464 1.00 1.46 C ATOM 1063 SD MET A 72 -1.854 11.694 -0.781 1.00 1.69 S ATOM 1064 CE MET A 72 -2.307 13.379 -1.180 1.00 1.53 C ATOM 0 H MET A 72 0.364 10.802 3.285 1.00 1.61 H new ATOM 0 HA MET A 72 -1.700 9.967 1.656 1.00 1.69 H new ATOM 0 HB2 MET A 72 1.088 11.009 1.357 1.00 1.60 H new ATOM 0 HB3 MET A 72 0.453 10.198 -0.061 1.00 1.60 H new ATOM 0 HG2 MET A 72 -1.052 12.414 1.354 1.00 1.46 H new ATOM 0 HG3 MET A 72 0.118 12.729 0.089 1.00 1.46 H new ATOM 0 HE1 MET A 72 -2.669 13.425 -2.207 1.00 1.53 H new ATOM 0 HE2 MET A 72 -3.093 13.715 -0.503 1.00 1.53 H new ATOM 0 HE3 MET A 72 -1.436 14.025 -1.073 1.00 1.53 H new ATOM 1207 N SER A 81 -4.103 -4.386 -0.626 1.00 3.49 N ATOM 1208 CA SER A 81 -3.989 -5.651 0.094 1.00 3.36 C ATOM 1209 C SER A 81 -3.194 -6.681 -0.714 1.00 2.88 C ATOM 1210 O SER A 81 -2.163 -7.188 -0.265 1.00 2.79 O ATOM 1211 CB SER A 81 -5.380 -6.190 0.459 1.00 3.71 C ATOM 1212 OG SER A 81 -6.200 -6.315 -0.690 1.00 4.35 O ATOM 0 HA SER A 81 -3.441 -5.466 1.018 1.00 3.36 H new ATOM 0 HB2 SER A 81 -5.281 -7.161 0.945 1.00 3.71 H new ATOM 0 HB3 SER A 81 -5.855 -5.521 1.177 1.00 3.71 H new ATOM 0 HG SER A 81 -7.079 -6.661 -0.429 1.00 4.35 H new ATOM 1218 N GLU A 82 -3.708 -6.967 -1.907 1.00 2.97 N ATOM 1219 CA GLU A 82 -3.102 -7.921 -2.855 1.00 3.25 C ATOM 1220 C GLU A 82 -2.022 -7.256 -3.700 1.00 3.85 C ATOM 1221 O GLU A 82 -1.145 -7.915 -4.250 1.00 4.27 O ATOM 1222 CB GLU A 82 -4.174 -8.490 -3.777 1.00 3.94 C ATOM 1223 CG GLU A 82 -5.138 -9.452 -3.096 1.00 4.12 C ATOM 1224 CD GLU A 82 -6.191 -9.992 -4.044 1.00 4.93 C ATOM 1225 OE1 GLU A 82 -5.942 -11.043 -4.671 1.00 5.51 O ATOM 1226 OE2 GLU A 82 -7.264 -9.363 -4.159 1.00 5.25 O ATOM 0 H GLU A 82 -4.568 -6.542 -2.255 1.00 2.97 H new ATOM 0 HA GLU A 82 -2.645 -8.721 -2.273 1.00 3.25 H new ATOM 0 HB2 GLU A 82 -4.744 -7.665 -4.205 1.00 3.94 H new ATOM 0 HB3 GLU A 82 -3.688 -9.006 -4.605 1.00 3.94 H new ATOM 0 HG2 GLU A 82 -4.576 -10.284 -2.672 1.00 4.12 H new ATOM 0 HG3 GLU A 82 -5.628 -8.942 -2.267 1.00 4.12 H new ATOM 1233 N GLU A 83 -2.136 -5.946 -3.834 1.00 4.18 N ATOM 1234 CA GLU A 83 -1.166 -5.138 -4.588 1.00 5.12 C ATOM 1235 C GLU A 83 0.210 -5.125 -3.899 1.00 5.33 C ATOM 1236 O GLU A 83 1.230 -4.858 -4.542 1.00 6.21 O ATOM 1237 CB GLU A 83 -1.683 -3.707 -4.765 1.00 5.53 C ATOM 1238 CG GLU A 83 -2.781 -3.581 -5.812 1.00 5.74 C ATOM 1239 CD GLU A 83 -3.276 -2.157 -5.972 1.00 6.48 C ATOM 1240 OE1 GLU A 83 -4.230 -1.777 -5.261 1.00 6.88 O ATOM 1241 OE2 GLU A 83 -2.710 -1.422 -6.808 1.00 6.89 O ATOM 0 H GLU A 83 -2.899 -5.404 -3.428 1.00 4.18 H new ATOM 0 HA GLU A 83 -1.046 -5.595 -5.570 1.00 5.12 H new ATOM 0 HB2 GLU A 83 -2.061 -3.345 -3.809 1.00 5.53 H new ATOM 0 HB3 GLU A 83 -0.851 -3.061 -5.044 1.00 5.53 H new ATOM 0 HG2 GLU A 83 -2.407 -3.941 -6.770 1.00 5.74 H new ATOM 0 HG3 GLU A 83 -3.617 -4.223 -5.535 1.00 5.74 H new ATOM 1248 N GLU A 84 0.214 -5.416 -2.587 1.00 4.72 N ATOM 1249 CA GLU A 84 1.440 -5.437 -1.779 1.00 5.16 C ATOM 1250 C GLU A 84 2.208 -6.768 -1.869 1.00 4.87 C ATOM 1251 O GLU A 84 3.435 -6.764 -1.756 1.00 5.53 O ATOM 1252 CB GLU A 84 1.114 -5.129 -0.317 1.00 5.11 C ATOM 1253 CG GLU A 84 0.908 -3.650 -0.032 1.00 5.77 C ATOM 1254 CD GLU A 84 0.812 -3.350 1.451 1.00 6.38 C ATOM 1255 OE1 GLU A 84 -0.301 -3.455 2.008 1.00 6.86 O ATOM 1256 OE2 GLU A 84 1.850 -3.010 2.056 1.00 6.68 O ATOM 0 H GLU A 84 -0.630 -5.642 -2.061 1.00 4.72 H new ATOM 0 HA GLU A 84 2.092 -4.667 -2.191 1.00 5.16 H new ATOM 0 HB2 GLU A 84 0.213 -5.673 -0.033 1.00 5.11 H new ATOM 0 HB3 GLU A 84 1.923 -5.501 0.312 1.00 5.11 H new ATOM 0 HG2 GLU A 84 1.734 -3.083 -0.461 1.00 5.77 H new ATOM 0 HG3 GLU A 84 -0.002 -3.312 -0.527 1.00 5.77 H new ATOM 1263 N ILE A 85 1.495 -7.904 -2.061 1.00 3.98 N ATOM 1264 CA ILE A 85 2.144 -9.238 -2.158 1.00 3.69 C ATOM 1265 C ILE A 85 3.169 -9.306 -3.259 1.00 4.63 C ATOM 1266 O ILE A 85 4.352 -9.506 -2.981 1.00 5.03 O ATOM 1267 CB ILE A 85 1.150 -10.430 -2.253 1.00 2.77 C ATOM 1268 CG1 ILE A 85 -0.082 -10.125 -3.111 1.00 3.16 C ATOM 1269 CG2 ILE A 85 0.732 -10.840 -0.858 1.00 1.99 C ATOM 1270 CD1 ILE A 85 -0.024 -10.735 -4.493 1.00 3.97 C ATOM 0 H ILE A 85 0.479 -7.926 -2.151 1.00 3.98 H new ATOM 0 HA ILE A 85 2.662 -9.350 -1.205 1.00 3.69 H new ATOM 0 HB ILE A 85 1.670 -11.248 -2.751 1.00 2.77 H new ATOM 0 HG12 ILE A 85 -0.971 -10.492 -2.598 1.00 3.16 H new ATOM 0 HG13 ILE A 85 -0.191 -9.044 -3.204 1.00 3.16 H new ATOM 0 HG21 ILE A 85 0.035 -11.676 -0.918 1.00 1.99 H new ATOM 0 HG22 ILE A 85 1.611 -11.141 -0.288 1.00 1.99 H new ATOM 0 HG23 ILE A 85 0.248 -9.999 -0.361 1.00 1.99 H new ATOM 0 HD11 ILE A 85 -0.929 -10.477 -5.043 1.00 3.97 H new ATOM 0 HD12 ILE A 85 0.846 -10.349 -5.025 1.00 3.97 H new ATOM 0 HD13 ILE A 85 0.053 -11.819 -4.409 1.00 3.97 H new ATOM 1282 N ARG A 86 2.737 -9.085 -4.486 1.00 5.19 N ATOM 1283 CA ARG A 86 3.652 -9.080 -5.635 1.00 6.32 C ATOM 1284 C ARG A 86 4.790 -8.103 -5.410 1.00 7.11 C ATOM 1285 O ARG A 86 5.851 -8.204 -6.034 1.00 7.98 O ATOM 1286 CB ARG A 86 2.943 -8.627 -6.889 1.00 6.99 C ATOM 1287 CG ARG A 86 2.608 -9.760 -7.845 1.00 7.36 C ATOM 1288 CD ARG A 86 1.875 -9.255 -9.077 1.00 8.25 C ATOM 1289 NE ARG A 86 1.554 -10.341 -10.010 1.00 8.76 N ATOM 1290 CZ ARG A 86 1.026 -10.168 -11.231 1.00 9.65 C ATOM 1291 NH1 ARG A 86 0.746 -8.951 -11.695 1.00 10.08 N ATOM 1292 NH2 ARG A 86 0.777 -11.225 -11.992 1.00 10.26 N ATOM 0 H ARG A 86 1.761 -8.906 -4.723 1.00 5.19 H new ATOM 0 HA ARG A 86 4.023 -10.099 -5.744 1.00 6.32 H new ATOM 0 HB2 ARG A 86 2.022 -8.115 -6.610 1.00 6.99 H new ATOM 0 HB3 ARG A 86 3.568 -7.900 -7.407 1.00 6.99 H new ATOM 0 HG2 ARG A 86 3.526 -10.264 -8.148 1.00 7.36 H new ATOM 0 HG3 ARG A 86 1.993 -10.499 -7.332 1.00 7.36 H new ATOM 0 HD2 ARG A 86 0.955 -8.755 -8.772 1.00 8.25 H new ATOM 0 HD3 ARG A 86 2.489 -8.511 -9.584 1.00 8.25 H new ATOM 0 HE ARG A 86 1.746 -11.296 -9.708 1.00 8.76 H new ATOM 0 HH11 ARG A 86 0.933 -8.130 -11.119 1.00 10.08 H new ATOM 0 HH12 ARG A 86 0.345 -8.840 -12.626 1.00 10.08 H new ATOM 0 HH21 ARG A 86 0.987 -12.162 -11.648 1.00 10.26 H new ATOM 0 HH22 ARG A 86 0.376 -11.101 -12.921 1.00 10.26 H new ATOM 1306 N GLU A 87 4.541 -7.157 -4.500 1.00 6.95 N ATOM 1307 CA GLU A 87 5.505 -6.121 -4.208 1.00 7.91 C ATOM 1308 C GLU A 87 6.520 -6.578 -3.151 1.00 7.97 C ATOM 1309 O GLU A 87 7.691 -6.189 -3.178 1.00 8.94 O ATOM 1310 CB GLU A 87 4.794 -4.835 -3.757 1.00 8.02 C ATOM 1311 CG GLU A 87 5.535 -3.547 -4.112 1.00 8.75 C ATOM 1312 CD GLU A 87 5.350 -3.135 -5.563 1.00 9.11 C ATOM 1313 OE1 GLU A 87 6.161 -3.565 -6.410 1.00 9.62 O ATOM 1314 OE2 GLU A 87 4.393 -2.385 -5.850 1.00 9.05 O ATOM 0 H GLU A 87 3.678 -7.097 -3.960 1.00 6.95 H new ATOM 0 HA GLU A 87 6.056 -5.912 -5.125 1.00 7.91 H new ATOM 0 HB2 GLU A 87 3.802 -4.805 -4.208 1.00 8.02 H new ATOM 0 HB3 GLU A 87 4.652 -4.872 -2.677 1.00 8.02 H new ATOM 0 HG2 GLU A 87 5.185 -2.743 -3.465 1.00 8.75 H new ATOM 0 HG3 GLU A 87 6.598 -3.679 -3.910 1.00 8.75 H new ATOM 1321 N ALA A 88 6.028 -7.414 -2.231 1.00 7.00 N ATOM 1322 CA ALA A 88 6.816 -7.959 -1.116 1.00 7.06 C ATOM 1323 C ALA A 88 7.700 -9.117 -1.550 1.00 7.01 C ATOM 1324 O ALA A 88 8.863 -9.178 -1.194 1.00 7.73 O ATOM 1325 CB ALA A 88 5.895 -8.426 -0.015 1.00 6.21 C ATOM 0 H ALA A 88 5.060 -7.736 -2.238 1.00 7.00 H new ATOM 0 HA ALA A 88 7.462 -7.158 -0.756 1.00 7.06 H new ATOM 0 HB1 ALA A 88 6.486 -8.829 0.808 1.00 6.21 H new ATOM 0 HB2 ALA A 88 5.300 -7.586 0.343 1.00 6.21 H new ATOM 0 HB3 ALA A 88 5.233 -9.202 -0.399 1.00 6.21 H new ATOM 1331 N PHE A 89 7.108 -10.065 -2.271 1.00 6.21 N ATOM 1332 CA PHE A 89 7.810 -11.234 -2.818 1.00 6.21 C ATOM 1333 C PHE A 89 9.182 -10.926 -3.445 1.00 7.49 C ATOM 1334 O PHE A 89 9.992 -11.832 -3.636 1.00 7.70 O ATOM 1335 CB PHE A 89 6.878 -11.915 -3.803 1.00 5.56 C ATOM 1336 CG PHE A 89 5.847 -12.715 -3.087 1.00 4.24 C ATOM 1337 CD1 PHE A 89 6.021 -14.068 -2.937 1.00 3.84 C ATOM 1338 CD2 PHE A 89 4.725 -12.112 -2.520 1.00 3.79 C ATOM 1339 CE1 PHE A 89 5.112 -14.808 -2.255 1.00 2.77 C ATOM 1340 CE2 PHE A 89 3.810 -12.851 -1.843 1.00 2.72 C ATOM 1341 CZ PHE A 89 4.006 -14.209 -1.712 1.00 1.93 C ATOM 0 H PHE A 89 6.114 -10.047 -2.498 1.00 6.21 H new ATOM 0 HA PHE A 89 8.054 -11.897 -1.988 1.00 6.21 H new ATOM 0 HB2 PHE A 89 6.394 -11.166 -4.430 1.00 5.56 H new ATOM 0 HB3 PHE A 89 7.452 -12.563 -4.466 1.00 5.56 H new ATOM 0 HD1 PHE A 89 6.889 -14.547 -3.366 1.00 3.84 H new ATOM 0 HD2 PHE A 89 4.583 -11.046 -2.621 1.00 3.79 H new ATOM 0 HE1 PHE A 89 5.260 -15.872 -2.140 1.00 2.77 H new ATOM 0 HE2 PHE A 89 2.939 -12.381 -1.412 1.00 2.72 H new ATOM 0 HZ PHE A 89 3.282 -14.806 -1.177 1.00 1.93 H new ATOM 1351 N ARG A 90 9.436 -9.650 -3.764 1.00 8.36 N ATOM 1352 CA ARG A 90 10.730 -9.226 -4.307 1.00 9.63 C ATOM 1353 C ARG A 90 11.802 -9.186 -3.195 1.00 10.20 C ATOM 1354 O ARG A 90 12.992 -9.019 -3.479 1.00 11.20 O ATOM 1355 CB ARG A 90 10.610 -7.848 -4.970 1.00 10.38 C ATOM 1356 CG ARG A 90 9.865 -7.866 -6.299 1.00 10.73 C ATOM 1357 CD ARG A 90 9.799 -6.482 -6.930 1.00 11.51 C ATOM 1358 NE ARG A 90 11.088 -6.066 -7.498 1.00 12.01 N ATOM 1359 CZ ARG A 90 11.277 -4.962 -8.237 1.00 12.77 C ATOM 1360 NH1 ARG A 90 10.269 -4.137 -8.514 1.00 13.10 N ATOM 1361 NH2 ARG A 90 12.488 -4.684 -8.700 1.00 13.29 N ATOM 0 H ARG A 90 8.760 -8.894 -3.655 1.00 8.36 H new ATOM 0 HA ARG A 90 11.036 -9.953 -5.060 1.00 9.63 H new ATOM 0 HB2 ARG A 90 10.098 -7.170 -4.287 1.00 10.38 H new ATOM 0 HB3 ARG A 90 11.610 -7.444 -5.130 1.00 10.38 H new ATOM 0 HG2 ARG A 90 10.360 -8.554 -6.984 1.00 10.73 H new ATOM 0 HG3 ARG A 90 8.854 -8.243 -6.144 1.00 10.73 H new ATOM 0 HD2 ARG A 90 9.041 -6.478 -7.713 1.00 11.51 H new ATOM 0 HD3 ARG A 90 9.485 -5.757 -6.179 1.00 11.51 H new ATOM 0 HE ARG A 90 11.898 -6.659 -7.318 1.00 12.01 H new ATOM 0 HH11 ARG A 90 9.333 -4.339 -8.163 1.00 13.10 H new ATOM 0 HH12 ARG A 90 10.433 -3.303 -9.077 1.00 13.10 H new ATOM 0 HH21 ARG A 90 13.268 -5.308 -8.494 1.00 13.29 H new ATOM 0 HH22 ARG A 90 12.639 -3.847 -9.262 1.00 13.29 H new ATOM 1375 N VAL A 91 11.358 -9.346 -1.928 1.00 9.66 N ATOM 1376 CA VAL A 91 12.227 -9.341 -0.774 1.00 10.29 C ATOM 1377 C VAL A 91 12.574 -10.760 -0.332 1.00 9.81 C ATOM 1378 O VAL A 91 13.744 -11.094 -0.129 1.00 10.52 O ATOM 1379 CB VAL A 91 11.597 -8.635 0.447 1.00 10.33 C ATOM 1380 CG1 VAL A 91 12.634 -7.826 1.216 1.00 11.64 C ATOM 1381 CG2 VAL A 91 10.397 -7.771 0.094 1.00 9.85 C ATOM 0 H VAL A 91 10.374 -9.482 -1.697 1.00 9.66 H new ATOM 0 HA VAL A 91 13.117 -8.799 -1.094 1.00 10.29 H new ATOM 0 HB VAL A 91 11.225 -9.433 1.090 1.00 10.33 H new ATOM 0 HG11 VAL A 91 12.158 -7.342 2.069 1.00 11.64 H new ATOM 0 HG12 VAL A 91 13.424 -8.489 1.569 1.00 11.64 H new ATOM 0 HG13 VAL A 91 13.063 -7.068 0.561 1.00 11.64 H new ATOM 0 HG21 VAL A 91 10.005 -7.306 0.998 1.00 9.85 H new ATOM 0 HG22 VAL A 91 10.701 -6.996 -0.610 1.00 9.85 H new ATOM 0 HG23 VAL A 91 9.623 -8.391 -0.360 1.00 9.85 H new ATOM 1391 N PHE A 92 11.530 -11.578 -0.194 1.00 8.63 N ATOM 1392 CA PHE A 92 11.670 -12.958 0.287 1.00 8.08 C ATOM 1393 C PHE A 92 11.702 -13.998 -0.831 1.00 7.58 C ATOM 1394 O PHE A 92 12.335 -15.047 -0.680 1.00 7.57 O ATOM 1395 CB PHE A 92 10.482 -13.335 1.181 1.00 7.14 C ATOM 1396 CG PHE A 92 9.963 -12.268 2.113 1.00 7.60 C ATOM 1397 CD1 PHE A 92 9.061 -11.299 1.676 1.00 7.95 C ATOM 1398 CD2 PHE A 92 10.321 -12.287 3.449 1.00 7.88 C ATOM 1399 CE1 PHE A 92 8.540 -10.379 2.556 1.00 8.45 C ATOM 1400 CE2 PHE A 92 9.811 -11.358 4.329 1.00 8.39 C ATOM 1401 CZ PHE A 92 8.916 -10.404 3.885 1.00 8.62 C ATOM 0 H PHE A 92 10.570 -11.308 -0.410 1.00 8.63 H new ATOM 0 HA PHE A 92 12.620 -12.973 0.821 1.00 8.08 H new ATOM 0 HB2 PHE A 92 9.661 -13.652 0.538 1.00 7.14 H new ATOM 0 HB3 PHE A 92 10.769 -14.199 1.781 1.00 7.14 H new ATOM 0 HD1 PHE A 92 8.769 -11.270 0.637 1.00 7.95 H new ATOM 0 HD2 PHE A 92 11.009 -13.039 3.806 1.00 7.88 H new ATOM 0 HE1 PHE A 92 7.837 -9.637 2.208 1.00 8.45 H new ATOM 0 HE2 PHE A 92 10.111 -11.375 5.366 1.00 8.39 H new ATOM 0 HZ PHE A 92 8.511 -9.679 4.576 1.00 8.62 H new ATOM 1411 N ALA A 93 11.027 -13.708 -1.940 1.00 7.32 N ATOM 1412 CA ALA A 93 10.957 -14.638 -3.060 1.00 7.11 C ATOM 1413 C ALA A 93 11.926 -14.241 -4.180 1.00 8.33 C ATOM 1414 O ALA A 93 11.606 -13.403 -5.032 1.00 8.83 O ATOM 1415 CB ALA A 93 9.509 -14.744 -3.543 1.00 6.22 C ATOM 0 H ALA A 93 10.521 -12.835 -2.086 1.00 7.32 H new ATOM 0 HA ALA A 93 11.275 -15.626 -2.728 1.00 7.11 H new ATOM 0 HB1 ALA A 93 9.455 -15.439 -4.381 1.00 6.22 H new ATOM 0 HB2 ALA A 93 8.880 -15.106 -2.730 1.00 6.22 H new ATOM 0 HB3 ALA A 93 9.159 -13.762 -3.863 1.00 6.22 H new ATOM 1421 N LYS A 94 13.129 -14.850 -4.151 1.00 8.92 N ATOM 1422 CA LYS A 94 14.198 -14.603 -5.142 1.00 10.13 C ATOM 1423 C LYS A 94 15.422 -15.512 -4.889 1.00 10.64 C ATOM 1424 O LYS A 94 16.576 -15.078 -5.003 1.00 11.32 O ATOM 1425 CB LYS A 94 14.611 -13.092 -5.231 1.00 10.90 C ATOM 1426 CG LYS A 94 14.740 -12.348 -3.895 1.00 11.36 C ATOM 1427 CD LYS A 94 15.711 -13.054 -2.971 1.00 11.16 C ATOM 1428 CE LYS A 94 14.978 -13.860 -1.921 1.00 10.61 C ATOM 1429 NZ LYS A 94 15.909 -14.556 -0.992 1.00 11.01 N ATOM 0 H LYS A 94 13.388 -15.530 -3.436 1.00 8.92 H new ATOM 0 HA LYS A 94 13.782 -14.863 -6.115 1.00 10.13 H new ATOM 0 HB2 LYS A 94 15.566 -13.027 -5.753 1.00 10.90 H new ATOM 0 HB3 LYS A 94 13.876 -12.571 -5.844 1.00 10.90 H new ATOM 0 HG2 LYS A 94 15.080 -11.328 -4.074 1.00 11.36 H new ATOM 0 HG3 LYS A 94 13.763 -12.279 -3.417 1.00 11.36 H new ATOM 0 HD2 LYS A 94 16.358 -13.711 -3.552 1.00 11.16 H new ATOM 0 HD3 LYS A 94 16.355 -12.320 -2.486 1.00 11.16 H new ATOM 0 HE2 LYS A 94 14.325 -13.200 -1.350 1.00 10.61 H new ATOM 0 HE3 LYS A 94 14.340 -14.595 -2.411 1.00 10.61 H new ATOM 0 HZ1 LYS A 94 15.361 -15.095 -0.291 1.00 11.01 H new ATOM 0 HZ2 LYS A 94 16.516 -15.206 -1.531 1.00 11.01 H new ATOM 0 HZ3 LYS A 94 16.501 -13.854 -0.504 1.00 11.01 H new ATOM 1443 N ASP A 95 15.153 -16.791 -4.583 1.00 10.41 N ATOM 1444 CA ASP A 95 16.205 -17.769 -4.289 1.00 10.95 C ATOM 1445 C ASP A 95 16.810 -18.413 -5.544 1.00 11.36 C ATOM 1446 O ASP A 95 17.439 -19.478 -5.478 1.00 11.72 O ATOM 1447 CB ASP A 95 15.682 -18.839 -3.320 1.00 10.75 C ATOM 1448 CG ASP A 95 15.455 -18.300 -1.920 1.00 10.79 C ATOM 1449 OD1 ASP A 95 14.332 -17.829 -1.639 1.00 11.08 O ATOM 1450 OD2 ASP A 95 16.400 -18.348 -1.104 1.00 10.72 O ATOM 0 H ASP A 95 14.208 -17.171 -4.533 1.00 10.41 H new ATOM 0 HA ASP A 95 17.018 -17.219 -3.815 1.00 10.95 H new ATOM 0 HB2 ASP A 95 14.747 -19.246 -3.705 1.00 10.75 H new ATOM 0 HB3 ASP A 95 16.394 -19.663 -3.277 1.00 10.75 H new ATOM 1455 N GLY A 96 16.632 -17.738 -6.675 1.00 11.41 N ATOM 1456 CA GLY A 96 17.157 -18.214 -7.959 1.00 11.89 C ATOM 1457 C GLY A 96 16.455 -19.443 -8.491 1.00 11.67 C ATOM 1458 O GLY A 96 15.308 -19.717 -8.130 1.00 11.82 O ATOM 0 H GLY A 96 16.126 -16.854 -6.733 1.00 11.41 H new ATOM 0 HA2 GLY A 96 17.073 -17.413 -8.694 1.00 11.89 H new ATOM 0 HA3 GLY A 96 18.219 -18.434 -7.847 1.00 11.89 H new ATOM 1462 N ASN A 97 17.179 -20.188 -9.363 1.00 11.48 N ATOM 1463 CA ASN A 97 16.708 -21.448 -9.981 1.00 11.39 C ATOM 1464 C ASN A 97 15.515 -21.284 -10.933 1.00 11.24 C ATOM 1465 O ASN A 97 