USER MOD reduce.3.24.130724 H: found=0, std=0, add=661, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 661 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 68 ASN : amide:sc= 0.182 K(o=0.27,f=-1.8) USER MOD Set 1.2: A 70 THR OG1 : rot 180:sc= 0.0903 USER MOD Set 2.1: A 57 GLN : amide:sc=-0.00225 K(o=0.13,f=-3.2!) USER MOD Set 2.2: A 88 GLN : amide:sc= 0.134 K(o=0.13,f=-3.3) USER MOD Set 3.1: A 19 ASN : amide:sc= 1.14 K(o=1.1,f=-0.26) USER MOD Set 3.2: A 31 GLN : amide:sc=0.000387 X(o=1.1,f=0.89) USER MOD Single : A 17 HIS : no HD1:sc= -0.267 X(o=-0.27,f=-0.074) USER MOD Single : A 21 LYS NZ :NH3+ -159:sc= 1.34 (180deg=0.956) USER MOD Single : A 25 GLN : amide:sc= 1.15 K(o=1.1,f=-0.79) USER MOD Single : A 28 SER OG : rot -97:sc= 1.22 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= -0.0627 K(o=-0.063,f=-0.67) USER MOD Single : A 38 THR OG1 : rot -160:sc= -2.66! USER MOD Single : A 41 SER OG : rot -100:sc= 1.36 USER MOD Single : A 42 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0107) USER MOD Single : A 44 MET CE :methyl -173:sc= -0.389 (180deg=-0.661) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -67:sc= -1.22 USER MOD Single : A 51 GLN : amide:sc= -0.217 X(o=-0.22,f=-0.22) USER MOD Single : A 54 SER OG : rot 180:sc= 0.0501 USER MOD Single : A 55 MET CE :methyl 162:sc= -0.0531 (180deg=-0.477) USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 72 THR OG1 : rot 180:sc= -1.26 USER MOD Single : A 75 GLN : amide:sc= -0.272 K(o=-0.27,f=-0.8) USER MOD Single : A 78 MET CE :methyl -117:sc= -0.647 (180deg=-0.826) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.0255 K(o=-0.026,f=-0.54) USER MOD Single : A 90 GLN : amide:sc= -0.415 K(o=-0.41,f=-3.8!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0288 USER MOD Single : B 196 THR OG1 : rot 180:sc= 0 USER MOD Single : B 199 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N HIS A 17 7.790 13.148 1.178 1.00 10.00 N ATOM 14 CA HIS A 17 6.724 12.162 1.276 1.00 10.00 C ATOM 15 C HIS A 17 5.379 12.794 0.942 1.00 10.00 C ATOM 16 O HIS A 17 5.007 13.817 1.514 1.00 10.00 O ATOM 17 CB HIS A 17 6.673 11.561 2.684 1.00 10.00 C ATOM 18 CG HIS A 17 7.689 10.488 2.930 1.00 10.00 C ATOM 19 ND1 HIS A 17 8.782 10.705 3.737 1.00 10.00 N ATOM 20 CD2 HIS A 17 7.722 9.212 2.472 1.00 10.00 C ATOM 21 CE1 HIS A 17 9.450 9.564 3.754 1.00 10.00 C ATOM 22 NE2 HIS A 17 8.846 8.634 3.005 1.00 10.00 N ATOM 0 HA HIS A 17 6.933 11.368 0.559 1.00 10.00 H new ATOM 0 HB2 HIS A 17 6.819 12.358 3.413 1.00 10.00 H new ATOM 0 HB3 HIS A 17 5.678 11.150 2.856 1.00 10.00 H new ATOM 0 HD2 HIS A 17 7.004 8.743 1.816 1.00 10.00 H new ATOM 0 HE1 HIS A 17 10.366 9.403 4.302 1.00 10.00 H new ATOM 0 HE2 HIS A 17 9.162 7.675 2.858 1.00 10.00 H new ATOM 30 N ILE A 18 4.655 12.187 0.013 1.00 10.00 N ATOM 31 CA ILE A 18 3.350 12.688 -0.382 1.00 10.00 C ATOM 32 C ILE A 18 2.263 11.953 0.396 1.00 10.00 C ATOM 33 O ILE A 18 2.349 10.741 0.613 1.00 10.00 O ATOM 34 CB ILE A 18 3.116 12.554 -1.910 1.00 10.00 C ATOM 35 CG1 ILE A 18 1.709 13.028 -2.282 1.00 10.00 C ATOM 36 CG2 ILE A 18 3.337 11.123 -2.378 1.00 10.00 C ATOM 37 CD1 ILE A 18 1.426 12.971 -3.765 1.00 10.00 C ATOM 0 H ILE A 18 4.951 11.345 -0.481 1.00 10.00 H new ATOM 0 HA ILE A 18 3.309 13.751 -0.146 1.00 10.00 H new ATOM 0 HB ILE A 18 3.843 13.189 -2.416 1.00 10.00 H new ATOM 0 HG12 ILE A 18 0.977 12.415 -1.757 1.00 10.00 H new ATOM 0 HG13 ILE A 18 1.575 14.052 -1.934 1.00 10.00 H new ATOM 0 HG21 ILE A 18 3.166 11.061 -3.453 1.00 10.00 H new ATOM 0 HG22 ILE A 18 4.361 10.822 -2.156 1.00 10.00 H new ATOM 0 HG23 ILE A 18 2.643 10.460 -1.861 1.00 10.00 H new ATOM 0 HD11 ILE A 18 0.412 13.321 -3.956 1.00 10.00 H new ATOM 0 HD12 ILE A 18 2.135 13.607 -4.295 1.00 10.00 H new ATOM 0 HD13 ILE A 18 1.527 11.944 -4.115 1.00 10.00 H new ATOM 49 N ASN A 19 1.257 12.694 0.834 1.00 10.00 N ATOM 50 CA ASN A 19 0.163 12.117 1.607 1.00 10.00 C ATOM 51 C ASN A 19 -1.012 11.765 0.710 1.00 10.00 C ATOM 52 O ASN A 19 -1.678 12.645 0.171 1.00 10.00 O ATOM 53 CB ASN A 19 -0.301 13.089 2.696 1.00 10.00 C ATOM 54 CG ASN A 19 0.822 13.512 3.621 1.00 10.00 C ATOM 55 OD1 ASN A 19 1.228 12.761 4.508 1.00 10.00 O ATOM 56 ND2 ASN A 19 1.318 14.726 3.436 1.00 10.00 N ATOM 0 H ASN A 19 1.173 13.697 0.668 1.00 10.00 H new ATOM 0 HA ASN A 19 0.535 11.205 2.074 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -0.733 13.973 2.228 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -1.092 12.621 3.282 1.00 10.00 H new ATOM 0 HD21 ASN A 19 2.064 15.070 4.040 1.00 10.00 H new ATOM 0 HD22 ASN A 19 0.954 15.317 2.689 1.00 10.00 H new ATOM 63 N LEU A 20 -1.259 10.476 0.544 1.00 10.00 N ATOM 64 CA LEU A 20 -2.366 10.015 -0.281 1.00 10.00 C ATOM 65 C LEU A 20 -3.467 9.437 0.596 1.00 10.00 C ATOM 66 O LEU A 20 -3.207 8.965 1.703 1.00 10.00 O ATOM 67 CB LEU A 20 -1.888 8.975 -1.299 1.00 10.00 C ATOM 68 CG LEU A 20 -0.842 9.480 -2.298 1.00 10.00 C ATOM 69 CD1 LEU A 20 -0.409 8.359 -3.228 1.00 10.00 C ATOM 70 CD2 LEU A 20 -1.385 10.654 -3.099 1.00 10.00 C ATOM 0 H LEU A 20 -0.709 9.730 0.969 1.00 10.00 H new ATOM 0 HA LEU A 20 -2.767 10.867 -0.830 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -1.472 8.125 -0.759 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -2.751 8.608 -1.854 1.00 10.00 H new ATOM 0 HG LEU A 20 0.028 9.821 -1.737 1.00 10.00 H new ATOM 0 HD11 LEU A 20 0.334 8.736 -3.931 1.00 10.00 H new ATOM 0 HD12 LEU A 20 0.024 7.547 -2.643 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -1.274 7.988 -3.778 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -0.626 10.997 -3.802 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -2.273 10.340 -3.648 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -1.646 11.467 -2.422 1.00 10.00 H new ATOM 82 N LYS A 21 -4.693 9.484 0.106 1.00 10.00 N ATOM 83 CA LYS A 21 -5.835 8.973 0.851 1.00 10.00 C ATOM 84 C LYS A 21 -6.484 7.807 0.119 1.00 10.00 C ATOM 85 O LYS A 21 -6.716 7.872 -1.087 1.00 10.00 O ATOM 86 CB LYS A 21 -6.871 10.079 1.064 1.00 10.00 C ATOM 87 CG LYS A 21 -6.341 11.276 1.835 1.00 10.00 C ATOM 88 CD LYS A 21 -7.380 12.378 1.925 1.00 10.00 C ATOM 89 CE LYS A 21 -6.829 13.608 2.625 1.00 10.00 C ATOM 90 NZ LYS A 21 -7.813 14.719 2.662 1.00 10.00 N ATOM 0 H LYS A 21 -4.926 9.872 -0.808 1.00 10.00 H new ATOM 0 HA LYS A 21 -5.473 8.624 1.818 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.234 10.416 0.093 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -7.726 9.665 1.598 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -6.050 10.965 2.838 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -5.444 11.658 1.347 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -7.714 12.647 0.923 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -8.254 12.012 2.464 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -6.541 13.346 3.643 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -5.926 13.941 2.114 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -7.314 15.620 2.810 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -8.331 14.754 1.761 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -8.484 14.563 3.441 1.00 10.00 H new ATOM 104 N VAL A 22 -6.766 6.742 0.851 1.00 10.00 N ATOM 105 CA VAL A 22 -7.399 5.563 0.275 1.00 10.00 C ATOM 106 C VAL A 22 -8.888 5.544 0.603 1.00 10.00 C ATOM 107 O VAL A 22 -9.274 5.610 1.773 1.00 10.00 O ATOM 108 CB VAL A 22 -6.755 4.261 0.795 1.00 10.00 C ATOM 109 CG1 VAL A 22 -7.332 3.047 0.080 1.00 10.00 C ATOM 110 CG2 VAL A 22 -5.242 4.307 0.642 1.00 10.00 C ATOM 0 H VAL A 22 -6.567 6.668 1.849 1.00 10.00 H new ATOM 0 HA VAL A 22 -7.257 5.617 -0.804 1.00 10.00 H new ATOM 0 HB VAL A 22 -6.987 4.171 1.856 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -6.862 2.141 0.464 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -8.407 3.000 0.253 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -7.140 3.130 -0.990 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -4.810 3.378 1.015 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.986 4.429 -0.411 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -4.844 5.147 1.212 1.00 10.00 H new ATOM 120 N ALA A 23 -9.720 5.465 -0.425 1.00 10.00 N ATOM 121 CA ALA A 23 -11.165 5.437 -0.234 1.00 10.00 C ATOM 122 C ALA A 23 -11.673 4.006 -0.108 1.00 10.00 C ATOM 123 O ALA A 23 -11.574 3.215 -1.046 1.00 10.00 O ATOM 124 CB ALA A 23 -11.867 6.157 -1.373 1.00 10.00 C ATOM 0 H ALA A 23 -9.421 5.419 -1.399 1.00 10.00 H new ATOM 0 HA ALA A 23 -11.393 5.957 0.696 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -12.945 6.126 -1.214 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -11.535 7.195 -1.407 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -11.626 5.668 -2.317 1.00 10.00 H new ATOM 130 N GLY A 24 -12.209 3.682 1.060 1.00 10.00 N ATOM 131 CA GLY A 24 -12.724 2.349 1.295 1.00 10.00 C ATOM 132 C GLY A 24 -14.203 2.253 0.984 1.00 10.00 C ATOM 133 O GLY A 24 -14.916 3.258 