15.303 -22.108 -11.828 1.00 11.69 O ATOM 1466 CB ASN A 97 16.364 -22.412 -8.875 1.00 10.47 C ATOM 1467 CG ASN A 97 16.840 -23.826 -9.152 1.00 10.82 C ATOM 1468 OD1 ASN A 97 16.187 -24.586 -9.866 1.00 11.12 O ATOM 1469 ND2 ASN A 97 17.986 -24.184 -8.587 1.00 10.95 N ATOM 0 H ASN A 97 18.119 -19.925 -9.659 1.00 11.48 H new ATOM 0 HA ASN A 97 17.518 -21.823 -10.607 1.00 11.39 H new ATOM 0 HB2 ASN A 97 16.808 -22.061 -7.943 1.00 10.47 H new ATOM 0 HB3 ASN A 97 15.284 -22.420 -8.730 1.00 10.47 H new ATOM 0 HD21 ASN A 97 18.358 -25.122 -8.738 1.00 10.95 H new ATOM 0 HD22 ASN A 97 18.495 -23.521 -8.002 1.00 10.95 H new ATOM 1476 N GLY A 98 14.764 -20.222 -10.718 1.00 10.71 N ATOM 1477 CA GLY A 98 13.595 -19.908 -11.533 1.00 10.57 C ATOM 1478 C GLY A 98 12.278 -20.079 -10.790 1.00 9.35 C ATOM 1479 O GLY A 98 11.241 -19.629 -11.276 1.00 9.23 O ATOM 0 H GLY A 98 14.943 -19.548 -9.973 1.00 10.71 H new ATOM 0 HA2 GLY A 98 13.673 -18.880 -11.887 1.00 10.57 H new ATOM 0 HA3 GLY A 98 13.593 -20.549 -12.414 1.00 10.57 H new ATOM 1483 N TYR A 99 12.318 -20.735 -9.624 1.00 8.53 N ATOM 1484 CA TYR A 99 11.140 -20.915 -8.792 1.00 7.35 C ATOM 1485 C TYR A 99 11.443 -20.455 -7.369 1.00 6.60 C ATOM 1486 O TYR A 99 12.314 -21.018 -6.697 1.00 6.68 O ATOM 1487 CB TYR A 99 10.599 -22.369 -8.828 1.00 7.03 C ATOM 1488 CG TYR A 99 11.529 -23.474 -8.338 1.00 7.42 C ATOM 1489 CD1 TYR A 99 12.817 -23.632 -8.845 1.00 7.29 C ATOM 1490 CD2 TYR A 99 11.091 -24.382 -7.373 1.00 8.16 C ATOM 1491 CE1 TYR A 99 13.637 -24.651 -8.406 1.00 7.85 C ATOM 1492 CE2 TYR A 99 11.912 -25.402 -6.931 1.00 8.71 C ATOM 1493 CZ TYR A 99 13.182 -25.531 -7.451 1.00 8.53 C ATOM 1494 OH TYR A 99 14.001 -26.546 -7.015 1.00 9.21 O ATOM 0 H TYR A 99 13.166 -21.151 -9.239 1.00 8.53 H new ATOM 0 HA TYR A 99 10.341 -20.296 -9.200 1.00 7.35 H new ATOM 0 HB2 TYR A 99 9.688 -22.405 -8.230 1.00 7.03 H new ATOM 0 HB3 TYR A 99 10.315 -22.598 -9.855 1.00 7.03 H new ATOM 0 HD1 TYR A 99 13.180 -22.945 -9.595 1.00 7.29 H new ATOM 0 HD2 TYR A 99 10.095 -24.286 -6.965 1.00 8.16 H new ATOM 0 HE1 TYR A 99 14.633 -24.758 -8.811 1.00 7.85 H new ATOM 0 HE2 TYR A 99 11.560 -26.095 -6.181 1.00 8.71 H new ATOM 0 HH TYR A 99 14.936 -26.260 -7.075 1.00 9.21 H new ATOM 1504 N ILE A 100 10.716 -19.425 -6.923 1.00 6.19 N ATOM 1505 CA ILE A 100 10.893 -18.843 -5.580 1.00 5.73 C ATOM 1506 C ILE A 100 10.519 -19.842 -4.480 1.00 4.64 C ATOM 1507 O ILE A 100 9.506 -20.531 -4.595 1.00 4.17 O ATOM 1508 CB ILE A 100 10.079 -17.522 -5.416 1.00 5.84 C ATOM 1509 CG1 ILE A 100 8.569 -17.706 -5.693 1.00 5.96 C ATOM 1510 CG2 ILE A 100 10.643 -16.450 -6.344 1.00 5.70 C ATOM 1511 CD1 ILE A 100 7.745 -18.029 -4.462 1.00 6.65 C ATOM 0 H ILE A 100 9.990 -18.970 -7.477 1.00 6.19 H new ATOM 0 HA ILE A 100 11.951 -18.604 -5.475 1.00 5.73 H new ATOM 0 HB ILE A 100 10.179 -17.215 -4.375 1.00 5.84 H new ATOM 0 HG12 ILE A 100 8.181 -16.794 -6.147 1.00 5.96 H new ATOM 0 HG13 ILE A 100 8.440 -18.505 -6.423 1.00 5.96 H new ATOM 0 HG21 ILE A 100 10.072 -15.529 -6.226 1.00 5.70 H new ATOM 0 HG22 ILE A 100 11.687 -16.264 -6.093 1.00 5.70 H new ATOM 0 HG23 ILE A 100 10.574 -16.790 -7.377 1.00 5.70 H new ATOM 0 HD11 ILE A 100 6.698 -18.142 -4.744 1.00 6.65 H new ATOM 0 HD12 ILE A 100 8.103 -18.958 -4.018 1.00 6.65 H new ATOM 0 HD13 ILE A 100 7.840 -17.220 -3.738 1.00 6.65 H new ATOM 1523 N SER A 101 11.319 -19.898 -3.404 1.00 4.56 N ATOM 1524 CA SER A 101 11.063 -20.843 -2.319 1.00 3.87 C ATOM 1525 C SER A 101 9.726 -20.600 -1.636 1.00 3.18 C ATOM 1526 O SER A 101 9.333 -19.460 -1.374 1.00 3.33 O ATOM 1527 CB SER A 101 12.185 -20.846 -1.288 1.00 4.59 C ATOM 1528 OG SER A 101 12.364 -19.566 -0.703 1.00 5.48 O ATOM 0 H SER A 101 12.138 -19.305 -3.267 1.00 4.56 H new ATOM 0 HA SER A 101 11.023 -21.826 -2.788 1.00 3.87 H new ATOM 0 HB2 SER A 101 11.961 -21.574 -0.508 1.00 4.59 H new ATOM 0 HB3 SER A 101 13.114 -21.162 -1.762 1.00 4.59 H new ATOM 0 HG SER A 101 13.086 -19.092 -1.167 1.00 5.48 H new ATOM 1534 N ALA A 102 9.050 -21.710 -1.363 1.00 2.74 N ATOM 1535 CA ALA A 102 7.734 -21.709 -0.717 1.00 2.63 C ATOM 1536 C ALA A 102 7.797 -21.460 0.794 1.00 3.39 C ATOM 1537 O ALA A 102 6.783 -21.117 1.410 1.00 3.61 O ATOM 1538 CB ALA A 102 7.043 -23.026 -0.990 1.00 3.06 C ATOM 0 H ALA A 102 9.398 -22.643 -1.583 1.00 2.74 H new ATOM 0 HA ALA A 102 7.170 -20.879 -1.144 1.00 2.63 H new ATOM 0 HB1 ALA A 102 6.064 -23.029 -0.511 1.00 3.06 H new ATOM 0 HB2 ALA A 102 6.922 -23.157 -2.065 1.00 3.06 H new ATOM 0 HB3 ALA A 102 7.645 -23.842 -0.591 1.00 3.06 H new ATOM 1544 N ALA A 103 8.989 -21.633 1.382 1.00 4.09 N ATOM 1545 CA ALA A 103 9.200 -21.444 2.825 1.00 5.20 C ATOM 1546 C ALA A 103 9.027 -19.984 3.270 1.00 5.47 C ATOM 1547 O ALA A 103 8.810 -19.720 4.457 1.00 6.33 O ATOM 1548 CB ALA A 103 10.581 -21.948 3.217 1.00 5.96 C ATOM 0 H ALA A 103 9.830 -21.906 0.874 1.00 4.09 H new ATOM 0 HA ALA A 103 8.431 -22.023 3.337 1.00 5.20 H new ATOM 0 HB1 ALA A 103 10.730 -21.805 4.287 1.00 5.96 H new ATOM 0 HB2 ALA A 103 10.663 -23.008 2.978 1.00 5.96 H new ATOM 0 HB3 ALA A 103 11.341 -21.392 2.667 1.00 5.96 H new ATOM 1554 N GLU A 104 9.124 -19.048 2.315 1.00 4.91 N ATOM 1555 CA GLU A 104 8.994 -17.615 2.610 1.00 5.33 C ATOM 1556 C GLU A 104 7.540 -17.132 2.604 1.00 4.76 C ATOM 1557 O GLU A 104 7.204 -16.228 3.361 1.00 5.38 O ATOM 1558 CB GLU A 104 9.807 -16.775 1.618 1.00 5.44 C ATOM 1559 CG GLU A 104 11.321 -16.884 1.792 1.00 6.31 C ATOM 1560 CD GLU A 104 11.848 -16.075 2.966 1.00 6.92 C ATOM 1561 OE1 GLU A 104 12.507 -15.041 2.726 1.00 7.26 O ATOM 1562 OE2 GLU A 104 11.600 -16.476 4.122 1.00 7.37 O ATOM 0 H GLU A 104 9.292 -19.258 1.331 1.00 4.91 H new ATOM 0 HA GLU A 104 9.385 -17.482 3.619 1.00 5.33 H new ATOM 0 HB2 GLU A 104 9.547 -17.079 0.604 1.00 5.44 H new ATOM 0 HB3 GLU A 104 9.516 -15.730 1.721 1.00 5.44 H new ATOM 0 HG2 GLU A 104 11.590 -17.931 1.931 1.00 6.31 H new ATOM 0 HG3 GLU A 104 11.811 -16.547 0.878 1.00 6.31 H new ATOM 1569 N LEU A 105 6.690 -17.734 1.744 1.00 3.64 N ATOM 1570 CA LEU A 105 5.259 -17.369 1.605 1.00 3.09 C ATOM 1571 C LEU A 105 4.541 -17.159 2.914 1.00 4.03 C ATOM 1572 O LEU A 105 3.861 -16.150 3.104 1.00 4.13 O ATOM 1573 CB LEU A 105 4.484 -18.462 0.858 1.00 2.35 C ATOM 1574 CG LEU A 105 5.169 -19.099 -0.362 1.00 1.65 C ATOM 1575 CD1 LEU A 105 4.526 -20.426 -0.713 1.00 2.00 C ATOM 1576 CD2 LEU A 105 5.126 -18.173 -1.560 1.00 1.38 C ATOM 0 H LEU A 105 6.976 -18.491 1.123 1.00 3.64 H new ATOM 0 HA LEU A 105 5.278 -16.426 1.058 1.00 3.09 H new ATOM 0 HB2 LEU A 105 4.251 -19.256 1.568 1.00 2.35 H new ATOM 0 HB3 LEU A 105 3.535 -18.039 0.530 1.00 2.35 H new ATOM 0 HG LEU A 105 6.212 -19.273 -0.096 1.00 1.65 H new ATOM 0 HD11 LEU A 105 5.029 -20.856 -1.579 1.00 2.00 H new ATOM 0 HD12 LEU A 105 4.614 -21.108 0.133 1.00 2.00 H new ATOM 0 HD13 LEU A 105 3.473 -20.270 -0.945 1.00 2.00 H new ATOM 0 HD21 LEU A 105 5.618 -18.651 -2.407 1.00 1.38 H new ATOM 0 HD22 LEU A 105 4.089 -17.958 -1.817 1.00 1.38 H new ATOM 0 HD23 LEU A 105 5.640 -17.243 -1.319 1.00 1.38 H new ATOM 1588 N ARG A 106 4.691 -18.124 3.802 1.00 4.83 N ATOM 1589 CA ARG A 106 4.036 -18.083 5.100 1.00 5.95 C ATOM 1590 C ARG A 106 4.542 -16.909 5.915 1.00 6.65 C ATOM 1591 O ARG A 106 3.898 -16.462 6.855 1.00 7.39 O ATOM 1592 CB ARG A 106 4.252 -19.383 5.886 1.00 6.81 C ATOM 1593 CG ARG A 106 3.867 -20.673 5.150 1.00 6.46 C ATOM 1594 CD ARG A 106 5.009 -21.213 4.311 1.00 5.99 C ATOM 1595 NE ARG A 106 4.782 -22.603 3.898 1.00 6.40 N ATOM 1596 CZ ARG A 106 5.720 -23.562 3.894 1.00 6.89 C ATOM 1597 NH1 ARG A 106 6.969 -23.307 4.280 1.00 7.08 N ATOM 1598 NH2 ARG A 106 5.401 -24.786 3.498 1.00 7.37 N ATOM 0 H ARG A 106 5.265 -18.953 3.648 1.00 4.83 H new ATOM 0 HA ARG A 106 2.968 -17.966 4.918 1.00 5.95 H new ATOM 0 HB2 ARG A 106 5.303 -19.446 6.168 1.00 6.81 H new ATOM 0 HB3 ARG A 106 3.677 -19.328 6.810 1.00 6.81 H new ATOM 0 HG2 ARG A 106 3.563 -21.427 5.876 1.00 6.46 H new ATOM 0 HG3 ARG A 106 3.006 -20.481 4.510 1.00 6.46 H new ATOM 0 HD2 ARG A 106 5.135 -20.589 3.427 1.00 5.99 H new ATOM 0 HD3 ARG A 106 5.937 -21.151 4.880 1.00 5.99 H new ATOM 0 HE ARG A 106 3.843 -22.858 3.592 1.00 6.40 H new ATOM 0 HH11 ARG A 106 7.227 -22.369 4.586 1.00 7.08 H new ATOM 0 HH12 ARG A 106 7.668 -24.050 4.270 1.00 7.08 H new ATOM 0 HH21 ARG A 106 4.448 -24.993 3.199 1.00 7.37 H new ATOM 0 HH22 ARG A 106 6.109 -25.521 3.492 1.00 7.37 H new ATOM 1612 N HIS A 107 5.735 -16.475 5.560 1.00 6.60 N ATOM 1613 CA HIS A 107 6.358 -15.320 6.154 1.00 7.43 C ATOM 1614 C HIS A 107 6.024 -14.067 5.335 1.00 6.90 C ATOM 1615 O HIS A 107 6.104 -12.955 5.859 1.00 7.61 O ATOM 1616 CB HIS A 107 7.876 -15.503 6.251 1.00 8.00 C ATOM 1617 CG HIS A 107 8.298 -16.533 7.255 1.00 8.87 C ATOM 1618 ND1 HIS A 107 8.764 -16.211 8.513 1.00 9.79 N ATOM 1619 CD2 HIS A 107 8.324 -17.885 7.181 1.00 9.07 C ATOM 1620 CE1 HIS A 107 9.059 -17.320 9.168 1.00 10.41 C ATOM 1621 NE2 HIS A 107 8.801 -18.349 8.382 1.00 10.03 N ATOM 0 H HIS A 107 6.302 -16.924 4.841 1.00 6.60 H new ATOM 0 HA HIS A 107 5.968 -15.201 7.165 1.00 7.43 H new ATOM 0 HB2 HIS A 107 8.262 -15.785 5.271 1.00 8.00 H new ATOM 0 HB3 HIS A 107 8.332 -14.548 6.511 1.00 8.00 H new ATOM 0 HD2 HIS A 107 8.025 -18.486 6.335 1.00 9.07 H new ATOM 0 HE1 HIS A 107 9.445 -17.375 10.175 1.00 10.41 H new ATOM 0 HE2 HIS A 107 8.934 -19.330 8.627 1.00 10.03 H new ATOM 1630 N VAL A 108 5.650 -14.253 4.040 1.00 5.69 N ATOM 1631 CA VAL A 108 5.309 -13.132 3.171 1.00 5.20 C ATOM 1632 C VAL A 108 3.849 -12.738 3.310 1.00 4.84 C ATOM 1633 O VAL A 108 3.550 -11.627 3.738 1.00 5.36 O ATOM 1634 CB VAL A 108 5.642 -13.441 1.676 1.00 4.27 C ATOM 1635 CG1 VAL A 108 5.327 -12.256 0.779 1.00 4.16 C ATOM 1636 CG2 VAL A 108 7.083 -13.886 1.491 1.00 4.80 C ATOM 0 H VAL A 108 5.582 -15.167 3.593 1.00 5.69 H new ATOM 0 HA VAL A 108 5.922 -12.290 3.492 1.00 5.20 H new ATOM 0 HB VAL A 108 5.002 -14.272 1.379 1.00 4.27 H new ATOM 0 HG11 VAL A 108 5.571 -12.506 -0.253 1.00 4.16 H new ATOM 0 HG12 VAL A 108 4.267 -12.015 0.853 1.00 4.16 H new ATOM 0 HG13 VAL A 108 5.917 -11.395 1.093 1.00 4.16 H new ATOM 0 HG21 VAL A 108 7.268 -14.090 0.436 1.00 4.80 H new ATOM 0 HG22 VAL A 108 7.754 -13.097 1.832 1.00 4.80 H new ATOM 0 HG23 VAL A 108 7.262 -14.791 2.072 1.00 4.80 H new ATOM 1646 N MET A 109 2.954 -13.643 2.930 1.00 4.11 N ATOM 1647 CA MET A 109 1.508 -13.412 3.063 1.00 4.08 C ATOM 1648 C MET A 109 1.175 -12.972 4.483 1.00 5.33 C ATOM 1649 O MET A 109 0.321 -12.105 4.686 1.00 5.53 O ATOM 1650 CB MET A 109 0.718 -14.648 2.669 1.00 3.81 C ATOM 1651 CG MET A 109 0.481 -14.726 1.164 1.00 2.70 C ATOM 1652 SD MET A 109 -0.633 -16.058 0.683 1.00 3.27 S ATOM 1653 CE MET A 109 0.393 -17.487 0.984 1.00 3.46 C ATOM 0 H MET A 109 3.198 -14.547 2.526 1.00 4.11 H new ATOM 0 HA MET A 109 1.221 -12.612 2.380 1.00 4.08 H new ATOM 0 HB2 MET A 109 1.253 -15.539 2.997 1.00 3.81 H new ATOM 0 HB3 MET A 109 -0.241 -14.644 3.186 1.00 3.81 H new ATOM 0 HG2 MET A 109 0.071 -13.777 0.819 1.00 2.70 H new ATOM 0 HG3 MET A 109 1.438 -14.862 0.660 1.00 2.70 H new ATOM 0 HE1 MET A 109 0.689 -17.929 0.033 1.00 3.46 H new ATOM 0 HE2 MET A 109 1.283 -17.186 1.537 1.00 3.46 H new ATOM 0 HE3 MET A 109 -0.165 -18.220 1.567 1.00 3.46 H new ATOM 1663 N THR A 110 1.861 -13.586 5.466 1.00 6.20 N ATOM 1664 CA THR A 110 1.721 -13.175 6.865 1.00 7.45 C ATOM 1665 C THR A 110 2.329 -11.767 7.070 1.00 7.80 C ATOM 1666 O THR A 110 1.847 -11.005 7.912 1.00 8.54 O ATOM 1667 CB THR A 110 2.402 -14.183 7.810 1.00 8.32 C ATOM 1668 OG1 THR A 110 1.856 -15.486 7.578 1.00 8.16 O ATOM 1669 CG2 THR A 110 2.210 -13.827 9.286 1.00 9.65 C ATOM 0 H THR A 110 2.509 -14.359 5.314 1.00 6.20 H new ATOM 0 HA THR A 110 0.658 -13.146 7.104 1.00 7.45 H new ATOM 0 HB THR A 110 3.471 -14.157 7.597 1.00 8.32 H new ATOM 0 HG1 THR A 110 2.576 -16.103 7.332 1.00 8.16 H new ATOM 0 HG21 THR A 110 2.710 -14.570 9.907 1.00 9.65 H new ATOM 0 HG22 THR A 110 2.637 -12.843 9.482 1.00 9.65 H new ATOM 0 HG23 THR A 110 1.146 -13.814 9.522 1.00 9.65 H new ATOM 1677 N ASN A 111 3.396 -11.432 6.298 1.00 7.42 N ATOM 1678 CA ASN A 111 4.035 -10.102 6.389 1.00 8.00 C ATOM 1679 C ASN A 111 3.086 -8.976 5.925 1.00 7.57 C ATOM 1680 O ASN A 111 3.037 -7.913 6.550 1.00 8.26 O ATOM 1681 CB ASN A 111 5.330 -10.069 5.567 1.00 7.98 C ATOM 1682 CG ASN A 111 6.337 -9.060 6.093 1.00 9.16 C ATOM 1683 OD1 ASN A 111 7.172 -9.382 6.938 1.00 9.84 O ATOM 1684 ND2 ASN A 111 6.261 -7.832 5.593 1.00 9.58 N ATOM 0 H ASN A 111 3.824 -12.058 5.616 1.00 7.42 H new ATOM 0 HA ASN A 111 4.272 -9.928 7.439 1.00 8.00 H new ATOM 0 HB2 ASN A 111 5.782 -11.061 5.569 1.00 7.98 H new ATOM 0 HB3 ASN A 111 5.091 -9.830 4.531 1.00 7.98 H new ATOM 0 HD21 ASN A 111 6.911 -7.112 5.908 1.00 9.58 H new ATOM 0 HD22 ASN A 111 5.553 -7.609 4.894 1.00 9.58 H new ATOM 1691 N LEU A 112 2.339 -9.219 4.828 1.00 6.48 N ATOM 1692 CA LEU A 112 1.388 -8.239 4.290 1.00 6.02 C ATOM 1693 C LEU A 112 0.064 -8.281 5.045 1.00 6.50 C ATOM 1694 O LEU A 112 -0.453 -7.244 5.473 1.00 6.87 O ATOM 1695 CB LEU A 112 1.114 -8.465 2.783 1.00 4.81 C ATOM 1696 CG LEU A 112 2.301 -8.302 1.808 1.00 4.44 C ATOM 1697 CD1 LEU A 112 3.077 -7.012 2.063 1.00 4.55 C ATOM 1698 CD2 LEU A 112 3.219 -9.510 1.878 1.00 4.77 C ATOM 0 H LEU A 112 2.381 -10.091 4.300 1.00 6.48 H new ATOM 0 HA LEU A 112 1.850 -7.260 4.420 1.00 6.02 H new ATOM 0 HB2 LEU A 112 0.715 -9.472 2.661 1.00 4.81 H new ATOM 0 HB3 LEU A 112 0.330 -7.773 2.477 1.00 4.81 H new ATOM 0 HG LEU A 112 1.890 -8.235 0.801 1.00 4.44 H new ATOM 0 HD11 LEU A 112 3.903 -6.938 1.355 1.00 4.55 H new ATOM 0 HD12 LEU A 112 2.413 -6.157 1.937 1.00 4.55 H new ATOM 0 HD13 LEU A 112 3.470 -7.019 3.080 1.00 4.55 H new ATOM 0 HD21 LEU A 112 4.049 -9.377 1.184 1.00 4.77 H new ATOM 0 HD22 LEU A 112 3.606 -9.614 2.892 1.00 4.77 H new ATOM 0 HD23 LEU A 112 2.661 -10.407 1.609 1.00 4.77 H new ATOM 1710 N GLY A 113 -0.468 -9.497 5.196 1.00 6.67 N ATOM 1711 CA GLY A 113 -1.733 -9.696 5.890 1.00 7.40 C ATOM 1712 C GLY A 113 -1.569 -9.926 7.377 1.00 8.34 C ATOM 1713 O GLY A 113 -0.749 -10.746 7.799 1.00 8.64 O ATOM 0 H GLY A 113 -0.040 -10.354 4.846 1.00 6.67 H new ATOM 0 HA2 GLY A 113 -2.368 -8.824 5.732 1.00 7.40 H new ATOM 0 HA3 GLY A 113 -2.250 -10.550 5.452 1.00 7.40 H new ATOM 1717 N GLU A 114 -2.364 -9.197 8.166 1.00 8.94 N ATOM 1718 CA GLU A 114 -2.337 -9.303 9.629 1.00 10.00 C ATOM 1719 C GLU A 114 -3.279 -10.396 10.117 1.00 10.47 C ATOM 1720 O GLU A 114 -3.039 -11.027 11.151 1.00 11.33 O ATOM 1721 CB GLU A 114 -2.729 -7.970 10.267 1.00 10.43 C ATOM 1722 CG GLU A 114 -1.675 -6.880 10.125 1.00 10.39 C ATOM 1723 CD GLU A 114 -2.096 -5.574 10.769 1.00 11.02 C ATOM 1724 OE1 GLU A 114 -1.806 -5.384 11.969 1.00 11.20 O ATOM 1725 OE2 GLU A 114 -2.716 -4.742 10.074 1.00 11.47 O ATOM 0 H GLU A 114 -3.041 -8.521 7.812 1.00 8.94 H new ATOM 0 HA GLU A 114 -1.320 -9.561 9.925 1.00 10.00 H new ATOM 0 HB2 GLU A 114 -3.659 -7.623 9.816 1.00 10.43 H new ATOM 0 HB3 GLU A 114 -2.929 -8.131 11.326 1.00 10.43 H new ATOM 0 HG2 GLU A 114 -0.743 -7.220 10.577 1.00 10.39 H new ATOM 0 HG3 GLU A 114 -1.473 -6.711 9.067 1.00 10.39 H new ATOM 1732 N LYS A 115 -4.348 -10.602 9.354 1.00 