1.007 1.00 10.00 O ATOM 0 H GLY A 24 -12.296 4.320 1.851 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -12.176 1.635 0.680 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -12.553 2.072 2.335 1.00 10.00 H new ATOM 137 N GLN A 25 -14.669 1.048 0.701 1.00 10.00 N ATOM 138 CA GLN A 25 -16.072 0.826 0.375 1.00 10.00 C ATOM 139 C GLN A 25 -16.954 0.950 1.617 1.00 10.00 C ATOM 140 O GLN A 25 -18.093 1.413 1.534 1.00 10.00 O ATOM 141 CB GLN A 25 -16.257 -0.549 -0.267 1.00 10.00 C ATOM 142 CG GLN A 25 -15.623 -0.664 -1.642 1.00 10.00 C ATOM 143 CD GLN A 25 -16.364 0.131 -2.700 1.00 10.00 C ATOM 144 OE1 GLN A 25 -17.584 0.280 -2.647 1.00 10.00 O ATOM 145 NE2 GLN A 25 -15.632 0.655 -3.669 1.00 10.00 N ATOM 0 H GLN A 25 -14.096 0.204 0.690 1.00 10.00 H new ATOM 0 HA GLN A 25 -16.377 1.594 -0.336 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -15.828 -1.308 0.387 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -17.323 -0.764 -0.348 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -14.591 -0.318 -1.591 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -15.593 -1.713 -1.937 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -14.622 0.511 -3.681 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -16.077 1.204 -4.405 1.00 10.00 H new ATOM 154 N ASP A 26 -16.417 0.562 2.766 1.00 10.00 N ATOM 155 CA ASP A 26 -17.166 0.626 4.020 1.00 10.00 C ATOM 156 C ASP A 26 -17.021 1.995 4.686 1.00 10.00 C ATOM 157 O ASP A 26 -17.785 2.338 5.591 1.00 10.00 O ATOM 158 CB ASP A 26 -16.710 -0.479 4.979 1.00 10.00 C ATOM 159 CG ASP A 26 -15.366 -0.198 5.623 1.00 10.00 C ATOM 160 OD1 ASP A 26 -14.496 0.411 4.965 1.00 10.00 O ATOM 161 OD2 ASP A 26 -15.168 -0.597 6.789 1.00 10.00 O ATOM 0 H ASP A 26 -15.468 0.200 2.859 1.00 10.00 H new ATOM 0 HA ASP A 26 -18.219 0.474 3.783 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -17.460 -0.605 5.760 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -16.654 -1.422 4.435 1.00 10.00 H new ATOM 166 N GLY A 27 -16.038 2.769 4.242 1.00 10.00 N ATOM 167 CA GLY A 27 -15.828 4.092 4.797 1.00 10.00 C ATOM 168 C GLY A 27 -14.488 4.247 5.494 1.00 10.00 C ATOM 169 O GLY A 27 -14.103 5.363 5.851 1.00 10.00 O ATOM 0 H GLY A 27 -15.382 2.504 3.507 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -15.901 4.829 3.997 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -16.626 4.311 5.506 1.00 10.00 H new ATOM 173 N SER A 28 -13.781 3.138 5.699 1.00 10.00 N ATOM 174 CA SER A 28 -12.474 3.172 6.359 1.00 10.00 C ATOM 175 C SER A 28 -11.516 4.104 5.615 1.00 10.00 C ATOM 176 O SER A 28 -11.373 4.018 4.394 1.00 10.00 O ATOM 177 CB SER A 28 -11.886 1.760 6.439 1.00 10.00 C ATOM 178 OG SER A 28 -12.047 1.065 5.212 1.00 10.00 O ATOM 0 H SER A 28 -14.088 2.206 5.419 1.00 10.00 H new ATOM 0 HA SER A 28 -12.609 3.556 7.370 1.00 10.00 H new ATOM 0 HB2 SER A 28 -10.827 1.818 6.690 1.00 10.00 H new ATOM 0 HB3 SER A 28 -12.374 1.205 7.241 1.00 10.00 H new ATOM 0 HG SER A 28 -12.838 0.489 5.264 1.00 10.00 H new ATOM 184 N VAL A 29 -10.874 5.006 6.345 1.00 10.00 N ATOM 185 CA VAL A 29 -9.949 5.944 5.733 1.00 10.00 C ATOM 186 C VAL A 29 -8.505 5.570 6.060 1.00 10.00 C ATOM 187 O VAL A 29 -8.123 5.425 7.227 1.00 10.00 O ATOM 188 CB VAL A 29 -10.243 7.406 6.157 1.00 10.00 C ATOM 189 CG1 VAL A 29 -10.178 7.563 7.667 1.00 10.00 C ATOM 190 CG2 VAL A 29 -9.284 8.371 5.472 1.00 10.00 C ATOM 0 H VAL A 29 -10.977 5.106 7.355 1.00 10.00 H new ATOM 0 HA VAL A 29 -10.090 5.882 4.654 1.00 10.00 H new ATOM 0 HB VAL A 29 -11.257 7.648 5.839 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -10.388 8.599 7.935 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -10.917 6.911 8.133 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -9.182 7.293 8.018 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -9.509 9.391 5.784 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -8.259 8.124 5.750 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -9.396 8.290 4.391 1.00 10.00 H new ATOM 200 N VAL A 30 -7.709 5.390 5.022 1.00 10.00 N ATOM 201 CA VAL A 30 -6.314 5.022 5.186 1.00 10.00 C ATOM 202 C VAL A 30 -5.400 6.068 4.558 1.00 10.00 C ATOM 203 O VAL A 30 -5.578 6.444 3.398 1.00 10.00 O ATOM 204 CB VAL A 30 -6.018 3.636 4.566 1.00 10.00 C ATOM 205 CG1 VAL A 30 -4.534 3.292 4.663 1.00 10.00 C ATOM 206 CG2 VAL A 30 -6.863 2.560 5.237 1.00 10.00 C ATOM 0 H VAL A 30 -8.006 5.493 4.052 1.00 10.00 H new ATOM 0 HA VAL A 30 -6.118 4.972 6.257 1.00 10.00 H new ATOM 0 HB VAL A 30 -6.282 3.677 3.509 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.358 2.312 4.219 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -3.951 4.043 4.129 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -4.232 3.275 5.710 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -6.642 1.591 4.788 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -6.633 2.528 6.302 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -7.920 2.790 5.101 1.00 10.00 H new ATOM 216 N GLN A 31 -4.443 6.544 5.338 1.00 10.00 N ATOM 217 CA GLN A 31 -3.481 7.526 4.868 1.00 10.00 C ATOM 218 C GLN A 31 -2.241 6.804 4.362 1.00 10.00 C ATOM 219 O GLN A 31 -1.632 6.009 5.086 1.00 10.00 O ATOM 220 CB GLN A 31 -3.104 8.505 5.983 1.00 10.00 C ATOM 221 CG GLN A 31 -2.271 9.687 5.499 1.00 10.00 C ATOM 222 CD GLN A 31 -1.730 10.540 6.635 1.00 10.00 C ATOM 223 OE1 GLN A 31 -2.340 10.645 7.702 1.00 10.00 O ATOM 224 NE2 GLN A 31 -0.579 11.158 6.416 1.00 10.00 N ATOM 0 H GLN A 31 -4.312 6.262 6.309 1.00 10.00 H new ATOM 0 HA GLN A 31 -3.930 8.101 4.058 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -4.015 8.880 6.450 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -2.548 7.970 6.753 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -1.438 9.316 4.902 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -2.880 10.309 4.844 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -0.103 11.047 5.521 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -0.169 11.744 7.143 1.00 10.00 H new ATOM 233 N PHE A 32 -1.873 7.078 3.127 1.00 10.00 N ATOM 234 CA PHE A 32 -0.726 6.436 2.519 1.00 10.00 C ATOM 235 C PHE A 32 0.473 7.366 2.458 1.00 10.00 C ATOM 236 O PHE A 32 0.406 8.454 1.886 1.00 10.00 O ATOM 237 CB PHE A 32 -1.080 5.959 1.116 1.00 10.00 C ATOM 238 CG PHE A 32 -0.803 4.502 0.904 1.00 10.00 C ATOM 239 CD1 PHE A 32 -1.828 3.575 0.955 1.00 10.00 C ATOM 240 CD2 PHE A 32 0.484 4.059 0.658 1.00 10.00 C ATOM 241 CE1 PHE A 32 -1.576 2.231 0.764 1.00 10.00 C ATOM 242 CE2 PHE A 32 0.742 2.717 0.465 1.00 10.00 C ATOM 243 CZ PHE A 32 -0.289 1.802 0.518 1.00 10.00 C ATOM 0 H PHE A 32 -2.354 7.744 2.523 1.00 10.00 H new ATOM 0 HA PHE A 32 -0.456 5.583 3.141 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -2.136 6.153 0.928 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -0.515 6.540 0.388 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -2.838 3.906 1.147 1.00 10.00 H new ATOM 0 HD2 PHE A 32 1.295 4.771 0.617 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.385 1.517 0.807 1.00 10.00 H new ATOM 0 HE2 PHE A 32 1.751 2.383 0.273 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.088 0.752 0.367 1.00 10.00 H new ATOM 253 N LYS A 33 1.562 6.928 3.061 1.00 10.00 N ATOM 254 CA LYS A 33 2.799 7.682 3.063 1.00 10.00 C ATOM 255 C LYS A 33 3.741 7.059 2.043 1.00 10.00 C ATOM 256 O LYS A 33 4.233 5.945 2.234 1.00 10.00 O ATOM 257 CB LYS A 33 3.426 7.684 4.459 1.00 10.00 C ATOM 258 CG LYS A 33 4.692 8.517 4.561 1.00 10.00 C ATOM 259 CD LYS A 33 5.090 8.737 6.009 1.00 10.00 C ATOM 260 CE LYS A 33 6.287 9.668 6.121 1.00 10.00 C ATOM 261 NZ LYS A 33 6.697 9.883 7.531 1.00 10.00 N ATOM 0 H LYS A 33 1.613 6.041 3.562 1.00 10.00 H new ATOM 0 HA LYS A 33 2.604 8.720 2.794 1.00 10.00 H new ATOM 0 HB2 LYS A 33 2.695 8.061 5.175 1.00 10.00 H new ATOM 0 HB3 LYS A 33 3.653 6.657 4.746 1.00 10.00 H new ATOM 0 HG2 LYS A 33 5.503 8.018 4.030 1.00 10.00 H new ATOM 0 HG3 LYS A 33 4.537 9.480 4.074 1.00 10.00 H new ATOM 0 HD2 LYS A 33 4.248 9.157 6.559 1.00 10.00 H new ATOM 0 HD3 LYS A 33 5.328 7.779 6.472 1.00 10.00 H new ATOM 0 HE2 LYS A 33 7.124 9.251 5.560 1.00 10.00 H new ATOM 0 HE3 LYS A 33 6.044 10.627 5.664 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 7.516 10.523 7.561 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 5.908 10.305 8.061 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 6.955 8.972 7.960 1.00 10.00 H new ATOM 275 N ILE A 34 3.963 7.769 0.953 1.00 10.00 N ATOM 276 CA ILE A 34 4.805 7.284 -0.126 1.00 10.00 C ATOM 277 C ILE A 34 5.622 8.440 -0.708 1.00 10.00 C ATOM 278 O ILE A 34 5.273 9.601 -0.511 1.00 10.00 O ATOM 279 CB ILE A 34 3.910 6.641 -1.221 1.00 10.00 C ATOM 280 CG1 ILE A 34 4.734 6.141 -2.405 1.00 10.00 C ATOM 281 CG2 ILE A 34 2.855 7.629 -1.691 1.00 10.00 C ATOM 282 CD1 ILE A 34 3.897 5.556 -3.523 1.00 10.00 C ATOM 0 H ILE A 34 3.567 8.695 0.790 1.00 10.00 H new ATOM 0 HA ILE A 34 5.497 6.533 0.254 1.00 10.00 H new ATOM 0 HB