10.04 N ATOM 1733 CA LYS A 115 -5.363 -11.615 9.661 1.00 10.61 C ATOM 1734 C LYS A 115 -5.047 -12.936 8.986 1.00 10.14 C ATOM 1735 O LYS A 115 -5.330 -14.016 9.514 1.00 10.70 O ATOM 1736 CB LYS A 115 -6.754 -11.141 9.216 1.00 11.03 C ATOM 1737 CG LYS A 115 -6.785 -10.673 7.757 1.00 10.36 C ATOM 1738 CD LYS A 115 -7.157 -9.196 7.630 1.00 10.71 C ATOM 1739 CE LYS A 115 -6.030 -8.282 8.102 1.00 10.61 C ATOM 1740 NZ LYS A 115 -6.491 -6.880 8.295 1.00 10.83 N ATOM 0 H LYS A 115 -4.539 -10.073 8.503 1.00 10.04 H new ATOM 0 HA LYS A 115 -5.357 -11.762 10.741 1.00 10.61 H new ATOM 0 HB2 LYS A 115 -7.469 -11.954 9.347 1.00 11.03 H new ATOM 0 HB3 LYS A 115 -7.078 -10.325 9.861 1.00 11.03 H new ATOM 0 HG2 LYS A 115 -5.808 -10.840 7.303 1.00 10.36 H new ATOM 0 HG3 LYS A 115 -7.502 -11.275 7.200 1.00 10.36 H new ATOM 0 HD2 LYS A 115 -7.396 -8.970 6.591 1.00 10.71 H new ATOM 0 HD3 LYS A 115 -8.055 -8.996 8.215 1.00 10.71 H new ATOM 0 HE2 LYS A 115 -5.624 -8.662 9.039 1.00 10.61 H new ATOM 0 HE3 LYS A 115 -5.220 -8.300 7.373 1.00 10.61 H new ATOM 0 HZ1 LYS A 115 -5.694 -6.294 8.616 1.00 10.83 H new ATOM 0 HZ2 LYS A 115 -6.855 -6.507 7.395 1.00 10.83 H new ATOM 0 HZ3 LYS A 115 -7.246 -6.858 9.009 1.00 10.83 H new ATOM 1754 N LEU A 116 -4.455 -12.809 7.809 1.00 9.19 N ATOM 1755 CA LEU A 116 -4.089 -13.932 6.969 1.00 8.69 C ATOM 1756 C LEU A 116 -3.016 -14.810 7.630 1.00 9.07 C ATOM 1757 O LEU A 116 -1.919 -14.333 7.944 1.00 9.05 O ATOM 1758 CB LEU A 116 -3.587 -13.395 5.638 1.00 7.40 C ATOM 1759 CG LEU A 116 -4.658 -12.778 4.721 1.00 6.84 C ATOM 1760 CD1 LEU A 116 -4.065 -11.661 3.874 1.00 6.44 C ATOM 1761 CD2 LEU A 116 -5.283 -13.835 3.822 1.00 6.43 C ATOM 0 H LEU A 116 -4.212 -11.904 7.406 1.00 9.19 H new ATOM 0 HA LEU A 116 -4.966 -14.561 6.817 1.00 8.69 H new ATOM 0 HB2 LEU A 116 -2.826 -12.641 5.835 1.00 7.40 H new ATOM 0 HB3 LEU A 116 -3.099 -14.208 5.100 1.00 7.40 H new ATOM 0 HG LEU A 116 -5.438 -12.360 5.358 1.00 6.84 H new ATOM 0 HD11 LEU A 116 -4.840 -11.239 3.234 1.00 6.44 H new ATOM 0 HD12 LEU A 116 -3.669 -10.882 4.525 1.00 6.44 H new ATOM 0 HD13 LEU A 116 -3.261 -12.061 3.256 1.00 6.44 H new ATOM 0 HD21 LEU A 116 -6.036 -13.372 3.185 1.00 6.43 H new ATOM 0 HD22 LEU A 116 -4.510 -14.287 3.200 1.00 6.43 H new ATOM 0 HD23 LEU A 116 -5.751 -14.604 4.436 1.00 6.43 H new ATOM 1773 N THR A 117 -3.350 -16.083 7.845 1.00 9.56 N ATOM 1774 CA THR A 117 -2.453 -17.027 8.484 1.00 10.01 C ATOM 1775 C THR A 117 -1.798 -17.995 7.535 1.00 9.24 C ATOM 1776 O THR A 117 -1.915 -17.908 6.316 1.00 8.29 O ATOM 1777 CB THR A 117 -3.152 -17.873 9.561 1.00 11.26 C ATOM 1778 OG1 THR A 117 -4.445 -18.299 9.110 1.00 11.46 O ATOM 1779 CG2 THR A 117 -3.275 -17.076 10.823 1.00 12.18 C ATOM 0 H THR A 117 -4.250 -16.481 7.579 1.00 9.56 H new ATOM 0 HA THR A 117 -1.694 -16.381 8.925 1.00 10.01 H new ATOM 0 HB THR A 117 -2.553 -18.762 9.756 1.00 11.26 H new ATOM 0 HG1 THR A 117 -4.874 -18.837 9.808 1.00 11.46 H new ATOM 0 HG21 THR A 117 -3.771 -17.677 11.586 1.00 12.18 H new ATOM 0 HG22 THR A 117 -2.282 -16.793 11.173 1.00 12.18 H new ATOM 0 HG23 THR A 117 -3.862 -16.178 10.630 1.00 12.18 H new ATOM 1787 N ASP A 118 -1.071 -18.902 8.169 1.00 9.74 N ATOM 1788 CA ASP A 118 -0.362 -19.993 7.527 1.00 9.28 C ATOM 1789 C ASP A 118 -1.311 -20.963 6.853 1.00 9.42 C ATOM 1790 O ASP A 118 -0.954 -21.615 5.868 1.00 8.80 O ATOM 1791 CB ASP A 118 0.427 -20.703 8.605 1.00 10.08 C ATOM 1792 CG ASP A 118 1.805 -20.107 8.815 1.00 9.81 C ATOM 1793 OD1 ASP A 118 1.908 -19.089 9.532 1.00 9.86 O ATOM 1794 OD2 ASP A 118 2.780 -20.659 8.265 1.00 9.76 O ATOM 0 H ASP A 118 -0.956 -18.896 9.182 1.00 9.74 H new ATOM 0 HA ASP A 118 0.290 -19.600 6.747 1.00 9.28 H new ATOM 0 HB2 ASP A 118 -0.128 -20.661 9.542 1.00 10.08 H new ATOM 0 HB3 ASP A 118 0.528 -21.756 8.341 1.00 10.08 H new ATOM 1799 N GLU A 119 -2.523 -21.048 7.400 1.00 10.37 N ATOM 1800 CA GLU A 119 -3.569 -21.899 6.844 1.00 10.83 C ATOM 1801 C GLU A 119 -3.994 -21.367 5.487 1.00 10.04 C ATOM 1802 O GLU A 119 -4.566 -22.095 4.672 1.00 10.27 O ATOM 1803 CB GLU A 119 -4.768 -22.018 7.790 1.00 12.10 C ATOM 1804 CG GLU A 119 -4.496 -22.865 9.026 1.00 13.08 C ATOM 1805 CD GLU A 119 -5.701 -22.966 9.940 1.00 14.16 C ATOM 1806 OE1 GLU A 119 -5.839 -22.109 10.838 1.00 14.50 O ATOM 1807 OE2 GLU A 119 -6.508 -23.902 9.757 1.00 14.78 O ATOM 0 H GLU A 119 -2.804 -20.533 8.234 1.00 10.37 H new ATOM 0 HA GLU A 119 -3.164 -22.903 6.721 1.00 10.83 H new ATOM 0 HB2 GLU A 119 -5.070 -21.019 8.105 1.00 12.10 H new ATOM 0 HB3 GLU A 119 -5.608 -22.448 7.244 1.00 12.10 H new ATOM 0 HG2 GLU A 119 -4.194 -23.866 8.717 1.00 13.08 H new ATOM 0 HG3 GLU A 119 -3.660 -22.436 9.579 1.00 13.08 H new ATOM 1814 N GLU A 120 -3.703 -20.076 5.268 1.00 9.24 N ATOM 1815 CA GLU A 120 -3.936 -19.431 3.983 1.00 8.40 C ATOM 1816 C GLU A 120 -2.948 -20.052 3.012 1.00 7.57 C ATOM 1817 O GLU A 120 -3.297 -20.386 1.884 1.00 7.44 O ATOM 1818 CB GLU A 120 -3.717 -17.907 4.066 1.00 7.71 C ATOM 1819 CG GLU A 120 -4.271 -17.103 2.887 1.00 7.14 C ATOM 1820 CD GLU A 120 -5.789 -17.153 2.772 1.00 8.10 C ATOM 1821 OE1 GLU A 120 -6.473 -16.637 3.680 1.00 8.52 O ATOM 1822 OE2 GLU A 120 -6.289 -17.709 1.771 1.00 8.58 O ATOM 0 H GLU A 120 -3.303 -19.460 5.976 1.00 9.24 H new ATOM 0 HA GLU A 120 -4.967 -19.579 3.662 1.00 8.40 H new ATOM 0 HB2 GLU A 120 -4.177 -17.540 4.983 1.00 7.71 H new ATOM 0 HB3 GLU A 120 -2.647 -17.714 4.146 1.00 7.71 H new ATOM 0 HG2 GLU A 120 -3.957 -16.064 2.988 1.00 7.14 H new ATOM 0 HG3 GLU A 120 -3.833 -17.481 1.963 1.00 7.14 H new ATOM 1829 N VAL A 121 -1.711 -20.265 3.500 1.00 7.19 N ATOM 1830 CA VAL A 121 -0.679 -20.874 2.714 1.00 6.42 C ATOM 1831 C VAL A 121 -1.022 -22.334 2.426 1.00 7.15 C ATOM 1832 O VAL A 121 -1.048 -22.743 1.269 1.00 6.95 O ATOM 1833 CB VAL A 121 0.679 -20.748 3.433 1.00 5.97 C ATOM 1834 CG1 VAL A 121 1.779 -21.191 2.513 1.00 5.00 C ATOM 1835 CG2 VAL A 121 0.922 -19.314 3.903 1.00 5.72 C ATOM 0 H VAL A 121 -1.424 -20.014 4.446 1.00 7.19 H new ATOM 0 HA VAL A 121 -0.605 -20.354 1.759 1.00 6.42 H new ATOM 0 HB VAL A 121 0.666 -21.389 4.314 1.00 5.97 H new ATOM 0 HG11 VAL A 121 2.738 -21.101 3.023 1.00 5.00 H new ATOM 0 HG12 VAL A 121 1.617 -22.230 2.226 1.00 5.00 H new ATOM 0 HG13 VAL A 121 1.782 -20.564 1.621 1.00 5.00 H new ATOM 0 HG21 VAL A 121 1.887 -19.255 4.407 1.00 5.72 H new ATOM 0 HG22 VAL A 121 0.920 -18.644 3.043 1.00 5.72 H new ATOM 0 HG23 VAL A 121 0.133 -19.019 4.595 1.00 5.72 H new ATOM 1845 N ASP A 122 -1.343 -23.081 3.487 1.00 8.17 N ATOM 1846 CA ASP A 122 -1.721 -24.511 3.375 1.00 9.00 C ATOM 1847 C ASP A 122 -2.952 -24.680 2.481 1.00 9.58 C ATOM 1848 O ASP A 122 -3.173 -25.747 1.900 1.00 10.07 O ATOM 1849 CB ASP A 122 -1.991 -25.121 4.755 1.00 10.08 C ATOM 1850 CG ASP A 122 -0.751 -25.165 5.631 1.00 9.97 C ATOM 1851 OD1 ASP A 122 -0.022 -26.177 5.577 1.00 10.09 O ATOM 1852 OD2 ASP A 122 -0.511 -24.187 6.370 1.00 9.98 O ATOM 0 H ASP A 122 -1.351 -22.725 4.443 1.00 8.17 H new ATOM 0 HA ASP A 122 -0.882 -25.038 2.922 1.00 9.00 H new ATOM 0 HB2 ASP A 122 -2.765 -24.542 5.258 1.00 10.08 H new ATOM 0 HB3 ASP A 122 -2.379 -26.132 4.631 1.00 10.08 H new ATOM 1857 N GLU A 123 -3.740 -23.601 2.389 1.00 9.61 N ATOM 1858 CA GLU A 123 -4.943 -23.554 1.554 1.00 10.24 C ATOM 1859 C GLU A 123 -4.549 -23.512 0.069 1.00 9.65 C ATOM 1860 O GLU A 123 -5.210 -24.118 -0.774 1.00 10.36 O ATOM 1861 CB GLU A 123 -5.797 -22.330 1.913 1.00 10.45 C ATOM 1862 CG GLU A 123 -7.289 -22.525 1.676 1.00 11.70 C ATOM 1863 CD GLU A 123 -8.102 -21.297 2.038 1.00 11.94 C ATOM 1864 OE1 GLU A 123 -8.536 -21.196 3.205 1.00 12.02 O ATOM 1865 OE2 GLU A 123 -8.303 -20.436 1.156 1.00 12.16 O ATOM 0 H GLU A 123 -3.559 -22.734 2.894 1.00 9.61 H new ATOM 0 HA GLU A 123 -5.533 -24.452 1.738 1.00 10.24 H new ATOM 0 HB2 GLU A 123 -5.635 -22.082 2.962 1.00 10.45 H new ATOM 0 HB3 GLU A 123 -5.455 -21.477 1.327 1.00 10.45 H new ATOM 0 HG2 GLU A 123 -7.457 -22.772 0.628 1.00 11.70 H new ATOM 0 HG3 GLU A 123 -7.639 -23.374 2.264 1.00 11.70 H new ATOM 1872 N MET A 124 -3.495 -22.738 -0.239 1.00 8.45 N ATOM 1873 CA MET A 124 -2.971 -22.638 -1.600 1.00 7.91 C ATOM 1874 C MET A 124 -1.937 -23.708 -1.903 1.00 7.70 C ATOM 1875 O MET A 124 -1.662 -23.992 -3.073 1.00 7.76 O ATOM 1876 CB MET A 124 -2.381 -21.251 -1.859 1.00 6.78 C ATOM 1877 CG MET A 124 -3.371 -20.272 -2.472 1.00 6.98 C ATOM 1878 SD MET A 124 -3.375 -18.663 -1.658 1.00 6.62 S ATOM 1879 CE MET A 124 -4.341 -19.036 -0.199 1.00 7.40 C ATOM 0 H MET A 124 -2.991 -22.172 0.444 1.00 8.45 H new ATOM 0 HA MET A 124 -3.816 -22.798 -2.270 1.00 7.91 H new ATOM 0 HB2 MET A 124 -2.012 -20.841 -0.919 1.00 6.78 H new ATOM 0 HB3 MET A 124 -1.522 -21.349 -2.523 1.00 6.78 H new ATOM 0 HG2 MET A 124 -3.133 -20.138 -3.527 1.00 6.98 H new ATOM 0 HG3 MET A 124 -4.373 -20.699 -2.423 1.00 6.98 H new ATOM 0 HE1 MET A 124 -5.310 -18.542 -0.268 1.00 7.40 H new ATOM 0 HE2 MET A 124 -4.488 -20.114 -0.125 1.00 7.40 H new ATOM 0 HE3 MET A 124 -3.815 -18.680 0.687 1.00 7.40 H new ATOM 1889 N ILE A 125 -1.367 -24.302 -0.851 1.00 7.60 N ATOM 1890 CA ILE A 125 -0.357 -25.335 -1.007 1.00 7.41 C ATOM 1891 C ILE A 125 -0.908 -26.583 -1.683 1.00 8.49 C ATOM 1892 O ILE A 125 -0.301 -27.097 -2.621 1.00 8.45 O ATOM 1893 CB ILE A 125 0.326 -25.689 0.316 1.00 7.24 C ATOM 1894 CG1 ILE A 125 1.123 -24.488 0.821 1.00 6.16 C ATOM 1895 CG2 ILE A 125 1.236 -26.856 0.078 1.00 7.27 C ATOM 1896 CD1 ILE A 125 1.531 -24.573 2.256 1.00 6.48 C ATOM 0 H ILE A 125 -1.593 -24.079 0.118 1.00 7.60 H new ATOM 0 HA ILE A 125 0.403 -24.912 -1.664 1.00 7.41 H new ATOM 0 HB ILE A 125 -0.417 -25.949 1.070 1.00 7.24 H new ATOM 0 HG12 ILE A 125 2.018 -24.378 0.208 1.00 6.16 H new ATOM 0 HG13 ILE A 125 0.527 -23.587 0.679 1.00 6.16 H new ATOM 0 HG21 ILE A 125 1.734 -27.125 1.010 1.00 7.27 H new ATOM 0 HG22 ILE A 125 0.653 -27.705 -0.280 1.00 7.27 H new ATOM 0 HG23 ILE A 125 1.984 -26.588 -0.668 1.00 7.27 H new ATOM 0 HD11 ILE A 125 2.092 -23.679 2.528 1.00 6.48 H new ATOM 0 HD12 ILE A 125 0.643 -24.649 2.883 1.00 6.48 H new ATOM 0 HD13 ILE A 125 2.157 -25.453 2.405 1.00 6.48 H new ATOM 1908 N ARG A 126 -2.008 -27.089 -1.144 1.00 9.53 N ATOM 1909 CA ARG A 126 -2.723 -28.251 -1.717 1.00 10.70 C ATOM 1910 C ARG A 126 -2.796 -28.137 -3.240 1.00 10.89 C ATOM 1911 O ARG A 126 -2.462 -29.074 -3.970 1.00 11.45 O ATOM 1912 CB ARG A 126 -4.152 -28.367 -1.162 1.00 11.76 C ATOM 1913 CG ARG A 126 -4.933 -27.055 -1.062 1.00 12.03 C ATOM 1914 CD ARG A 126 -5.562 -26.859 0.306 1.00 12.20 C ATOM 1915 NE ARG A 126 -6.524 -27.918 0.651 1.00 12.92 N ATOM 1916 CZ ARG A 126 -7.145 -28.030 1.834 1.00 13.50 C ATOM 1917 NH1 ARG A 126 -6.923 -27.155 2.814 1.00 13.44 N ATOM 1918 NH2 ARG A 126 -7.995 -29.027 2.036 1.00 14.26 N ATOM 0 H ARG A 126 -2.440 -26.716 -0.299 1.00 9.53 H new ATOM 0 HA ARG A 126 -2.162 -29.142 -1.435 1.00 10.70 H new ATOM 0 HB2 ARG A 126 -4.713 -29.055 -1.794 1.00 11.76 H new ATOM 0 HB3 ARG A 126 -4.101 -28.815 -0.170 1.00 11.76 H new ATOM 0 HG2 ARG A 126 -4.265 -26.220 -1.275 1.00 12.03 H new ATOM 0 HG3 ARG A 126 -5.713 -27.041 -1.823 1.00 12.03 H new ATOM 0 HD2 ARG A 126 -4.776 -26.829 1.061 1.00 12.20 H new ATOM 0 HD3 ARG A 126 -6.067 -25.893 0.333 1.00 12.20 H new ATOM 0 HE ARG A 126 -6.733 -28.617 -0.061 1.00 12.92 H new ATOM 0 HH11 ARG A 126 -6.271 -26.384 2.671 1.00 13.44 H new ATOM 0 HH12 ARG A 126 -7.405 -27.257 3.707 1.00 13.44 H new ATOM 0 HH21 ARG A 126 -8.173 -29.703 1.294 1.00 14.26 H new ATOM 0 HH22 ARG A 126 -8.471 -29.118 2.934 1.00 14.26 H new ATOM 1932 N GLU A 127 -3.246 -26.956 -3.687 1.00 10.50 N ATOM 1933 CA GLU A 127 -3.343 -26.632 -5.114 1.00 10.79 C ATOM 1934 C GLU A 127 -1.953 -26.556 -5.759 1.00 10.06 C ATOM 1935 O GLU A 127 -1.798 -26.863 -6.944 1.00 10.61 O ATOM 1936 CB GLU A 127 -4.068 -25.301 -5.301 1.00 10.70 C ATOM 1937 CG GLU A 127 -5.575 -25.368 -5.056 1.00 11.77 C ATOM 1938 CD GLU A 127 -6.341 -25.954 -6.230 1.00 12.85 C ATOM 1939 OE1 GLU A 127 -6.530 -27.188 -6.259 1.00 13.26 O ATOM 1940 OE2 GLU A 127 -6.752 -25.177 -7.118 1.00 13.42 O ATOM 0 H GLU A 127 -3.551 -26.203 -3.071 1.00 10.50 H new ATOM 0 HA GLU A 127 -3.907 -27.427 -5.602 1.00 10.79 H new ATOM 0 HB2 GLU A 127 -3.634 -24.565 -4.624 1.00 10.70 H new ATOM 0 HB3 GLU A 127 -3.892 -24.944 -6.316 1.00 10.70 H new ATOM 0 HG2 GLU A 127 -5.767 -25.969 -4.167 1.00 11.77 H new ATOM 0 HG3 GLU A 127 -5.949 -24.365 -4.849 1.00 11.77 H new ATOM 1947 N ALA A 128 -0.946 -26.144 -4.962 1.00 8.89 N ATOM 1948 CA ALA A 128 0.440 -26.042 -5.431 1.00 8.16 C ATOM 1949 C ALA A 128 1.119 -27.410 -5.567 1.00 8.57 C ATOM 1950 O ALA A 128 2.075 -27.558 -6.333 1.00 8.66 O ATOM 1951 CB ALA A 128 1.234 -25.201 -4.458 1.00 6.87 C ATOM 0 H ALA A 128 -1.074 -25.876 -3.986 1.00 8.89 H new ATOM 0 HA ALA A 128 0.414 -25.584 -6.420 1.00 8.16 H new ATOM 0 HB1 ALA A 128 2.265 -25.122 -4.802 1.00 6.87 H new ATOM 0 HB2 ALA A 128 0.795 -24.205 -4.396 1.00 6.87 H new ATOM 0 HB3 ALA A 128 1.215 -25.668 -3.473 1.00 6.87 H new ATOM 1957 N ALA A 129 0.613 -28.395 -4.792 1.00 8.95 N ATOM 1958 CA ALA A 129 1.132 -29.788 -4.742 1.00 9.43 C ATOM 1959 C ALA A 129 2.367 -29.862 -3.842 1.00 8.51 C ATOM 1960 O ALA A 129 2.456 -30.730 -2.970 1.00 8.76 O ATOM 1961 CB ALA A 129 1.427 -30.371 -6.129 1.00 10.42 C ATOM 0 H ALA A 129 -0.182 -28.246 -4.171 1.00 8.95 H new ATOM 0 HA ALA A 129 0.341 -30.405 -4.317 1.00 9.43 H new ATOM 0 HB1 ALA A 129 1.802 -31.389 -6.024 1.00 10.42 H new ATOM 0 HB2 ALA A 129 0.512 -30.381 -6.721 1.00 10.42 H new ATOM 0 HB3 ALA A 129 2.176 -29.758 -6.629 1.00 10.42 H new ATOM 1967 N ILE A 130 3.317 -28.933 -4.077 1.00 7.54 N ATOM 1968 CA ILE A 130 4.563 -28.795 -3.296 1.00 6.69 C ATOM 1969 C ILE A 130 5.337 -30.127 -3.127 1.00 6.68 C ATOM 1970 O ILE A 130 5.101 -31.096 -3.853 1.00 6.97 O ATOM 1971 CB ILE A 130 4.255 -28.094 -1.919 1.00 5.80 C ATOM 1972 CG1 ILE A 130 5.437 -27.242 -1.449 1.00 5.43 C ATOM 1973 CG2 ILE A 130 3.804 -29.062 -0.821 1.00 6.19 C ATOM 1974 CD1 ILE A 130 5.297 -25.784 -1.828 1.00 4.53 C ATOM 0 H ILE A 130 3.238 -28.247 -4.827 1.00 7.54 H new ATOM 0 HA ILE A 130 5.240 -28.158 -3.866 1.00 6.69 H new ATOM 0 HB ILE A 130 3.406 -27.437 -2.108 1.00 5.80 H new ATOM 0 HG12 ILE A 130 5.530 -27.324 -0.366 1.00 5.43 H new ATOM 0 HG13 ILE A 130 6.357 -27.637 -1.879 1.00 5.43 H new ATOM 0 HG21 ILE A 130 3.611 -28.507 0.097 1.00 6.19 H new ATOM 0 HG22 ILE A 130 2.893 -29.571 -1.136 1.00 6.19 H new ATOM 0 HG23 ILE A 130 4.587 -29.799 -0.641 1.00 6.19 H new ATOM 0 HD11 ILE A 130 6.164 -25.230 -1.469 1.00 4.53 H new ATOM 0 HD12 ILE A 130 5.233 -25.694 -2.912 1.00 4.53 H new ATOM 0 HD13 ILE A 130 4.393 -25.376 -1.376 1.00 4.53 H new ATOM 1986 N ASP A 131 6.264 -30.132 -2.151 1.00 6.58 N ATOM 1987 CA ASP A 131 7.122 -31.289 -1.805 1.00 6.68 C ATOM 1988 C ASP A 131 8.088 -31.660 -2.940 1.00 6.59 C ATOM 1989 O ASP A 131 7.920 -31.228 -4.084 1.00 6.80 O ATOM 1990 CB ASP A 131 6.273 -32.511 -1.385 1.00 7.70 C ATOM 1991 CG ASP A 131 7.012 -33.446 -0.442 1.00 7.98 C ATOM 1992 OD1 ASP A 131 6.915 -33.248 0.787 1.00 8.18 O ATOM 1993 OD2 ASP A 131 7.686 -34.375 -0.935 1.00 8.25 O ATOM 0 H ASP A 131 6.444 -29.316 -1.566 1.00 6.58 H new