ILE A 34 3.416 5.778 -0.776 1.00 10.00 H new ATOM 0 HG12 ILE A 34 5.326 6.967 -2.800 1.00 10.00 H new ATOM 0 HG13 ILE A 34 5.436 5.385 -2.054 1.00 10.00 H new ATOM 0 HG21 ILE A 34 2.236 7.163 -2.458 1.00 10.00 H new ATOM 0 HG22 ILE A 34 2.229 7.921 -0.848 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.342 8.512 -2.105 1.00 10.00 H new ATOM 0 HD11 ILE A 34 4.550 5.222 -4.330 1.00 10.00 H new ATOM 0 HD12 ILE A 34 3.325 4.709 -3.144 1.00 10.00 H new ATOM 0 HD13 ILE A 34 3.213 6.316 -3.901 1.00 10.00 H new ATOM 294 N LYS A 35 6.721 8.139 -1.382 1.00 10.00 N ATOM 295 CA LYS A 35 7.540 9.180 -1.987 1.00 10.00 C ATOM 296 C LYS A 35 7.126 9.398 -3.442 1.00 10.00 C ATOM 297 O LYS A 35 6.354 8.622 -4.002 1.00 10.00 O ATOM 298 CB LYS A 35 9.028 8.832 -1.907 1.00 10.00 C ATOM 299 CG LYS A 35 9.615 8.980 -0.514 1.00 10.00 C ATOM 300 CD LYS A 35 11.130 9.109 -0.561 1.00 10.00 C ATOM 301 CE LYS A 35 11.725 9.298 0.826 1.00 10.00 C ATOM 302 NZ LYS A 35 12.300 8.039 1.363 1.00 10.00 N ATOM 0 H LYS A 35 7.066 7.189 -1.524 1.00 10.00 H new ATOM 0 HA LYS A 35 7.380 10.102 -1.429 1.00 10.00 H new ATOM 0 HB2 LYS A 35 9.171 7.806 -2.245 1.00 10.00 H new ATOM 0 HB3 LYS A 35 9.580 9.473 -2.594 1.00 10.00 H new ATOM 0 HG2 LYS A 35 9.188 9.858 -0.029 1.00 10.00 H new ATOM 0 HG3 LYS A 35 9.340 8.116 0.092 1.00 10.00 H new ATOM 0 HD2 LYS A 35 11.556 8.217 -1.021 1.00 10.00 H new ATOM 0 HD3 LYS A 35 11.403 9.955 -1.192 1.00 10.00 H new ATOM 0 HE2 LYS A 35 12.501 10.062 0.786 1.00 10.00 H new ATOM 0 HE3 LYS A 35 10.954 9.662 1.504 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 12.694 8.213 2.309 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 11.555 7.316 1.426 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 13.054 7.704 0.730 1.00 10.00 H new ATOM 316 N ARG A 36 7.658 10.447 -4.050 1.00 10.00 N ATOM 317 CA ARG A 36 7.333 10.783 -5.432 1.00 10.00 C ATOM 318 C ARG A 36 7.895 9.764 -6.425 1.00 10.00 C ATOM 319 O ARG A 36 7.287 9.504 -7.465 1.00 10.00 O ATOM 320 CB ARG A 36 7.876 12.173 -5.770 1.00 10.00 C ATOM 321 CG ARG A 36 7.203 13.303 -5.005 1.00 10.00 C ATOM 322 CD ARG A 36 6.065 13.921 -5.801 1.00 10.00 C ATOM 323 NE ARG A 36 6.536 14.544 -7.038 1.00 10.00 N ATOM 324 CZ ARG A 36 5.750 15.209 -7.888 1.00 10.00 C ATOM 325 NH1 ARG A 36 4.457 15.348 -7.631 1.00 10.00 N ATOM 326 NH2 ARG A 36 6.259 15.735 -8.996 1.00 10.00 N ATOM 0 H ARG A 36 8.320 11.084 -3.608 1.00 10.00 H new ATOM 0 HA ARG A 36 6.247 10.769 -5.521 1.00 10.00 H new ATOM 0 HB2 ARG A 36 8.946 12.194 -5.562 1.00 10.00 H new ATOM 0 HB3 ARG A 36 7.755 12.349 -6.839 1.00 10.00 H new ATOM 0 HG2 ARG A 36 6.820 12.924 -4.057 1.00 10.00 H new ATOM 0 HG3 ARG A 36 7.939 14.071 -4.767 1.00 10.00 H new ATOM 0 HD2 ARG A 36 5.330 13.152 -6.039 1.00 10.00 H new ATOM 0 HD3 ARG A 36 5.558 14.667 -5.189 1.00 10.00 H new ATOM 0 HE ARG A 36 7.527 14.465 -7.265 1.00 10.00 H new ATOM 0 HH11 ARG A 36 4.060 14.946 -6.782 1.00 10.00 H new ATOM 0 HH12 ARG A 36 3.859 15.857 -8.283 1.00 10.00 H new ATOM 0 HH21 ARG A 36 7.253 15.632 -9.200 1.00 10.00 H new ATOM 0 HH22 ARG A 36 5.656 16.242 -9.643 1.00 10.00 H new ATOM 340 N HIS A 37 9.046 9.185 -6.098 1.00 10.00 N ATOM 341 CA HIS A 37 9.695 8.218 -6.985 1.00 10.00 C ATOM 342 C HIS A 37 9.269 6.781 -6.688 1.00 10.00 C ATOM 343 O HIS A 37 9.619 5.859 -7.426 1.00 10.00 O ATOM 344 CB HIS A 37 11.224 8.343 -6.885 1.00 10.00 C ATOM 345 CG HIS A 37 11.800 7.964 -5.547 1.00 10.00 C ATOM 346 ND1 HIS A 37 12.054 6.651 -5.216 1.00 10.00 N ATOM 347 CD2 HIS A 37 12.170 8.758 -4.511 1.00 10.00 C ATOM 348 CE1 HIS A 37 12.567 6.676 -3.996 1.00 10.00 C ATOM 349 NE2 HIS A 37 12.657 7.928 -3.534 1.00 10.00 N ATOM 0 H HIS A 37 9.549 9.366 -5.229 1.00 10.00 H new ATOM 0 HA HIS A 37 9.375 8.451 -8.001 1.00 10.00 H new ATOM 0 HB2 HIS A 37 11.677 7.714 -7.652 1.00 10.00 H new ATOM 0 HB3 HIS A 37 11.506 9.372 -7.109 1.00 10.00 H new ATOM 0 HD2 HIS A 37 12.095 9.834 -4.465 1.00 10.00 H new ATOM 0 HE1 HIS A 37 12.873 5.799 -3.445 1.00 10.00 H new ATOM 0 HE2 HIS A 37 13.020 8.212 -2.624 1.00 10.00 H new ATOM 357 N THR A 38 8.511 6.593 -5.624 1.00 10.00 N ATOM 358 CA THR A 38 8.065 5.266 -5.230 1.00 10.00 C ATOM 359 C THR A 38 6.907 4.780 -6.106 1.00 10.00 C ATOM 360 O THR A 38 5.881 5.448 -6.211 1.00 10.00 O ATOM 361 CB THR A 38 7.634 5.271 -3.754 1.00 10.00 C ATOM 362 OG1 THR A 38 8.555 6.054 -2.985 1.00 10.00 O ATOM 363 CG2 THR A 38 7.582 3.863 -3.193 1.00 10.00 C ATOM 0 H THR A 38 8.189 7.344 -5.014 1.00 10.00 H new ATOM 0 HA THR A 38 8.902 4.580 -5.364 1.00 10.00 H new ATOM 0 HB THR A 38 6.635 5.704 -3.694 1.00 10.00 H new ATOM 0 HG1 THR A 38 8.481 5.810 -2.039 1.00 10.00 H new ATOM 0 HG21 THR A 38 7.274 3.899 -2.148 1.00 10.00 H new ATOM 0 HG22 THR A 38 6.865 3.271 -3.762 1.00 10.00 H new ATOM 0 HG23 THR A 38 8.569 3.406 -3.265 1.00 10.00 H new ATOM 371 N PRO A 39 7.069 3.617 -6.763 1.00 10.00 N ATOM 372 CA PRO A 39 6.029 3.043 -7.629 1.00 10.00 C ATOM 373 C PRO A 39 4.738 2.737 -6.875 1.00 10.00 C ATOM 374 O PRO A 39 4.764 2.334 -5.708 1.00 10.00 O ATOM 375 CB PRO A 39 6.659 1.741 -8.141 1.00 10.00 C ATOM 376 CG PRO A 39 8.125 1.919 -7.954 1.00 10.00 C ATOM 377 CD PRO A 39 8.282 2.782 -6.736 1.00 10.00 C ATOM 0 HA PRO A 39 5.742 3.737 -8.419 1.00 10.00 H new ATOM 0 HB2 PRO A 39 6.292 0.880 -7.583 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.413 1.570 -9.189 1.00 10.00 H new ATOM 0 HG2 PRO A 39 8.621 0.958 -7.818 1.00 10.00 H new ATOM 0 HG3 PRO A 39 8.576 2.390 -8.827 1.00 10.00 H new ATOM 0 HD2 PRO A 39 8.342 2.187 -5.825 1.00 10.00 H new ATOM 0 HD3 PRO A 39 9.189 3.385 -6.783 1.00 10.00 H new ATOM 385 N LEU A 40 3.609 2.904 -7.555 1.00 10.00 N ATOM 386 CA LEU A 40 2.306 2.651 -6.953 1.00 10.00 C ATOM 387 C LEU A 40 2.014 1.152 -6.896 1.00 10.00 C ATOM 388 O LEU A 40 1.004 0.729 -6.334 1.00 10.00 O ATOM 389 CB LEU A 40 1.205 3.375 -7.731 1.00 10.00 C ATOM 390 CG LEU A 40 1.343 4.896 -7.786 1.00 10.00 C ATOM 391 CD1 LEU A 40 0.399 5.480 -8.823 1.00 10.00 C ATOM 392 CD2 LEU A 40 1.077 5.509 -6.420 1.00 10.00 C ATOM 0 H LEU A 40 3.571 3.214 -8.526 1.00 10.00 H new ATOM 0 HA LEU A 40 2.325 3.036 -5.934 1.00 10.00 H new ATOM 0 HB2 LEU A 40 1.189 2.990 -8.751 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.243 3.129 -7.282 1.00 10.00 H new ATOM 0 HG LEU A 40 2.366 5.136 -8.076 1.00 10.00 H new ATOM 0 HD11 LEU A 40 0.511 6.564 -8.848 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.636 5.068 -9.804 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.629 5.228 -8.562 1.00 10.00 H new ATOM 0 HD21 LEU A 40 1.180 6.592 -6.481 1.00 10.00 H new ATOM 0 HD22 LEU A 40 0.066 5.258 -6.099 1.00 10.00 H new ATOM 0 HD23 LEU A 40 1.794 5.116 -5.699 1.00 10.00 H new ATOM 404 N SER A 41 2.905 0.358 -7.477 1.00 10.00 N ATOM 405 CA SER A 41 2.762 -1.089 -7.488 1.00 10.00 C ATOM 406 C SER A 41 2.712 -1.632 -6.061 1.00 10.00 C ATOM 407 O SER A 41 1.832 -2.423 -5.714 1.00 10.00 O ATOM 408 CB SER A 41 3.934 -1.703 -8.252 1.00 10.00 C ATOM 409 OG SER A 41 4.553 -0.731 -9.082 1.00 10.00 O ATOM 0 H SER A 41 3.742 0.698 -7.951 1.00 10.00 H new ATOM 0 HA SER A 41 1.828 -1.356 -7.983 1.00 10.00 H new ATOM 0 HB2 SER A 41 4.663 -2.106 -7.549 1.00 10.00 H new ATOM 0 HB3 SER A 41 3.582 -2.537 -8.859 1.00 10.00 H new ATOM 0 HG SER A 41 4.237 -0.839 -10.003 1.00 10.00 H new ATOM 415 N LYS A 42 3.646 -1.179 -5.231 1.00 10.00 N ATOM 416 CA LYS A 42 3.703 -1.609 -3.839 1.00 10.00 C ATOM 417 C LYS A 42 2.536 -1.020 -3.057 1.00 10.00 C ATOM 418 O LYS A 42 2.068 -1.608 -2.090 1.00 10.00 O ATOM 419 CB LYS A 42 5.031 -1.204 -3.183 1.00 10.00 C ATOM 420 CG LYS A 42 5.832 -0.177 -3.967 1.00 10.00 C ATOM 421 CD LYS A 42 6.902 0.485 -3.107 1.00 10.00 C ATOM 422 CE LYS A 42 7.864 -0.533 -2.512 1.00 10.00 C ATOM 423 NZ LYS A 42 8.691 -1.197 -3.553 1.00 10.00 N ATOM 0 H LYS A 42 4.373 -0.515 -5.498 1.00 10.00 H new ATOM 0 HA LYS A 42 3.634 -2.697 -3.823 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.825 -0.805 -2.190 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.642 -2.096 -3.047 1.00 10.00 H new ATOM 0 HG2 LYS A 42 6.302 -0.660 -4.824 1.00 10.00 H new ATOM 0 HG3 LYS A 42 5.159 0.585 -4.360 1.00 10.00 H new ATOM 0 HD2 LYS A 42 7.460 1.202 -3.710 1.00 10.00 H new ATOM 0 HD3 LYS A 42 6.425 1.047 -2.303 1.00 10.00 H new ATOM 0 HE2 LYS A 42 8.516 -0.037 -1.793 1.00 10.00 H new ATOM 0 HE3 LYS A 42 7.299 -1.287 -1.963 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 9.378 -1.832 -3.098 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 8.076 -1.748 -4.186 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 9.199 -0.476 -4.105 1.00 10.00 H new ATOM 437 N LEU A 43 2.067 0.139 -3.498 1.00 10.00 N ATOM 438 CA LEU A 43 0.949 0.824 -2.856 1.00 10.00 C ATOM 439 C LEU A 43 -0.321 -0.016 -2.951 1.00 10.00 C ATOM 440 O LEU A 43 -1.044 -0.181 -1.965 1.00 10.00 O ATOM 441 CB LEU A 43 0.745 2.200 -3.507 1.00 10.00 C ATOM 442 CG LEU A 43 -0.477 2.993 -3.037 1.00 10.00 C ATOM 443 CD1 LEU A 43 -0.091 4.439 -2.766 1.00 10.00 C ATOM 444 CD2 LEU A 43 -1.586 2.933 -4.078 1.00 10.00 C ATOM 0 H LEU A 43 2.447 0.631 -4.307 1.00 10.00 H new ATOM 0 HA LEU A 43 1.177 0.965 -1.799 1.00 10.00 H new ATOM 0 HB2 LEU A 43 1.635 2.801 -3.324 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.670 2.062 -4.586 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.845 2.546 -2.113 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -0.968 4.993 -2.432 1.00 10.00 H new ATOM 0 HD12 LEU A 43 0.675 4.472 -1.992 1.00 10.00 H new ATOM 0 HD13 LEU A 43 0.297 4.889 -3.680 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -2.446 3.502 -3.726 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -1.228 3.358 -5.016 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -1.879 1.895 -4.238 1.00 10.00 H new ATOM 456 N MET A 44 -0.581 -0.550 -4.131 1.00 10.00 N ATOM 457 CA MET A 44 -1.761 -1.375 -4.348 1.00 10.00 C ATOM 458 C MET A 44 -1.638 -2.696 -3.596 1.00 10.00 C ATOM 459 O MET A 44 -2.592 -3.162 -2.970 1.00 10.00 O ATOM 460 CB MET A 44 -1.958 -1.644 -5.841 1.00 10.00 C ATOM 461 CG MET A 44 -2.245 -0.393 -6.656 1.00 10.00 C ATOM 462 SD MET A 44 -2.572 -0.751 -8.395 1.00 10.00 S ATOM 463 CE MET A 44 -1.009 -1.469 -8.895 1.00 10.00 C ATOM 0 H MET A 44 0.008 -0.428 -4.955 1.00 10.00 H new ATOM 0 HA MET A 44 -2.628 -0.834 -3.968 1.00 10.00 H new ATOM 0 HB2 MET A 44 -1.063 -2.126 -6.235 1.00 10.00 H new ATOM 0 HB3 MET A 44 -2.781 -2.347 -5.969 1.00 10.00 H new ATOM 0 HG2 MET A 44 -3.104 0.125 -6.229 1.00 10.00 H new ATOM 0 HG3 MET A 44 -1.395 0.286 -6.583 1.00 10.00 H new ATOM 0 HE1 MET A 44 -1.010 -1.628 -9.973 1.00 10.00 H new ATOM 0 HE2 MET A 44 -0.196 -0.793 -8.628 1.00 10.00 H new ATOM 0 HE3 MET A 44 -0.868 -2.423 -8.388 1.00 10.00 H new ATOM 473 N LYS A 45 -0.446 -3.275 -3.639 1.00 10.00 N ATOM 474 CA LYS A 45 -0.180 -4.554 -2.989 1.00 10.00 C ATOM 475 C LYS A 45 -0.223 -4.454 -1.465 1.00 10.00 C ATOM 476 O LYS A 45 -0.844 -5.288 -0.810 1.00 10.00 O ATOM 477 CB LYS A 45 1.176 -5.101 -3.438 1.00 10.00 C ATOM 478 CG LYS A 45 1.164 -5.641 -4.857 1.00 10.00 C ATOM 479 CD LYS A 45 2.538 -6.110 -5.295 1.00 10.00 C ATOM 480 CE LYS A 45 2.465 -6.865 -6.612 1.00 10.00 C ATOM 481 NZ LYS A 45 3.803 -7.313 -7.071 1.00 10.00 N ATOM 0 H LYS A 45 0.359 -2.876 -4.121 1.00 10.00 H new ATOM 0 HA LYS A 45 -0.972 -5.239 -3.292 1.00 10.00 H new ATOM 0 HB2 LYS A 45 1.922 -4.310 -3.364 1.00 10.00 H new ATOM 0 HB3 LYS A 45 1.484 -5.894 -2.757 1.00 10.00 H new ATOM 0 HG2 LYS A 45 0.459 -6.470 -4.924 1.00 10.00 H new ATOM 0 HG3 LYS A 45 0.811 -4.866 -5.537 1.00 10.00 H new ATOM 0 HD2 LYS A 45 3.202 -5.252 -5.401 1.00 10.00 H new ATOM 0 HD3 LYS A 45 2.968 -6.753 -4.527 1.00 10.00 H new ATOM 0 HE2 LYS A 45 1.812 -7.731 -6.498 1.00 10.00 H new ATOM 0 HE3 LYS A 45 2.016 -6.225 -7.372 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 3.708 -7.823 -7.972 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 4.419 -6.486 -7.205 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 4.221 -7.944 -6.358 1.00 10.00 H new ATOM 495 N ALA A 46 0.435 -3.440 -0.910 1.00 10.00 N ATOM 496 CA ALA A 46 0.478 -3.244 0.540 1.00 10.00 C ATOM 497 C ALA A 46 -0.922 -3.197 1.142 1.00 10.00 C ATOM 498 O ALA A 46 -1.211 -3.886 2.120 1.00 10.00 O ATOM 499 CB ALA A 46 1.241 -1.974 0.889 1.00 10.00 C ATOM 0 H ALA A 46 0.948 -2.738 -1.443 1.00 10.00 H new ATOM 0 HA ALA A 46 1.000 -4.099 0.969 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.261 -1.847 1.971 1.00 10.00 H new ATOM 0 HB2 ALA A 46 2.262 -2.048 0.513 1.00 10.00 H new ATOM 0 HB3 ALA A 46 0.748 -1.116 0.432 1.00 10.00 H new ATOM 505 N TYR A 47 -1.794 -2.394 0.546 1.00 10.00 N ATOM 506 CA TYR A 47 -3.161 -2.261 1.034 1.00 10.00 C ATOM 507 C TYR A 47 -3.935 -3.558 0.821 1.00 10.00 C ATOM 508 O TYR A 47 -4.691 -3.992 1.689 1.00 10.00 O ATOM 509 CB TYR A 47 -3.862 -1.103 0.319 1.00 10.00 C ATOM 510 CG TYR A 47 -5.285 -0.851 0.777 1.00 10.00 C ATOM 511 CD1 TYR A 47 -6.367 -1.334 0.050 1.00 10.00 C ATOM 512 CD2 TYR A 47 -5.543 -0.124 1.932 1.00 10.00 C ATOM 513 CE1 TYR A 47 -7.667 -1.100 0.464 1.00 10.00 C ATOM 514 CE2 TYR A 47 -6.838 0.111 2.353 1.00 10.00 C ATOM 515 CZ TYR A 47 -7.895 -0.376 1.617 1.00 10.00 C ATOM 516 OH TYR A 47 -9.186 -0.139 2.036 1.00 10.00 O ATOM 0 H TYR A 47 -1.580 -1.826 -0.274 1.00 10.00 H new ATOM 0 HA TYR A 47 -3.130 -2.051 2.103 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -3.279 -0.194 0.469 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -3.869 -1.305 -0.752 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -6.191 -1.901 -0.852 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -4.718 0.264 2.511 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -8.498 -1.481 -0.111 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -7.020 0.675 3.256 1.00 10.00 H new ATOM 0 HH TYR A 47 -9.170 0.384 2.865 1.00 10.00 H new ATOM 526 N CYS A 48 -3.721 -4.180 -0.330 1.00 10.00 N ATOM 527 CA CYS A 48 -4.403 -5.422 -0.676 1.00 10.00 C ATOM 528 C CYS A 48 -4.031 -6.554 0.279 1.00 10.00 C ATOM 529 O CYS A 48 -4.898 -7.312 0.723 1.00 10.00 O ATOM 530 CB CYS A 48 -4.077 -5.825 -2.114 1.00 10.00 C ATOM 531 SG CYS A 48 -5.088 -7.185 -2.739 1.00 10.00 S ATOM 0 H CYS A 48 -3.076 -3.843 -1.045 1.00 10.00 H new ATOM 0 HA CYS A 48 -5.475 -5.244 -0.585 1.00 10.00 H new ATOM 0 HB2 CYS A 48 -4.209 -4.959 -2.763 1.00 10.00 H new ATOM 0 HB3 CYS A 48 -3.026 -6.110 -2.172 1.00 10.00 H new ATOM 0 HG CYS A 48 -4.803 -8.273 -2.087 1.00 10.00 H new ATOM 537 N GLU A 49 -2.746 -6.661 0.598 1.00 10.00 N ATOM 538 CA GLU A 49 -2.260 -7.703 1.498 1.00 10.00 C ATOM 539 C GLU A 49 -2.870 -7.559 2.884 1.00 10.00 C ATOM 540 O GLU A 49 -3.190 -8.552 3.537 1.00 10.00 O ATOM 541 CB GLU A 49 -0.735 -7.664 1.604 1.00 10.00 C ATOM 542 CG GLU A 49 -0.022 -8.225 0.385 1.00 10.00 C ATOM 543 CD GLU A 49 -0.486 -9.621 0.020 1.00 10.00 C ATOM 544 OE1 GLU A 49 -0.872 -10.390 0.929 1.00 10.00 O ATOM 545 OE2 GLU A 49 -0.463 -9.959 -1.181 1.00 10.00 O ATOM 0 H GLU A 49 -2.019 -6.038 0.246 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.563 -8.663 1.079 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -0.417 -6.633 1.757 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -0.427 -8.227 2.485 1.00 10.00 H new ATOM 0 HG2 GLU A 49 -0.185 -7.560 -0.463 1.00 10.00 H new ATOM 0 HG3 GLU A 49 1.051 -8.242 0.574 1.00 10.00 H new ATOM 552 N ARG A 50 -3.042 -6.318 3.323 1.00 10.00 N ATOM 553 CA ARG A 50 -3.611 -6.043 4.636 1.00 10.00 C ATOM 554 C ARG A 50 -5.089 -6.417 4.685 1.00 10.00 C ATOM 555 O ARG A 50 -5.641 -6.674 5.756 1.00 10.00 O ATOM 556 CB ARG A 50 -3.414 -4.572 5.004 1.00 10.00 C ATOM 557 CG ARG A 50 -1.951 -4.193 5.167 1.00 10.00 C ATOM 558 CD ARG A 50 -1.784 -2.866 5.885 1.00 10.00 C ATOM 559 NE ARG A 50 -0.377 -2.484 5.996 1.00 10.00 N ATOM 560 CZ ARG A 50 0.083 -1.564 6.842 1.00 10.00 C ATOM 561 NH1 ARG A 50 -0.750 -0.921 7.653 1.00 10.00 N ATOM 562 NH2 ARG A 50 1.380 -1.287 6.869 1.00 10.00 N ATOM 0 H ARG A 50 -2.795 -5.485 2.788 1.00 10.00 H new ATOM 0 HA ARG A 50 -3.087 -6.658 5.368 1.00 10.00 H new ATOM 0 HB2 ARG A 50 -3.862 -3.947 4.232 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -3.944 -4.361 5.933 1.00 10.00 H new ATOM 0 HG2 ARG A 50 -1.434 -4.974 5.724 1.00 10.00 H new ATOM 0 HG3 ARG A 50 -1.480 -4.136 4.186 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -2.330 -2.091 5.348 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -2.222 -2.933 6.881 1.00 10.00 H new ATOM 0 HE ARG A 50 0.295 -2.952 5.387 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -1.748 -1.131 7.630 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -0.392 -0.217 8.299 1.00 10.00 H new ATOM 0 HH21 ARG A 50 2.019 -1.778 6.244 1.00 10.00 H new ATOM 0 HH22 ARG A 50 1.738 -0.583 7.515 1.00 10.00 H new ATOM 576 N GLN A 51 -5.728 -6.455 3.522 1.00 10.00 N ATOM 577 CA GLN A 51 -7.133 -6.821 3.442 1.00 10.00 C ATOM 578 C GLN A 51 -7.267 -8.339 3.369 1.00 10.00 C ATOM 579 O GLN A 51 -8.345 -8.894 3.577 1.00 10.00 O ATOM 580 CB GLN A 51 -7.798 -6.167 2.224 1.00 10.00 C ATOM 581 CG GLN A 51 -7.740 -4.644 2.223 1.00 10.00 C ATOM 582 CD GLN A 51 -7.959 -4.035 3.595 1.00 10.00 C ATOM 583 OE1 GLN A 51 -7.006 -3.709 4.305 1.00 10.00 O ATOM 584 NE2 GLN A 51 -9.213 -3.895 3.985 1.00 10.00 N ATOM 0 H GLN A 51 -5.295 -6.237 2.624 1.00 10.00 H new ATOM 0 HA GLN A 51 -7.639 -6.460 4.337 1.00 10.00 H new ATOM 0 HB2 GLN A 51 -7.317 -6.538 1.319 1.00 10.00 H new ATOM 0 HB3 GLN A 51 -8.841 -6.480 2.182 1.00 10.00 H new ATOM 0 HG2 GLN A 51 -6.770 -4.324 1.842 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -8.495 -4.259 1.537 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -9.974 -4.177 3.367 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -9.421 -3.505 4.904 1.00 10.00 H new ATOM 593 N GLY A 52 -6.153 -9.000 3.072 1.00 10.00 N ATOM 594 CA GLY A 52 -6.138 -10.444 2.983 1.00 10.00 C ATOM 595 