ATOM 0 HA ASP A 131 7.729 -30.984 -0.953 1.00 6.68 H new ATOM 0 HB2 ASP A 131 5.359 -32.164 -0.903 1.00 7.70 H new ATOM 0 HB3 ASP A 131 5.974 -33.063 -2.276 1.00 7.70 H new ATOM 1998 N GLY A 132 9.096 -32.469 -2.591 1.00 6.49 N ATOM 1999 CA GLY A 132 10.106 -32.888 -3.545 1.00 6.52 C ATOM 2000 C GLY A 132 11.387 -32.106 -3.360 1.00 5.87 C ATOM 2001 O GLY A 132 12.452 -32.688 -3.131 1.00 6.01 O ATOM 0 H GLY A 132 9.226 -32.842 -1.651 1.00 6.49 H new ATOM 0 HA2 GLY A 132 10.306 -33.953 -3.424 1.00 6.52 H new ATOM 0 HA3 GLY A 132 9.733 -32.747 -4.560 1.00 6.52 H new ATOM 2005 N ASP A 133 11.270 -30.780 -3.462 1.00 5.34 N ATOM 2006 CA ASP A 133 12.397 -29.875 -3.294 1.00 4.95 C ATOM 2007 C ASP A 133 12.154 -29.034 -2.076 1.00 4.57 C ATOM 2008 O ASP A 133 13.081 -28.630 -1.368 1.00 4.65 O ATOM 2009 CB ASP A 133 12.502 -28.922 -4.462 1.00 4.99 C ATOM 2010 CG ASP A 133 13.930 -28.720 -4.928 1.00 5.63 C ATOM 2011 OD1 ASP A 133 14.379 -29.481 -5.811 1.00 6.07 O ATOM 2012 OD2 ASP A 133 14.599 -27.800 -4.412 1.00 5.97 O ATOM 0 H ASP A 133 10.388 -30.308 -3.664 1.00 5.34 H new ATOM 0 HA ASP A 133 13.306 -30.472 -3.214 1.00 4.95 H new ATOM 0 HB2 ASP A 133 11.905 -29.303 -5.290 1.00 4.99 H new ATOM 0 HB3 ASP A 133 12.077 -27.959 -4.179 1.00 4.99 H new ATOM 2017 N GLY A 134 10.864 -28.786 -1.858 1.00 4.47 N ATOM 2018 CA GLY A 134 10.436 -27.979 -0.772 1.00 4.33 C ATOM 2019 C GLY A 134 10.086 -26.549 -1.174 1.00 3.73 C ATOM 2020 O GLY A 134 9.466 -25.821 -0.393 1.00 3.75 O ATOM 0 H GLY A 134 10.108 -29.147 -2.439 1.00 4.47 H new ATOM 0 HA2 GLY A 134 9.564 -28.441 -0.309 1.00 4.33 H new ATOM 0 HA3 GLY A 134 11.222 -27.953 -0.017 1.00 4.33 H new ATOM 2024 N GLN A 135 10.485 -26.154 -2.391 1.00 3.55 N ATOM 2025 CA GLN A 135 10.221 -24.806 -2.912 1.00 3.33 C ATOM 2026 C GLN A 135 9.099 -24.833 -3.959 1.00 3.69 C ATOM 2027 O GLN A 135 8.689 -25.908 -4.410 1.00 4.33 O ATOM 2028 CB GLN A 135 11.488 -24.206 -3.529 1.00 3.82 C ATOM 2029 CG GLN A 135 12.660 -24.075 -2.563 1.00 4.41 C ATOM 2030 CD GLN A 135 13.895 -23.489 -3.221 1.00 5.26 C ATOM 2031 OE1 GLN A 135 14.087 -22.273 -3.236 1.00 5.74 O ATOM 2032 NE2 GLN A 135 14.739 -24.354 -3.771 1.00 5.78 N ATOM 0 H GLN A 135 10.996 -26.755 -3.038 1.00 3.55 H new ATOM 0 HA GLN A 135 9.905 -24.183 -2.075 1.00 3.33 H new ATOM 0 HB2 GLN A 135 11.795 -24.826 -4.371 1.00 3.82 H new ATOM 0 HB3 GLN A 135 11.251 -23.220 -3.928 1.00 3.82 H new ATOM 0 HG2 GLN A 135 12.366 -23.444 -1.724 1.00 4.41 H new ATOM 0 HG3 GLN A 135 12.901 -25.056 -2.155 1.00 4.41 H new ATOM 0 HE21 GLN A 135 14.540 -25.354 -3.735 1.00 5.78 H new ATOM 0 HE22 GLN A 135 15.586 -24.019 -4.229 1.00 5.78 H new ATOM 2041 N VAL A 136 8.611 -23.643 -4.340 1.00 3.59 N ATOM 2042 CA VAL A 136 7.555 -23.506 -5.332 1.00 4.23 C ATOM 2043 C VAL A 136 7.909 -22.393 -6.328 1.00 4.67 C ATOM 2044 O VAL A 136 9.061 -21.971 -6.407 1.00 4.74 O ATOM 2045 CB VAL A 136 6.162 -23.280 -4.646 1.00 4.02 C ATOM 2046 CG1 VAL A 136 5.980 -21.856 -4.116 1.00 3.51 C ATOM 2047 CG2 VAL A 136 5.000 -23.676 -5.561 1.00 5.08 C ATOM 0 H VAL A 136 8.943 -22.754 -3.965 1.00 3.59 H new ATOM 0 HA VAL A 136 7.473 -24.435 -5.896 1.00 4.23 H new ATOM 0 HB VAL A 136 6.150 -23.943 -3.781 1.00 4.02 H new ATOM 0 HG11 VAL A 136 4.998 -21.763 -3.653 1.00 3.51 H new ATOM 0 HG12 VAL A 136 6.751 -21.642 -3.376 1.00 3.51 H new ATOM 0 HG13 VAL A 136 6.061 -21.148 -4.941 1.00 3.51 H new ATOM 0 HG21 VAL A 136 4.055 -23.503 -5.045 1.00 5.08 H new ATOM 0 HG22 VAL A 136 5.032 -23.076 -6.470 1.00 5.08 H new ATOM 0 HG23 VAL A 136 5.084 -24.732 -5.820 1.00 5.08 H new ATOM 2057 N ASN A 137 6.915 -21.948 -7.083 1.00 5.28 N ATOM 2058 CA ASN A 137 7.112 -20.882 -8.069 1.00 5.95 C ATOM 2059 C ASN A 137 6.431 -19.583 -7.615 1.00 5.49 C ATOM 2060 O ASN A 137 5.948 -19.478 -6.483 1.00 4.60 O ATOM 2061 CB ASN A 137 6.620 -21.293 -9.474 1.00 7.18 C ATOM 2062 CG ASN A 137 7.130 -22.653 -9.921 1.00 7.90 C ATOM 2063 OD1 ASN A 137 8.150 -22.754 -10.603 1.00 8.11 O ATOM 2064 ND2 ASN A 137 6.419 -23.707 -9.537 1.00 8.51 N ATOM 0 H ASN A 137 5.961 -22.306 -7.036 1.00 5.28 H new ATOM 0 HA ASN A 137 8.185 -20.705 -8.139 1.00 5.95 H new ATOM 0 HB2 ASN A 137 5.530 -21.303 -9.480 1.00 7.18 H new ATOM 0 HB3 ASN A 137 6.936 -20.540 -10.196 1.00 7.18 H new ATOM 0 HD21 ASN A 137 6.712 -24.646 -9.807 1.00 8.51 H new ATOM 0 HD22 ASN A 137 5.580 -23.578 -8.972 1.00 8.51 H new ATOM 2071 N TYR A 138 6.406 -18.614 -8.524 1.00 6.22 N ATOM 2072 CA TYR A 138 5.842 -17.283 -8.295 1.00 6.03 C ATOM 2073 C TYR A 138 4.502 -17.122 -9.020 1.00 6.55 C ATOM 2074 O TYR A 138 3.573 -16.492 -8.508 1.00 6.13 O ATOM 2075 CB TYR A 138 6.839 -16.214 -8.798 1.00 6.78 C ATOM 2076 CG TYR A 138 7.487 -16.606 -10.108 1.00 7.93 C ATOM 2077 CD1 TYR A 138 8.188 -17.797 -10.203 1.00 8.62 C ATOM 2078 CD2 TYR A 138 7.335 -15.841 -11.250 1.00 8.50 C ATOM 2079 CE1 TYR A 138 8.715 -18.217 -11.373 1.00 9.65 C ATOM 2080 CE2 TYR A 138 7.883 -16.251 -12.446 1.00 9.54 C ATOM 2081 CZ TYR A 138 8.572 -17.447 -12.507 1.00 10.06 C ATOM 2082 OH TYR A 138 9.109 -17.872 -13.701 1.00 11.13 O ATOM 0 H TYR A 138 6.786 -18.732 -9.463 1.00 6.22 H new ATOM 0 HA TYR A 138 5.668 -17.157 -7.226 1.00 6.03 H new ATOM 0 HB2 TYR A 138 6.318 -15.264 -8.922 1.00 6.78 H new ATOM 0 HB3 TYR A 138 7.612 -16.058 -8.045 1.00 6.78 H new ATOM 0 HD1 TYR A 138 8.316 -18.405 -9.319 1.00 8.62 H new ATOM 0 HD2 TYR A 138 6.782 -14.914 -11.204 1.00 8.50 H new ATOM 0 HE1 TYR A 138 9.248 -19.155 -11.420 1.00 9.65 H new ATOM 0 HE2 TYR A 138 7.775 -15.641 -13.331 1.00 9.54 H new ATOM 0 HH TYR A 138 8.916 -17.212 -14.400 1.00 11.13 H new ATOM 2092 N GLU A 139 4.437 -17.710 -10.224 1.00 7.59 N ATOM 2093 CA GLU A 139 3.251 -17.660 -11.095 1.00 8.39 C ATOM 2094 C GLU A 139 2.178 -18.654 -10.662 1.00 8.26 C ATOM 2095 O GLU A 139 1.011 -18.525 -11.036 1.00 8.61 O ATOM 2096 CB GLU A 139 3.659 -17.993 -12.524 1.00 9.64 C ATOM 2097 CG GLU A 139 4.489 -16.914 -13.207 1.00 10.21 C ATOM 2098 CD GLU A 139 4.868 -17.283 -14.628 1.00 11.39 C ATOM 2099 OE1 GLU A 139 5.938 -17.900 -14.816 1.00 11.90 O ATOM 2100 OE2 GLU A 139 4.096 -16.955 -15.553 1.00 11.94 O ATOM 0 H GLU A 139 5.212 -18.238 -10.625 1.00 7.59 H new ATOM 0 HA GLU A 139 2.839 -16.653 -11.025 1.00 8.39 H new ATOM 0 HB2 GLU A 139 4.227 -18.923 -12.520 1.00 9.64 H new ATOM 0 HB3 GLU A 139 2.760 -18.171 -13.114 1.00 9.64 H new ATOM 0 HG2 GLU A 139 3.928 -15.980 -13.215 1.00 10.21 H new ATOM 0 HG3 GLU A 139 5.395 -16.736 -12.628 1.00 10.21 H new ATOM 2107 N GLU A 140 2.603 -19.671 -9.924 1.00 7.94 N ATOM 2108 CA GLU A 140 1.695 -20.706 -9.434 1.00 8.10 C ATOM 2109 C GLU A 140 1.171 -20.419 -8.021 1.00 7.13 C ATOM 2110 O GLU A 140 -0.015 -20.624 -7.758 1.00 7.54 O ATOM 2111 CB GLU A 140 2.388 -22.077 -9.457 1.00 8.42 C ATOM 2112 CG GLU A 140 2.589 -22.656 -10.856 1.00 9.47 C ATOM 2113 CD GLU A 140 1.329 -23.287 -11.424 1.00 9.95 C ATOM 2114 OE1 GLU A 140 0.551 -22.568 -12.086 1.00 10.29 O ATOM 2115 OE2 GLU A 140 1.123 -24.500 -11.207 1.00 10.17 O ATOM 0 H GLU A 140 3.576 -19.804 -9.649 1.00 7.94 H new ATOM 0 HA GLU A 140 0.836 -20.709 -10.105 1.00 8.10 H new ATOM 0 HB2 GLU A 140 3.359 -21.988 -8.970 1.00 8.42 H new ATOM 0 HB3 GLU A 140 1.799 -22.779 -8.867 1.00 8.42 H new ATOM 0 HG2 GLU A 140 2.926 -21.865 -11.526 1.00 9.47 H new ATOM 0 HG3 GLU A 140 3.381 -23.405 -10.823 1.00 9.47 H new ATOM 2122 N PHE A 141 2.049 -19.952 -7.116 1.00 5.98 N ATOM 2123 CA PHE A 141 1.658 -19.699 -5.731 1.00 5.06 C ATOM 2124 C PHE A 141 1.055 -18.319 -5.451 1.00 4.76 C ATOM 2125 O PHE A 141 -0.118 -18.225 -5.076 1.00 5.06 O ATOM 2126 CB