C GLY A 52 -6.742 -10.955 1.690 1.00 10.00 C ATOM 596 O GLY A 52 -7.374 -12.013 1.668 1.00 10.00 O ATOM 0 H GLY A 52 -5.254 -8.554 2.890 1.00 10.00 H new ATOM 0 HA2 GLY A 52 -5.111 -10.799 3.065 1.00 10.00 H new ATOM 0 HA3 GLY A 52 -6.688 -10.862 3.826 1.00 10.00 H new ATOM 600 N LEU A 53 -6.541 -10.208 0.609 1.00 10.00 N ATOM 601 CA LEU A 53 -7.079 -10.584 -0.693 1.00 10.00 C ATOM 602 C LEU A 53 -6.002 -10.514 -1.768 1.00 10.00 C ATOM 603 O LEU A 53 -4.881 -10.061 -1.515 1.00 10.00 O ATOM 604 CB LEU A 53 -8.244 -9.663 -1.076 1.00 10.00 C ATOM 605 CG LEU A 53 -9.390 -9.603 -0.062 1.00 10.00 C ATOM 606 CD1 LEU A 53 -10.322 -8.448 -0.382 1.00 10.00 C ATOM 607 CD2 LEU A 53 -10.158 -10.916 -0.043 1.00 10.00 C ATOM 0 H LEU A 53 -6.009 -9.338 0.609 1.00 10.00 H new ATOM 0 HA LEU A 53 -7.438 -11.611 -0.622 1.00 10.00 H new ATOM 0 HB2 LEU A 53 -7.856 -8.655 -1.221 1.00 10.00 H new ATOM 0 HB3 LEU A 53 -8.646 -9.991 -2.035 1.00 10.00 H new ATOM 0 HG LEU A 53 -8.964 -9.440 0.928 1.00 10.00 H new ATOM 0 HD11 LEU A 53 -11.131 -8.420 0.348 1.00 10.00 H new ATOM 0 HD12 LEU A 53 -9.766 -7.511 -0.344 1.00 10.00 H new ATOM 0 HD13 LEU A 53 -10.739 -8.583 -1.380 1.00 10.00 H new ATOM 0 HD21 LEU A 53 -10.968 -10.853 0.684 1.00 10.00 H new ATOM 0 HD22 LEU A 53 -10.572 -11.110 -1.032 1.00 10.00 H new ATOM 0 HD23 LEU A 53 -9.485 -11.727 0.233 1.00 10.00 H new ATOM 619 N SER A 54 -6.350 -10.977 -2.959 1.00 10.00 N ATOM 620 CA SER A 54 -5.441 -10.956 -4.092 1.00 10.00 C ATOM 621 C SER A 54 -5.611 -9.648 -4.852 1.00 10.00 C ATOM 622 O SER A 54 -6.728 -9.136 -4.971 1.00 10.00 O ATOM 623 CB SER A 54 -5.716 -12.147 -5.018 1.00 10.00 C ATOM 624 OG SER A 54 -4.989 -12.039 -6.229 1.00 10.00 O ATOM 0 H SER A 54 -7.266 -11.376 -3.166 1.00 10.00 H new ATOM 0 HA SER A 54 -4.416 -11.032 -3.730 1.00 10.00 H new ATOM 0 HB2 SER A 54 -5.446 -13.074 -4.511 1.00 10.00 H new ATOM 0 HB3 SER A 54 -6.783 -12.202 -5.236 1.00 10.00 H new ATOM 0 HG SER A 54 -5.184 -12.813 -6.798 1.00 10.00 H new ATOM 630 N MET A 55 -4.512 -9.117 -5.380 1.00 10.00 N ATOM 631 CA MET A 55 -4.545 -7.858 -6.124 1.00 10.00 C ATOM 632 C MET A 55 -5.382 -7.991 -7.397 1.00 10.00 C ATOM 633 O MET A 55 -5.776 -6.995 -8.000 1.00 10.00 O ATOM 634 CB MET A 55 -3.122 -7.400 -6.475 1.00 10.00 C ATOM 635 CG MET A 55 -3.031 -5.924 -6.833 1.00 10.00 C ATOM 636 SD MET A 55 -1.368 -5.411 -7.310 1.00 10.00 S ATOM 637 CE MET A 55 -1.158 -6.317 -8.841 1.00 10.00 C ATOM 0 H MET A 55 -3.586 -9.538 -5.307 1.00 10.00 H new ATOM 0 HA MET A 55 -5.010 -7.107 -5.485 1.00 10.00 H new ATOM 0 HB2 MET A 55 -2.465 -7.602 -5.629 1.00 10.00 H new ATOM 0 HB3 MET A 55 -2.754 -7.992 -7.313 1.00 10.00 H new ATOM 0 HG2 MET A 55 -3.719 -5.712 -7.652 1.00 10.00 H new ATOM 0 HG3 MET A 55 -3.358 -5.329 -5.980 1.00 10.00 H new ATOM 0 HE1 MET A 55 -0.342 -5.878 -9.415 1.00 10.00 H new ATOM 0 HE2 MET A 55 -0.926 -7.358 -8.619 1.00 10.00 H new ATOM 0 HE3 MET A 55 -2.079 -6.267 -9.423 1.00 10.00 H new ATOM 647 N ARG A 56 -5.660 -9.227 -7.791 1.00 10.00 N ATOM 648 CA ARG A 56 -6.456 -9.494 -8.980 1.00 10.00 C ATOM 649 C ARG A 56 -7.950 -9.401 -8.662 1.00 10.00 C ATOM 650 O ARG A 56 -8.780 -9.275 -9.562 1.00 10.00 O ATOM 651 CB ARG A 56 -6.113 -10.883 -9.528 1.00 10.00 C ATOM 652 CG ARG A 56 -6.893 -11.269 -10.773 1.00 10.00 C ATOM 653 CD ARG A 56 -6.522 -12.663 -11.247 1.00 10.00 C ATOM 654 NE ARG A 56 -7.455 -13.166 -12.256 1.00 10.00 N ATOM 655 CZ ARG A 56 -7.137 -13.397 -13.527 1.00 10.00 C ATOM 656 NH1 ARG A 56 -5.903 -13.165 -13.959 1.00 10.00 N ATOM 657 NH2 ARG A 56 -8.057 -13.874 -14.361 1.00 10.00 N ATOM 0 H ARG A 56 -5.344 -10.064 -7.301 1.00 10.00 H new ATOM 0 HA ARG A 56 -6.223 -8.744 -9.736 1.00 10.00 H new ATOM 0 HB2 ARG A 56 -5.047 -10.919 -9.754 1.00 10.00 H new ATOM 0 HB3 ARG A 56 -6.300 -11.624 -8.751 1.00 10.00 H new ATOM 0 HG2 ARG A 56 -7.962 -11.227 -10.563 1.00 10.00 H new ATOM 0 HG3 ARG A 56 -6.695 -10.548 -11.566 1.00 10.00 H new ATOM 0 HD2 ARG A 56 -5.514 -12.649 -11.661 1.00 10.00 H new ATOM 0 HD3 ARG A 56 -6.507 -13.343 -10.396 1.00 10.00 H new ATOM 0 HE ARG A 56 -8.415 -13.352 -11.965 1.00 10.00 H new ATOM 0 HH11 ARG A 56 -5.196 -12.809 -13.316 1.00 10.00 H new ATOM 0 HH12 ARG A 56 -5.662 -13.343 -14.934 1.00 10.00 H new ATOM 0 HH21 ARG A 56 -9.002 -14.061 -14.025 1.00 10.00 H new ATOM 0 HH22 ARG A 56 -7.818 -14.053 -15.336 1.00 10.00 H new ATOM 671 N GLN A 57 -8.286 -9.427 -7.379 1.00 10.00 N ATOM 672 CA GLN A 57 -9.681 -9.366 -6.955 1.00 10.00 C ATOM 673 C GLN A 57 -10.189 -7.927 -6.895 1.00 10.00 C ATOM 674 O GLN A 57 -11.355 -7.661 -7.185 1.00 10.00 O ATOM 675 CB GLN A 57 -9.851 -10.029 -5.589 1.00 10.00 C ATOM 676 CG GLN A 57 -11.297 -10.090 -5.122 1.00 10.00 C ATOM 677 CD GLN A 57 -11.446 -10.692 -3.740 1.00 10.00 C ATOM 678 OE1 GLN A 57 -10.656 -11.546 -3.333 1.00 10.00 O ATOM 679 NE2 GLN A 57 -12.459 -10.254 -3.008 1.00 10.00 N ATOM 0 H GLN A 57 -7.614 -9.490 -6.614 1.00 10.00 H new ATOM 0 HA GLN A 57 -10.272 -9.904 -7.696 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -9.448 -11.041 -5.632 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -9.262 -9.482 -4.852 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -11.716 -9.084 -5.121 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -11.879 -10.677 -5.833 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -13.090 -9.546 -3.383 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -12.608 -10.625 -2.070 1.00 10.00 H new ATOM 688 N ILE A 58 -9.324 -6.997 -6.529 1.00 10.00 N ATOM 689 CA ILE A 58 -9.729 -5.603 -6.428 1.00 10.00 C ATOM 690 C ILE A 58 -9.150 -4.767 -7.565 1.00 10.00 C ATOM 691 O ILE A 58 -8.287 -5.224 -8.313 1.00 10.00 O ATOM 692 CB ILE A 58 -9.323 -4.985 -5.075 1.00 10.00 C ATOM 693 CG1 ILE A 58 -7.858 -5.291 -4.755 1.00 10.00 C ATOM 694 CG2 ILE A 58 -10.233 -5.493 -3.966 1.00 10.00 C ATOM 695 CD1 ILE A 58 -7.385 -4.670 -3.458 1.00 10.00 C ATOM 0 H ILE A 58 -8.347 -7.177 -6.299 1.00 10.00 H new ATOM 0 HA ILE A 58 -10.816 -5.592 -6.502 1.00 10.00 H new ATOM 0 HB ILE A 58 -9.434 -3.903 -5.145 1.00 10.00 H new ATOM 0 HG12 ILE A 58 -7.723 -6.371 -4.703 1.00 10.00 H new ATOM 0 HG13 ILE A 58 -7.232 -4.931 -5.572 1.00 10.00 H new ATOM 0 HG21 ILE A 58 -9.934 -5.048 -3.017 1.00 10.00 H new ATOM 0 HG22 ILE A 58 -11.264 -5.218 -4.187 1.00 10.00 H new ATOM 0 HG23 ILE A 58 -10.154 -6.578 -3.899 1.00 10.00 H new ATOM 0 HD11 ILE A 58 -6.339 -4.926 -3.292 1.00 10.00 H new ATOM 0 HD12 ILE A 58 -7.489 -3.586 -3.514 1.00 10.00 H new ATOM 0 HD13 ILE A 58 -7.987 -5.049 -2.632 1.00 10.00 H new ATOM 707 N ARG A 59 -9.650 -3.547 -7.695 1.00 10.00 N ATOM 708 CA ARG A 59 -9.200 -2.624 -8.730 1.00 10.00 C ATOM 709 C ARG A 59 -8.904 -1.263 -8.114 1.00 10.00 C ATOM 710 O ARG A 59 -9.517 -0.882 -7.118 1.00 10.00 O ATOM 711 CB ARG A 59 -10.260 -2.481 -9.827 1.00 10.00 C ATOM 712 CG ARG A 59 -10.479 -3.746 -10.644 1.00 10.00 C ATOM 713 CD ARG A 59 -9.236 -4.120 -11.443 1.00 10.00 C ATOM 714 NE ARG A 59 -9.447 -5.308 -12.271 1.00 10.00 N ATOM 715 CZ ARG A 59 -9.353 -6.563 -11.822 1.00 10.00 C ATOM 716 NH1 ARG A 59 -9.052 -6.798 -10.552 1.00 10.00 N ATOM 717 NH2 ARG A 59 -9.559 -7.584 -12.648 1.00 10.00 N ATOM 0 H ARG A 59 -10.377 -3.168 -7.088 1.00 10.00 H new ATOM 0 HA ARG A 59 -8.291 -3.023 -9.179 1.00 10.00 H new ATOM 0 HB2 ARG A 59 -11.205 -2.188 -9.369 1.00 10.00 H new ATOM 0 HB3 ARG A 59 -9.967 -1.673 -10.498 1.00 10.00 H new ATOM 0 HG2 ARG A 59 -10.746 -4.568 -9.979 1.00 10.00 H new ATOM 0 HG3 ARG A 59 -11.319 -3.600 -11.323 1.00 10.00 H new ATOM 0 HD2 ARG A 59 -8.949 -3.282 -12.079 1.00 10.00 H new ATOM 0 HD3 ARG A 59 -8.407 -4.299 -10.759 1.00 10.00 H new ATOM 0 HE ARG A 59 -9.681 -5.169 -13.254 1.00 10.00 H new ATOM 0 HH11 ARG A 59 -8.891 -6.019 -9.913 1.00 10.00 H new ATOM 0 HH12 ARG A 59 -8.981 -7.758 -10.214 1.00 10.00 H new ATOM 0 HH21 ARG A 59 -9.789 -7.410 -13.626 1.00 10.00 H new ATOM 0 HH22 ARG A 59 -9.487 -8.541 -12.303 1.00 10.00 H new ATOM 731 N PHE A 60 -7.970 -0.536 -8.707 1.00 10.00 N ATOM 732 CA PHE A 60 -7.586 0.778 -8.210 1.00 10.00 C ATOM 733 C PHE A 60 -7.693 1.815 -9.317 1.00 10.00 C ATOM 734 O PHE A 60 -7.125 1.642 -10.397 1.00 10.00 O ATOM 735 CB PHE A 60 -6.153 0.753 -7.668 1.00 10.00 C ATOM 736 CG PHE A 60 -5.989 -0.068 -6.420 1.00 10.00 C ATOM 737 CD1 PHE A 60 -5.766 -1.434 -6.496 1.00 10.00 C ATOM 738 CD2 PHE A 60 -6.052 0.529 -5.171 1.00 10.00 C ATOM 739 CE1 PHE A 60 -5.613 -2.188 -5.349 1.00 10.00 C ATOM 740 CE2 PHE A 60 -5.899 -0.223 -4.023 1.00 10.00 C ATOM 741 CZ PHE A 60 -5.677 -1.582 -4.113 1.00 10.00 C ATOM 0 H PHE A 60 -7.460 -0.835 -9.538 1.00 10.00 H new ATOM 0 HA PHE A 60 -8.266 1.046 -7.401 1.00 10.00 H new ATOM 0 HB2 PHE A 60 -5.490 0.361 -8.439 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -5.834 1.775 -7.463 1.00 10.00 H new ATOM 0 HD1 PHE A 60 -5.711 -1.914 -7.462 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -6.222 1.593 -5.095 1.00 10.00 H new ATOM 0 HE1 PHE A 60 -5.443 -3.252 -5.421 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -5.953 0.252 -3.055 1.00 10.00 H new ATOM 0 HZ PHE A 60 -5.554 -2.170 -3.216 1.00 10.00 H new ATOM 751 N ARG A 61 -8.414 2.893 -9.048 1.00 10.00 N ATOM 752 CA ARG A 61 -8.591 3.945 -10.036 1.00 10.00 C ATOM 753 C ARG A 61 -8.184 5.307 -9.485 1.00 10.00 C ATOM 754 O ARG A 61 -8.373 5.602 -8.304 1.00 10.00 O ATOM 755 CB ARG A 61 -10.043 4.000 -10.524 1.00 10.00 C ATOM 756 CG ARG A 61 -10.416 2.866 -11.467 1.00 10.00 C ATOM 757 CD ARG A 61 -11.678 3.180 -12.261 1.00 10.00 C ATOM 758 NE ARG A 61 -11.971 2.143 -13.253 1.00 10.00 N ATOM 759 CZ ARG A 61 -12.689 2.342 -14.359 1.00 10.00 C ATOM 760 NH1 ARG A 61 -13.183 3.542 -14.633 1.00 10.00 N ATOM 761 NH2 ARG A 61 -12.894 1.342 -15.204 1.00 10.00 N ATOM 0 H ARG A 61 -8.884 3.061 -8.158 1.00 10.00 H new ATOM 0 HA ARG A 61 -7.941 3.705 -10.877 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -10.708 3.976 -9.661 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -10.211 4.951 -11.030 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -9.591 2.679 -12.155 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -10.566 1.951 -10.894 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -12.522 3.278 -11.578 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -11.561 4.140 -12.763 1.00 10.00 H new ATOM 0 HE ARG A 61 -11.601 1.207 -13.087 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -13.015 4.320 -13.996 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -13.731 3.686 -15.481 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -12.503 0.421 -15.008 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -13.443 1.494 -16.050 1.00 10.00 H new ATOM 775 N PHE A 62 -7.618 6.120 -10.361 1.00 10.00 N ATOM 776 CA PHE A 62 -7.189 7.467 -10.027 1.00 10.00 C ATOM 777 C PHE A 62 -7.705 8.417 -11.099 1.00 10.00 C ATOM 778 O PHE A 62 -7.458 8.205 -12.288 1.00 10.00 O ATOM 779 CB PHE A 62 -5.661 7.548 -9.933 1.00 10.00 C ATOM 780 CG PHE A 62 -5.131 8.956 -9.848 1.00 10.00 C ATOM 781 CD1 PHE A 62 -5.338 9.724 -8.713 1.00 10.00 C ATOM 782 CD2 PHE A 62 -4.427 9.509 -10.908 1.00 10.00 C ATOM 783 CE1 PHE A 62 -4.856 11.017 -8.638 1.00 10.00 C ATOM 784 CE2 PHE A 62 -3.944 10.802 -10.837 1.00 10.00 C ATOM 785 CZ PHE A 62 -4.158 11.556 -9.701 1.00 10.00 C ATOM 0 H PHE A 62 -7.442 5.861 -11.332 1.00 10.00 H new ATOM 0 HA PHE A 62 -7.593 7.746 -9.054 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -5.330 6.992 -9.056 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -5.226 7.058 -10.804 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -5.882 9.307 -7.878 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.255 8.923 -11.798 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -5.025 11.606 -7.749 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -3.400 11.222 -11.670 1.00 10.00 H new ATOM 0 HZ PHE A 62 -3.780 12.566 -9.643 1.00 10.00 H new ATOM 795 N ASP A 63 -8.452 9.433 -10.676 1.00 10.00 N ATOM 796 CA ASP A 63 -9.030 10.419 -11.594 1.00 10.00 C ATOM 797 C ASP A 63 -10.047 9.751 -12.521 1.00 10.00 C ATOM 798 O ASP A 63 -10.399 10.276 -13.579 1.00 10.00 O ATOM 799 CB ASP A 63 -7.935 11.127 -12.408 1.00 10.00 C ATOM 800 CG ASP A 63 -8.423 12.416 -13.040 1.00 10.00 C ATOM 801 OD1 ASP A 63 -8.911 13.295 -12.299 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.334 12.555 -14.277 1.00 10.00 O ATOM 0 H ASP A 63 -8.675 9.599 -9.694 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.545 11.175 -11.001 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -7.087 11.343 -11.759 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.576 10.456 -13.189 1.00 10.00 H new ATOM 807 N GLY A 64 -10.523 8.583 -12.106 1.00 10.00 N ATOM 808 CA GLY A 64 -11.494 7.850 -12.892 1.00 10.00 C ATOM 809 C GLY A 64 -10.861 6.807 -13.796 1.00 10.00 C ATOM 810 O GLY A 64 -11.562 5.971 -14.366 1.00 10.00 O ATOM 0 H GLY A 64 -10.251 8.129 -11.234 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -12.201 7.361 -12.222 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -12.065 8.552 -13.500 1.00 10.00 H new ATOM 814 N GLN A 65 -9.536 6.837 -13.913 1.00 10.00 N ATOM 815 CA GLN A 65 -8.822 5.892 -14.770 1.00 10.00 C ATOM 816 C GLN A 65 -8.045 4.881 -13.927 1.00 10.00 C ATOM 817 O GLN A 65 -7.522 5.230 -12.872 1.00 10.00 O ATOM 818 CB GLN A 65 -7.852 6.636 -15.702 1.00 10.00 C ATOM 819 CG GLN A 65 -8.361 7.984 -16.179 1.00 10.00 C ATOM 820 CD GLN A 65 -9.569 7.871 -17.087 1.00 10.00 C ATOM 821 OE1 GLN A 65 -9.712 6.906 -17.842 1.00 10.00 O ATOM 822 NE2 GLN A 65 -10.447 8.854 -17.010 1.00 10.00 N ATOM 0 H GLN A 65 -8.936 7.503 -13.427 1.00 10.00 H new ATOM 0 HA GLN A 65 -9.559 5.361 -15.372 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -6.905 6.781 -15.182 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -7.647 6.009 -16.570 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -8.619 8.596 -15.315 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -7.562 8.502 -16.709 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -10.286 9.632 -16.371 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -11.286 8.835 -17.590 1.00 10.00 H new ATOM 831 N PRO A 66 -7.976 3.611 -14.369 1.00 10.00 N ATOM 832 CA PRO A 66 -7.243 2.558 -13.654 1.00 10.00 C ATOM 833 C PRO A 66 -5.762 2.897 -13.491 1.00 10.00 C ATOM 834 O PRO A 66 -5.138 3.449 -14.401 1.00 10.00 O ATOM 835 CB PRO A 66 -7.411 1.321 -14.546 1.00 10.00 C ATOM 836 CG PRO A 66 -8.601 1.611 -15.387 1.00 10.00 C ATOM 837 CD PRO A 66 -8.621 3.097 -15.586 1.00 10.00 C ATOM 0 HA PRO A 66 -7.623 2.418 -12.642 1.00 10.00 H new ATOM 0 HB2 PRO A 66 -6.526 1.154 -15.159 1.00 10.00 H new ATOM 0 HB3 PRO A 66 -7.560 0.421 -13.949 1.00 10.00 H new ATOM 0 HG2 PRO A 66 -8.538 1.091 -16.343 1.00 10.00 H new ATOM 0 HG3 PRO A 66 -9.515 1.271 -14.899 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -8.077 3.390 -16.484 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -9.638 3.475 -15.692 1.00 10.00 H new ATOM 845 N ILE A 67 -5.212 2.571 -12.329 1.00 10.00 N ATOM 846 CA ILE A 67 -3.813 2.843 -12.042 1.00 10.00 C ATOM 847 C ILE A 67 -2.914 1.766 -12.636 1.00 10.00 C ATOM 848 O ILE A 67 -3.125 0.572 -12.412 1.00 10.00 O ATOM 849 CB ILE A 67 -3.560 2.942 -10.523 1.00 10.00 C ATOM 850 CG1 ILE A 67 -4.348 4.114 -9.933 1.00 10.00 C ATOM 851 CG2 ILE A 67 -2.071 3.095 -10.232 1.00 10.00 C ATOM 852 CD1 ILE A 67 -4.205 4.248 -8.435 1.00 10.00 C ATOM 0 H ILE A 67 -5.717 2.116 -11.568 1.00 10.00 H new ATOM 0 HA ILE A 67 -3.572 3.802 -12.501 1.00 10.00 H new ATOM 0 HB ILE A 67 -3.902 2.020 -10.054 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -4.015 5.038 -10.405 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -5.403 3.992 -10.179 1.00 10.00 H new ATOM 0 HG21 ILE A 67 -1.916 3.163 -9.155 1.00 10.00 H new ATOM 0 HG22 ILE A 67 -1.533 2.231 -10.622 1.00 10.00 H new ATOM 0 HG23 ILE A 67 -1.698 4.001 -10.710 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -4.791 5.099 -8.088 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -4.565 3.339 -7.952 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -3.156 4.402 -8.182 1.00 10.00 H new ATOM 864 N ASN A 68 -1.925 2.198 -13.406 1.00 10.00 N ATOM 865 CA ASN A 68 -0.975 1.289 -14.036 1.00 10.00 C ATOM 866 C ASN A 68 -0.033 0.692 -12.989 1.00 10.00 C ATOM 867 O ASN A 68 0.293 1.337 -11.991 1.00 10.00 O ATOM 868 CB ASN A 68 -0.180 2.030 -15.120 1.00 10.00 C ATOM 869 CG ASN A 68 0.865 1.160 -15.794 1.00 10.00 C ATOM 870 OD1 ASN A 68 0.662 -0.032 -16.002 1.00 10.00 O ATOM 871 ND2 ASN A 68 2.000 1.751 -16.125 1.00 10.00 N ATOM 0 H ASN A 68 -1.758 3.183 -13.611 1.00 10.00 H new ATOM 0 HA ASN A 68 -1.525 0.472 -14.504 1.00 10.00 H new ATOM 0 HB2 ASN A 68 -0.871 2.407 -15.874 1.00 10.00 H new ATOM 0 HB3 ASN A 68 0.310 2.896 -14.674 1.00 10.00 H new ATOM 0 HD21 ASN A 68 2.744 1.213 -16.570 1.00 10.00 H new ATOM 0 HD22 ASN A 68 2.132 2.745 -15.936 1.00 10.00 H new ATOM 878 N GLU A 69 0.409 -0.536 -13.234 1.00 10.00 N ATOM 879 CA GLU A 69 1.294 -1.247 -12.314 1.00 10.00 C ATOM 880 C GLU A 69 2.745 -0.765 -12.420 1.00 10.00 C ATOM 881 O GLU A 69 3.589 -1.138 -11.604 1.00 10.00 O ATOM 882 CB GLU A 69 1.209 -2.751 -12.578 1.00 10.00 C ATOM 883 CG GLU A 69 -0.153 -3.339 -12.249 1.00 10.00 C ATOM 884 CD GLU A 69 -0.393 -4.674 -12.917 1.00 10.00 C ATOM 885 OE1 GLU A 69 -0.369 -5.709 -12.220 1.00 10.00 O ATOM 886 OE2 GLU A 69 -0.617 -4.698 -14.147 1.00 10.00 O ATOM 0 H GLU A 69 0.167 -1.066 -14.071 1.00 10.00 H new ATOM 0 HA GLU A 69 0.961 -1.034 -11.298 1.00 10.00 H new ATOM 0 HB2 GLU A 69 1.437 -2.943 -13.626 1.00 10.00 H new ATOM 0 HB3 GLU A 69 1.970 -3.261 -11.988 1.00 10.00 H new ATOM 0 HG2 GLU A 69 -0.241 -3.458 -11.169 1.00 10.00 H new ATOM 0 HG3 GLU A 69 -0.930 -2.639 -12.557 1.00 10.00 H new ATOM 893 N THR A 70 3.034 0.055 -13.418 1.00 10.00 N ATOM 894 CA THR A 70 4.381 0.583 -13.601 1.00 10.00 C ATOM 895 C THR A 70 4.380 2.111 -13.570 1.00 10.00 C ATOM 896 O THR A 70 5.249 2.762 -14.159 1.00 10.00 O ATOM 897 CB THR A 70 4.993 0.099 -14.928 1.00 10.00 C ATOM 898 OG1 THR A 70 3.975 -0.467 -15.762 1.00 10.00 O ATOM 899 CG2 THR A 70 6.083 -0.933 -14.681 1.00 10.00 C ATOM 0 H THR A 70 2.357 0.370 -14.113 1.00 10.00 H new ATOM 0 HA THR A 70 4.988 0.210 -12.776 1.00 10.00 H new ATOM 0 HB THR A 70 5.437 0.959 -15.429 1.00 10.00 H new ATOM 0 HG1 THR A 70 4.373 -0.770 -16.604 1.00 10.00 H new ATOM 0 HG21 THR A 70 6.499 -1.258 -15.635 1.00 10.00 H new ATOM 0 HG22 THR A 70 6.872 -0.490 -14.073 1.00 10.00 H new ATOM 0 HG23 THR A 70 5.660 -1.791 -14.158 1.00 10.00 H new ATOM 907 N ASP A 71 3.406 2.677 -12.869 1.00 10.00 N ATOM 908 CA ASP A 71 3.273 4.127 -12.765 1.00 10.00 C ATOM 909 C ASP A 71 3.713 4.633 -11.395 1.00 10.00 C ATOM 910 O ASP A 71 3.751 3.875 -10.421 1.00 10.00 O ATOM 911 CB ASP A 71 1.823 4.547 -13.024 1.00 10.00 C ATOM 912 CG ASP A 71 1.590 4.982 -14.456 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.104 4.318 -15.380 1.00 10.00 O ATOM 914 OD2 ASP A 71 0.878 5.982 -14.667 1.00 10.00 O ATOM 0 H ASP A 71 2.693 2.153 -12.362 1.00 10.00 H new ATOM 0 HA ASP A 71 3.923 4.571 -13.519 1.00 10.00 H new ATOM 0 HB2 ASP A 71 1.160 3.715 -12.788 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.560 5.364 -12.352 1.00 10.00 H new ATOM 919 N THR A 72 4.035 5.918 -11.331 1.00 10.00 N ATOM 920 CA THR A 72 4.470 6.552 -10.096 1.00 10.00 C ATOM 921 C THR A 72 3.618 7.790 -9.811 1.00 10.00 C ATOM 922 O THR A 72 2.985 8.326 -10.722 1.00 10.00 O ATOM 923 CB THR A 72 5.957 6.959 -10.184 1.00 10.00 C ATOM 924 OG1 THR A 72 6.294 7.281 -11.539 1.00 10.00 O ATOM 925 CG2 THR A 72 6.863 5.843 -9.688 1.00 10.00 C ATOM 0 H THR A 72 4.002 6.548 -12.132 1.00 10.00 H new ATOM 0 HA THR A 72 4.349 5.834 -9.285 1.00 10.00 H new ATOM 0 HB THR A 72 6.106 7.832 -9.549 1.00 10.00 H new ATOM 0 HG1 THR A 72 7.238 7.540 -11.589 1.00 10.00 H new ATOM 0 HG21 THR A 72 7.904 6.159 -9.762 1.00 10.00 H new ATOM 0 HG22 THR A 72 6.626 5.617 -8.649 1.00 10.00 H new ATOM 0 HG23 THR A 72 6.710 4.952 -10.297 1.00 10.00 H new ATOM 933 N PRO A 73 3.582 8.265 -8.552 1.00 10.00 N ATOM 934 CA PRO A 73 2.797 9.446 -8.176 1.00 10.00 C ATOM 935 C PRO A 73 3.214 10.679 -8.970 1.00 10.00 C ATOM 936 O PRO A 73 2.370 11.440 -9.450 1.00 10.00 O ATOM 937 CB PRO A 73 3.112 9.639 -6.687 1.00 10.00 C ATOM 938 CG PRO A 73 3.611 8.321 -6.219 1.00 10.00 C ATOM 939 CD PRO A 73 4.291 7.689 -7.397 1.00 10.00 C ATOM 0 HA PRO A 73 1.735 9.310 -8.379 1.00 10.00 H new ATOM 0 HB2 PRO A 73 3.861 10.418 -6.541 1.00 10.00 H new ATOM 0 HB3 PRO A 73 2.224 9.943 -6.133 1.00 10.00 H new ATOM 0 HG2 PRO A 73 4.305 8.441 -5.387 1.00 10.00 H new ATOM 0 HG3 PRO A 73 2.790 7.698 -5.863 1.00 10.00 H new ATOM 0 HD2 PRO A 73 5.355 7.925 -7.421 1.00 10.00 H new ATOM 0 HD3 PRO A 73 4.206 6.603 -7.375 1.00 10.00 H new ATOM 947 N ALA A 74 4.524 10.856 -9.120 1.00 10.00 N ATOM 948 CA ALA A 74 5.068 11.991 -9.856 1.00 10.00 C ATOM 949 C ALA A 74 4.725 11.906 -11.338 1.00 10.00 C ATOM 950 O ALA A 74 4.600 12.925 -12.015 1.00 10.00 O ATOM 951 CB ALA A 74 6.577 12.064 -9.671 1.00 10.00 C ATOM 0 H ALA A 74 5.230 10.225 -8.740 1.00 10.00 H new ATOM 0 HA ALA A 74 4.614 12.898 -9.456 1.00 10.00 H new ATOM 0 HB1 ALA A 74 6.971 12.916 -10.226 1.00 10.00 H new ATOM 0 HB2 ALA A 74 6.809 12.182 -8.612 1.00 10.00 H new ATOM 0 HB3 ALA A 74 7.034 11.147 -10.042 1.00 10.00 H new ATOM 957 N GLN A 75 4.559 10.685 -11.829 1.00 10.00 N ATOM 958 CA GLN A 75 4.238 10.459 -13.232 1.00 10.00 C ATOM 959 C GLN A 75 2.765 10.748 -13.501 1.00 10.00 C ATOM 960 O GLN A 75 2.393 11.167 -14.596 1.00 10.00 O ATOM 961 CB GLN A 75 4.567 9.016 -13.618 1.00 10.00 C ATOM 962 CG GLN A 75 4.993 8.848 -15.070 1.00 10.00 C ATOM 963 CD GLN A 75 6.231 9.657 -15.411 1.00 10.00 C ATOM 964 OE1 GLN A 75 7.072 9.930 -14.552 1.00 10.00 O ATOM 965 NE2 GLN A 75 6.355 10.041 -16.669 1.00 10.00 N ATOM 0 H GLN A 75 4.642 9.833 -11.274 1.00 10.00 H new ATOM 0 HA GLN A 75 4.839 11.137 -13.837 1.00 10.00 H new ATOM 0 HB2 GLN A 75 5.364 8.650 -12.971 1.00 10.00 H new ATOM 0 HB3 GLN A 75 3.693 8.392 -13.431 1.00 10.00 H new ATOM 0 HG2 GLN A 75 5.186 7.794 -15.269 1.00 10.00 H new ATOM 0 HG3 GLN A 75 4.174 9.151 -15.723 1.00 10.00 H new ATOM 0 HE21 GLN A 75 5.637 9.795 -17.350 1.00 10.00 H new ATOM 0 HE22 GLN A 75 7.169 10.583 -16.959 1.00 10.00 H new ATOM 974 N LEU A 76 1.933 10.525 -12.491 1.00 10.00 N ATOM 975 CA LEU A 76 0.498 10.755 -12.614 1.00 10.00 C ATOM 976 C LEU A 76 0.125 12.167 -12.174 1.00 10.00 C ATOM 977 O LEU A 76 -1.051 12.532 -12.179 1.00 10.00 O ATOM 978 CB LEU A 76 -0.278 9.730 -11.783 1.00 10.00 C ATOM 979 CG LEU A 76 -0.511 8.379 -12.460 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.218 7.426 -11.511 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.318 8.553 -13.736 1.00 10.00 C ATOM 0 H LEU A 76 2.228 10.184 -11.576 1.00 10.00 H new ATOM 0 HA LEU A 76 0.231 10.642 -13.665 1.00 10.00 H new ATOM 0 HB2 LEU A 76 0.260 9.562 -10.850 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -1.246 10.158 -11.521 1.00 10.00 H new ATOM 0 HG LEU A 76 0.458 7.953 -12.721 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -1.377 6.469 -12.008 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -0.605 7.276 -10.622 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.180 7.848 -11.221 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -1.474 7.581 -14.204 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.283 9.000 -13.498 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -0.777 9.203 -14.423 1.00 10.00 H new ATOM 993 N GLU A 77 1.137 12.949 -11.790 1.00 10.00 N ATOM 994 CA GLU A 77 0.936 14.327 -11.346 1.00 10.00 C ATOM 995 C GLU A 77 0.020 14.375 -10.119 1.00 10.00 C ATOM 996 O GLU A 77 -0.789 15.296 -9.963 1.00 10.00 O ATOM 997 CB GLU A 77 0.346 15.174 -12.478 1.00 10.00 C ATOM 998 CG GLU A 77 1.165 15.149 -13.762 1.00 10.00 C ATOM 999 CD GLU A 77 2.448 15.942 -13.651 1.00 10.00 C ATOM 1000 OE1 GLU A 77 2.425 17.044 -13.063 1.00 10.00 O ATOM 1001 OE2 GLU A 77 3.486 15.475 -14.170 1.00 10.00 O ATOM 0 H GLU A 77 2.111 12.646 -11.779 1.00 10.00 H new ATOM 0 HA GLU A 77 1.906 14.739 -11.069 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -0.662 14.820 -12.695 1.00 10.00 H new ATOM 0 HB3 GLU A 77 0.255 16.205 -12.137 1.00 10.00 H new ATOM 0 HG2 GLU A 77 1.402 14.116 -14.017 1.00 10.00 H new ATOM 0 HG3 GLU A 77 0.565 15.549 -14.579 1.00 10.00 H new ATOM 1008 N MET A 78 0.160 13.380 -9.250 1.00 10.00 N ATOM 1009 CA MET A 78 -0.652 13.296 -8.043 1.00 10.00 C ATOM 1010 C MET A 78 -0.242 14.379 -7.054 1.00 10.00 C ATOM 1011 O MET A 78 0.934 14.743 -6.968 1.00 10.00 O ATOM 1012 CB MET A 78 -0.523 11.913 -7.400 1.00 10.00 C ATOM 1013 CG MET A 78 -0.925 10.774 -8.326 1.00 10.00 C ATOM 1014 SD MET A 78 -0.827 9.155 -7.538 1.00 10.00 S ATOM 1015 CE MET A 78 -2.265 9.214 -6.469 1.00 10.00 C ATOM 0 H MET A 78 0.830 12.619 -9.360 1.00 10.00 H new ATOM 0 HA MET A 78 -1.695 13.450 -8.319 1.00 10.00 H new ATOM 0 HB2 MET A 78 0.508 11.764 -7.080 1.00 10.00 H new ATOM 0 HB3 MET A 78 -1.143 11.878 -6.504 1.00 10.00 H new ATOM 0 HG2 MET A 78 -1.944 10.940 -8.676 1.00 10.00 H new ATOM 0 HG3 MET A 78 -0.281 10.783 -9.205 1.00 10.00 H new ATOM 0 HE1 MET A 78 -1.947 9.154 -5.428 1.00 10.00 H new ATOM 0 HE2 MET A 78 -2.801 10.149 -6.631 1.00 10.00 H new ATOM 0 HE3 MET A 78 -2.922 8.375 -6.697 1.00 10.00 H new ATOM 1025 N GLU A 79 -1.213 14.888 -6.314 1.00 10.00 N ATOM 1026 CA GLU A 79 -0.960 15.939 -5.344 1.00 10.00 C ATOM 1027 C GLU A 79 -1.190 15.438 -3.929 1.00 10.00 C ATOM 1028 O GLU A 79 -1.586 14.290 -3.722 1.00 10.00 O ATOM 1029 CB GLU A 79 -1.860 17.142 -5.621 1.00 10.00 C ATOM 1030 CG GLU A 79 -1.528 17.860 -6.917 1.00 10.00 C ATOM 1031 CD GLU A 79 -0.224 18.626 -6.848 1.00 10.00 C ATOM 1032 OE1 GLU A 79 0.742 18.126 -6.231 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -0.158 19.732 -7.421 1.00 10.00 O ATOM 0 H GLU A 79 -2.187 14.589 -6.367 1.00 10.00 H new ATOM 0 HA GLU A 79 0.083 16.242 -5.438 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -2.898 16.810 -5.654 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -1.777 17.846 -4.793 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.474 17.132 -7.726 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.336 18.549 -7.162 1.00 10.00 H new ATOM 1040 N ASP A 80 -0.928 16.296 -2.956 1.00 10.00 N ATOM 1041 CA ASP A 80 -1.121 15.934 -1.565 1.00 10.00 C ATOM 1042 C ASP A 80 -2.608 15.873 -1.264 1.00 10.00 C ATOM 1043 O ASP A 80 -3.382 16.683 -1.779 1.00 10.00 O ATOM 1044 CB ASP A 80 -0.430 16.931 -0.631 1.00 10.00 C ATOM 1045 CG ASP A 80 0.416 16.241 0.421 1.00 10.00 C ATOM 1046 OD1 ASP A 80 1.291 15.429 0.049 1.00 10.00 O ATOM 1047 OD2 ASP A 80 0.226 16.514 1.625 1.00 10.00 O ATOM 0 H ASP A 80 -0.582 17.244 -3.105 1.00 10.00 H new ATOM 0 HA ASP A 80 -0.672 14.956 -1.394 1.00 10.00 H new ATOM 