PHE A 141 2.817 -20.005 -4.776 1.00 3.97 C ATOM 2127 CG PHE A 141 2.346 -20.725 -3.560 1.00 3.73 C ATOM 2128 CD1 PHE A 141 1.723 -20.025 -2.553 1.00 3.83 C ATOM 2129 CD2 PHE A 141 2.481 -22.098 -3.451 1.00 4.10 C ATOM 2130 CE1 PHE A 141 1.233 -20.674 -1.450 1.00 4.24 C ATOM 2131 CE2 PHE A 141 2.003 -22.762 -2.335 1.00 4.47 C ATOM 2132 CZ PHE A 141 1.375 -22.037 -1.341 1.00 4.52 C ATOM 0 H PHE A 141 3.026 -19.745 -7.323 1.00 5.98 H new ATOM 0 HA PHE A 141 0.835 -20.389 -5.546 1.00 5.06 H new ATOM 0 HB2 PHE A 141 3.565 -20.608 -5.291 1.00 3.97 H new ATOM 0 HB3 PHE A 141 3.304 -19.075 -4.484 1.00 3.97 H new ATOM 0 HD1 PHE A 141 1.619 -18.953 -2.632 1.00 3.83 H new ATOM 0 HD2 PHE A 141 2.962 -22.655 -4.242 1.00 4.10 H new ATOM 0 HE1 PHE A 141 0.737 -20.117 -0.669 1.00 4.24 H new ATOM 0 HE2 PHE A 141 2.119 -23.832 -2.242 1.00 4.47 H new ATOM 0 HZ PHE A 141 0.992 -22.546 -0.469 1.00 4.52 H new ATOM 2142 N VAL A 142 1.848 -17.264 -5.626 1.00 4.40 N ATOM 2143 CA VAL A 142 1.392 -15.866 -5.368 1.00 4.15 C ATOM 2144 C VAL A 142 0.242 -15.527 -6.273 1.00 5.25 C ATOM 2145 O VAL A 142 -0.734 -14.893 -5.866 1.00 5.25 O ATOM 2146 CB VAL A 142 2.496 -14.793 -5.566 1.00 4.09 C ATOM 2147 CG1 VAL A 142 2.219 -13.545 -4.733 1.00 3.37 C ATOM 2148 CG2 VAL A 142 3.848 -15.356 -5.236 1.00 3.96 C ATOM 0 H VAL A 142 2.814 -17.333 -5.946 1.00 4.40 H new ATOM 0 HA VAL A 142 1.100 -15.843 -4.318 1.00 4.15 H new ATOM 0 HB VAL A 142 2.487 -14.501 -6.616 1.00 4.09 H new ATOM 0 HG11 VAL A 142 3.012 -12.815 -4.896 1.00 3.37 H new ATOM 0 HG12 VAL A 142 1.263 -13.114 -5.030 1.00 3.37 H new ATOM 0 HG13 VAL A 142 2.184 -13.813 -3.677 1.00 3.37 H new ATOM 0 HG21 VAL A 142 4.607 -14.588 -5.381 1.00 3.96 H new ATOM 0 HG22 VAL A 142 3.861 -15.687 -4.198 1.00 3.96 H new ATOM 0 HG23 VAL A 142 4.059 -16.203 -5.889 1.00 3.96 H new ATOM 2158 N GLN A 143 0.388 -15.949 -7.511 1.00 6.26 N ATOM 2159 CA GLN A 143 -0.664 -15.747 -8.507 1.00 7.42 C ATOM 2160 C GLN A 143 -1.958 -16.453 -8.084 1.00 7.74 C ATOM 2161 O GLN A 143 -3.052 -16.013 -8.451 1.00 8.48 O ATOM 2162 CB GLN A 143 -0.211 -16.209 -9.892 1.00 8.47 C ATOM 2163 CG GLN A 143 -0.838 -15.430 -11.041 1.00 9.24 C ATOM 2164 CD GLN A 143 -0.370 -15.916 -12.399 1.00 10.23 C ATOM 2165 OE1 GLN A 143 0.626 -15.431 -12.936 1.00 10.70 O ATOM 2166 NE2 GLN A 143 -1.090 -16.880 -12.962 1.00 10.74 N ATOM 0 H GLN A 143 1.216 -16.432 -7.859 1.00 6.26 H new ATOM 0 HA GLN A 143 -0.868 -14.678 -8.567 1.00 7.42 H new ATOM 0 HB2 GLN A 143 0.874 -16.121 -9.956 1.00 8.47 H new ATOM 0 HB3 GLN A 143 -0.453 -17.265 -10.008 1.00 8.47 H new ATOM 0 HG2 GLN A 143 -1.923 -15.515 -10.983 1.00 9.24 H new ATOM 0 HG3 GLN A 143 -0.595 -14.373 -10.934 1.00 9.24 H new ATOM 0 HE21 GLN A 143 -1.908 -17.253 -12.481 1.00 10.74 H new ATOM 0 HE22 GLN A 143 -0.824 -17.248 -13.876 1.00 10.74 H new ATOM 2175 N MET A 144 -1.824 -17.546 -7.314 1.00 7.32 N ATOM 2176 CA MET A 144 -2.986 -18.270 -6.818 1.00 7.88 C ATOM 2177 C MET A 144 -3.481 -17.723 -5.489 1.00 7.37 C ATOM 2178 O MET A 144 -4.521 -18.140 -4.968 1.00 8.01 O ATOM 2179 CB MET A 144 -2.726 -19.774 -6.739 1.00 8.04 C ATOM 2180 CG MET A 144 -3.859 -20.617 -7.306 1.00 9.33 C ATOM 2181 SD MET A 144 -3.954 -22.252 -6.555 1.00 9.76 S ATOM 2182 CE MET A 144 -4.962 -21.905 -5.114 1.00 9.64 C ATOM 0 H MET A 144 -0.927 -17.938 -7.028 1.00 7.32 H new ATOM 0 HA MET A 144 -3.783 -18.112 -7.544 1.00 7.88 H new ATOM 0 HB2 MET A 144 -1.807 -20.005 -7.278 1.00 8.04 H new ATOM 0 HB3 MET A 144 -2.563 -20.052 -5.698 1.00 8.04 H new ATOM 0 HG2 MET A 144 -4.805 -20.097 -7.154 1.00 9.33 H new ATOM 0 HG3 MET A 144 -3.723 -20.724 -8.382 1.00 9.33 H new ATOM 0 HE1 MET A 144 -4.646 -22.541 -4.287 1.00 9.64 H new ATOM 0 HE2 MET A 144 -4.846 -20.859 -4.832 1.00 9.64 H new ATOM 0 HE3 MET A 144 -6.008 -22.104 -5.345 1.00 9.64 H new ATOM 2192 N MET A 145 -2.719 -16.783 -4.973 1.00 6.37 N ATOM 2193 CA MET A 145 -3.057 -16.093 -3.724 1.00 5.88 C ATOM 2194 C MET A 145 -3.733 -14.767 -4.082 1.00 6.25 C ATOM 2195 O MET A 145 -4.353 -14.112 -3.239 1.00 6.33 O ATOM 2196 CB MET A 145 -1.831 -15.938 -2.777 1.00 4.66 C ATOM 2197 CG MET A 145 -0.981 -14.670 -2.949 1.00 3.68 C ATOM 2198 SD MET A 145 0.481 -14.569 -1.875 1.00 3.52 S ATOM 2199 CE MET A 145 1.331 -16.142 -2.069 1.00 3.45 C ATOM 0 H MET A 145 -1.847 -16.468 -5.398 1.00 6.37 H new ATOM 0 HA MET A 145 -3.757 -16.695 -3.144 1.00 5.88 H new ATOM 0 HB2 MET A 145 -2.190 -15.970 -1.748 1.00 4.66 H new ATOM 0 HB3 MET A 145 -1.183 -16.803 -2.915 1.00 4.66 H new ATOM 0 HG2 MET A 145 -0.655 -14.608 -3.987 1.00 3.68 H new ATOM 0 HG3 MET A 145 -1.611 -13.801 -2.761 1.00 3.68 H new ATOM 0 HE1 MET A 145 1.914 -16.354 -1.173 1.00 3.45 H new ATOM 0 HE2 MET A 145 0.599 -16.935 -2.221 1.00 3.45 H new ATOM 0 HE3 MET A 145 1.996 -16.092 -2.931 1.00 3.45 H new ATOM 2209 N THR A 146 -3.584 -14.402 -5.365 1.00 6.65 N ATOM 2210 CA THR A 146 -4.196 -13.213 -5.938 1.00 7.20 C ATOM 2211 C THR A 146 -5.500 -13.618 -6.643 1.00 8.45 C ATOM 2212 O THR A 146 -6.410 -12.798 -6.798 1.00 8.99 O ATOM 2213 CB THR A 146 -3.245 -12.520 -6.948 1.00 7.31 C ATOM 2214 OG1 THR A 146 -1.901 -12.533 -6.448 1.00 6.44 O ATOM 2215 CG2 THR A 146 -3.660 -11.074 -7.215 1.00 7.72 C ATOM 0 H THR A 146 -3.028 -14.936 -6.033 1.00 6.65 H new ATOM 0 HA THR A 146 -4.403 -12.504 -5.137 1.00 7.20 H new ATOM 0 HB THR A 146 -3.304 -13.076 -7.884 1.00 7.31 H new ATOM 0 HG1 THR A 146 -1.538 -13.441 -6.510 1.00 6.44 H new ATOM 0 HG21 THR A 146 -2.969 -10.623 -7.927 1.00 7.72 H new ATOM 0 HG22 THR A 146 -4.669 -11.055 -7.626 1.00 7.72 H new ATOM 0 HG23 THR A 146 -3.638 -10.511 -6.282 1.00 7.72 H new ATOM 2223 N ALA A 147 -5.570 -14.898 -7.065 1.00 8.92 N ATOM 2224 CA ALA A 147 -6.751 -15.438 -7.736 1.00 10.15 C ATOM 2225 C ALA A 147 -7.691 -16.123 -6.740 1.00 10.43 C ATOM 2226 O ALA A 147 -8.914 -16.078 -6.906 1.00 11.37 O ATOM 2227 CB ALA A 147 -6.335 -16.414 -8.825 1.00 10.68 C ATOM 0 H ALA A 147 -4.814 -15.572 -6.948 1.00 8.92 H new ATOM 0 HA ALA A 147 -7.291 -14.607 -8.190 1.00 10.15 H new ATOM 0 HB1 ALA A 147 -7.223 -16.810 -9.318 1.00 10.68 H new ATOM 0 HB2 ALA A 147 -5.713 -15.899 -9.557 1.00 10.68 H new ATOM 0 HB3 ALA A 147 -5.770 -17.234 -8.382 1.00 10.68 H new ATOM 2233 N LYS A 148 -7.108 -16.753 -5.707 1.00 9.72 N ATOM 2234 CA LYS A 148 -7.873 -17.447 -4.682 1.00 10.13 C ATOM 2235 C LYS A 148 -7.342 -17.113 -3.288 1.00 9.70 C ATOM 2236 O LYS A 148 -8.112 -16.545 -2.485 1.00 9.60 O ATOM 2237 CB LYS A 148 -7.855 -18.970 -4.909 1.00 10.60 C ATOM 2238 CG LYS A 148 -8.730 -19.446 -6.067 1.00 11.38 C ATOM 2239 CD LYS A 148 -7.967 -19.465 -7.386 1.00 11.36 C ATOM 2240 CE LYS A 148 -8.842 -19.937 -8.539 1.00 12.34 C ATOM 2241 NZ LYS A 148 -9.844 -18.910 -8.943 1.00 12.59 N ATOM 2242 OXT LYS A 148 -6.158 -17.411 -3.014 1.00 9.69 O ATOM 0 H LYS A 148 -6.098 -16.790 -5.568 1.00 9.72 H new ATOM 0 HA LYS A 148 -8.905 -17.104 -4.752 1.00 10.13 H new ATOM 0 HB2 LYS A 148 -6.828 -19.286 -5.092 1.00 10.60 H new ATOM 0 HB3 LYS A 148 -8.182 -19.465 -3.995 1.00 10.60 H new ATOM 0 HG2 LYS A 148 -9.106 -20.446 -5.851 1.00 11.38 H new ATOM 0 HG3 LYS A 148 -9.597 -18.792 -6.159 1.00 11.38 H new ATOM 0 HD2 LYS A 148 -7.589 -18.466 -7.602 1.00 11.36 H new ATOM 0 HD3 LYS A 148 -7.101 -20.120 -7.295 1.00 11.36 H new ATOM 0 HE2 LYS A 148 -8.212 -20.183 -9.394 1.00 12.34 H new ATOM 0 HE3 LYS A 148 -9.359 -20.852 -8.250 1.00 12.34 H new ATOM 0 HZ1 LYS A 148 -10.417 -19.275 -9.731 1.00 12.59 H new ATOM 0 HZ2 LYS A 148 -10.463 -18.693 -8.136 1.00 12.59 H new ATOM 0 HZ3 LYS A 148 -9.352 -18.045 -9.245 1.00 12.59 H new