0 HB2 ASP A 80 0.199 17.600 -1.218 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -1.183 17.549 -0.141 1.00 10.00 H new ATOM 1052 N GLU A 81 -2.993 14.883 -0.468 1.00 10.00 N ATOM 1053 CA GLU A 81 -4.384 14.663 -0.080 1.00 10.00 C ATOM 1054 C GLU A 81 -5.183 14.043 -1.227 1.00 10.00 C ATOM 1055 O GLU A 81 -6.410 13.956 -1.159 1.00 10.00 O ATOM 1056 CB GLU A 81 -5.058 15.956 0.399 1.00 10.00 C ATOM 1057 CG GLU A 81 -4.553 16.448 1.745 1.00 10.00 C ATOM 1058 CD GLU A 81 -5.478 17.469 2.371 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -5.062 18.634 2.532 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -6.630 17.111 2.700 1.00 10.00 O ATOM 0 H GLU A 81 -2.345 14.204 -0.069 1.00 10.00 H new ATOM 0 HA GLU A 81 -4.373 13.964 0.757 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -4.898 16.736 -0.346 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -6.134 15.792 0.463 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -4.442 15.600 2.421 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -3.563 16.887 1.620 1.00 10.00 H new ATOM 1067 N ASP A 82 -4.484 13.608 -2.277 1.00 10.00 N ATOM 1068 CA ASP A 82 -5.144 12.977 -3.419 1.00 10.00 C ATOM 1069 C ASP A 82 -5.789 11.676 -2.970 1.00 10.00 C ATOM 1070 O ASP A 82 -5.214 10.937 -2.170 1.00 10.00 O ATOM 1071 CB ASP A 82 -4.153 12.711 -4.557 1.00 10.00 C ATOM 1072 CG ASP A 82 -4.619 13.292 -5.880 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -5.814 13.140 -6.214 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -3.788 13.901 -6.594 1.00 10.00 O ATOM 0 H ASP A 82 -3.470 13.680 -2.360 1.00 10.00 H new ATOM 0 HA ASP A 82 -5.908 13.655 -3.798 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -3.184 13.137 -4.298 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -4.010 11.636 -4.666 1.00 10.00 H new ATOM 1079 N THR A 83 -6.975 11.395 -3.472 1.00 10.00 N ATOM 1080 CA THR A 83 -7.696 10.198 -3.070 1.00 10.00 C ATOM 1081 C THR A 83 -7.687 9.120 -4.152 1.00 10.00 C ATOM 1082 O THR A 83 -7.882 9.405 -5.334 1.00 10.00 O ATOM 1083 CB THR A 83 -9.147 10.551 -2.700 1.00 10.00 C ATOM 1084 OG1 THR A 83 -9.163 11.794 -1.983 1.00 10.00 O ATOM 1085 CG2 THR A 83 -9.780 9.459 -1.847 1.00 10.00 C ATOM 0 H THR A 83 -7.461 11.975 -4.156 1.00 10.00 H new ATOM 0 HA THR A 83 -7.180 9.792 -2.200 1.00 10.00 H new ATOM 0 HB THR A 83 -9.726 10.641 -3.619 1.00 10.00 H new ATOM 0 HG1 THR A 83 -10.086 12.024 -1.747 1.00 10.00 H new ATOM 0 HG21 THR A 83 -10.805 9.737 -1.602 1.00 10.00 H new ATOM 0 HG22 THR A 83 -9.781 8.520 -2.400 1.00 10.00 H new ATOM 0 HG23 THR A 83 -9.207 9.337 -0.928 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.443 7.888 -3.726 1.00 10.00 N ATOM 1094 CA ILE A 84 -7.417 6.740 -4.621 1.00 10.00 C ATOM 1095 C ILE A 84 -8.644 5.869 -4.373 1.00 10.00 C ATOM 1096 O ILE A 84 -8.974 5.562 -3.223 1.00 10.00 O ATOM 1097 CB ILE A 84 -6.138 5.896 -4.420 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -4.893 6.776 -4.567 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -6.096 4.744 -5.414 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -3.608 6.091 -4.154 1.00 10.00 C ATOM 0 H ILE A 84 -7.258 7.657 -2.750 1.00 10.00 H new ATOM 0 HA ILE A 84 -7.423 7.111 -5.646 1.00 10.00 H new ATOM 0 HB ILE A 84 -6.153 5.479 -3.413 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -4.806 7.095 -5.606 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -5.023 7.676 -3.966 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -5.188 4.161 -5.257 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -6.967 4.105 -5.268 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -6.102 5.139 -6.430 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -2.771 6.777 -4.286 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -3.673 5.796 -3.107 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.453 5.206 -4.771 1.00 10.00 H new ATOM 1112 N ASP A 85 -9.314 5.474 -5.445 1.00 10.00 N ATOM 1113 CA ASP A 85 -10.517 4.657 -5.338 1.00 10.00 C ATOM 1114 C ASP A 85 -10.201 3.173 -5.452 1.00 10.00 C ATOM 1115 O ASP A 85 -9.410 2.757 -6.302 1.00 10.00 O ATOM 1116 CB ASP A 85 -11.520 5.048 -6.422 1.00 10.00 C ATOM 1117 CG ASP A 85 -12.286 6.307 -6.077 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -13.401 6.197 -5.528 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -11.780 7.414 -6.359 1.00 10.00 O ATOM 0 H ASP A 85 -9.046 5.706 -6.401 1.00 10.00 H new ATOM 0 HA ASP A 85 -10.949 4.839 -4.354 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -10.993 5.194 -7.365 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -12.223 4.229 -6.574 1.00 10.00 H new ATOM 1124 N VAL A 86 -10.825 2.381 -4.589 1.00 10.00 N ATOM 1125 CA VAL A 86 -10.636 0.935 -4.584 1.00 10.00 C ATOM 1126 C VAL A 86 -11.959 0.237 -4.875 1.00 10.00 C ATOM 1127 O VAL A 86 -12.927 0.390 -4.130 1.00 10.00 O ATOM 1128 CB VAL A 86 -10.089 0.432 -3.227 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -9.691 -1.033 -3.319 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -8.912 1.280 -2.766 1.00 10.00 C ATOM 0 H VAL A 86 -11.472 2.720 -3.877 1.00 10.00 H new ATOM 0 HA VAL A 86 -9.906 0.699 -5.358 1.00 10.00 H new ATOM 0 HB VAL A 86 -10.884 0.526 -2.487 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -9.309 -1.367 -2.355 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -10.561 -1.630 -3.591 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -8.917 -1.153 -4.077 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -8.546 0.906 -1.810 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -8.113 1.227 -3.506 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -9.232 2.316 -2.651 1.00 10.00 H new ATOM 1140 N PHE A 87 -12.001 -0.516 -5.961 1.00 10.00 N ATOM 1141 CA PHE A 87 -13.209 -1.236 -6.351 1.00 10.00 C ATOM 1142 C PHE A 87 -12.964 -2.740 -6.323 1.00 10.00 C ATOM 1143 O PHE A 87 -11.833 -3.185 -6.130 1.00 10.00 O ATOM 1144 CB PHE A 87 -13.663 -0.805 -7.748 1.00 10.00 C ATOM 1145 CG PHE A 87 -13.997 0.656 -7.852 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -15.153 1.159 -7.277 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -13.155 1.525 -8.525 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -15.463 2.503 -7.372 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -13.459 2.869 -8.624 1.00 10.00 C ATOM 1150 CZ PHE A 87 -14.615 3.359 -8.048 1.00 10.00 C ATOM 0 H PHE A 87 -11.211 -0.647 -6.593 1.00 10.00 H new ATOM 0 HA PHE A 87 -13.997 -0.995 -5.637 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -12.876 -1.040 -8.465 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -14.538 -1.390 -8.032 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -15.820 0.494 -6.749 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -12.250 1.148 -8.978 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -16.367 2.883 -6.919 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -12.793 3.536 -9.151 1.00 10.00 H new ATOM 0 HZ PHE A 87 -14.855 4.409 -8.126 1.00 10.00 H new ATOM 1160 N GLN A 88 -14.020 -3.519 -6.512 1.00 10.00 N ATOM 1161 CA GLN A 88 -13.909 -4.971 -6.513 1.00 10.00 C ATOM 1162 C GLN A 88 -14.315 -5.541 -7.864 1.00 10.00 C ATOM 1163 O GLN A 88 -15.199 -5.001 -8.535 1.00 10.00 O ATOM 1164 CB GLN A 88 -14.773 -5.580 -5.409 1.00 10.00 C ATOM 1165 CG GLN A 88 -14.192 -5.404 -4.018 1.00 10.00 C ATOM 1166 CD GLN A 88 -13.763 -6.719 -3.390 1.00 10.00 C ATOM 1167 OE1 GLN A 88 -13.408 -7.672 -4.085 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -13.784 -6.775 -2.068 1.00 10.00 N ATOM 0 H GLN A 88 -14.965 -3.169 -6.667 1.00 10.00 H new ATOM 0 HA GLN A 88 -12.867 -5.228 -6.324 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -15.763 -5.125 -5.441 1.00 10.00 H new ATOM 0 HB3 GLN A 88 -14.905 -6.644 -5.607 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -13.334 -4.734 -4.069 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -14.933 -4.925 -3.378 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -14.085 -5.964 -1.528 1.00 10.00 H new ATOM 0 HE22 GLN A 88 -13.500 -7.630 -1.589 1.00 10.00 H new ATOM 1177 N GLN A 89 -13.661 -6.622 -8.260 1.00 10.00 N ATOM 1178 CA GLN A 89 -13.947 -7.279 -9.525 1.00 10.00 C ATOM 1179 C GLN A 89 -15.188 -8.154 -9.391 1.00 10.00 C ATOM 1180 O GLN A 89 -15.378 -8.834 -8.379 1.00 10.00 O ATOM 1181 CB GLN A 89 -12.741 -8.117 -9.972 1.00 10.00 C ATOM 1182 CG GLN A 89 -12.952 -8.863 -11.284 1.00 10.00 C ATOM 1183 CD GLN A 89 -13.232 -7.937 -12.452 1.00 10.00 C ATOM 1184 OE1 GLN A 89 -12.773 -6.795 -12.485 1.00 10.00 O ATOM 1185 NE2 GLN A 89 -13.993 -8.424 -13.419 1.00 10.00 N ATOM 0 H GLN A 89 -12.921 -7.066 -7.717 1.00 10.00 H new ATOM 0 HA GLN A 89 -14.138 -6.520 -10.283 1.00 10.00 H new ATOM 0 HB2 GLN A 89 -11.875 -7.462 -10.074 1.00 10.00 H new ATOM 0 HB3 GLN A 89 -12.504 -8.839 -9.190 1.00 10.00 H new ATOM 0 HG2 GLN A 89 -12.066 -9.459 -11.504 1.00 10.00 H new ATOM 0 HG3 GLN A 89 -13.784 -9.558 -11.171 1.00 10.00 H new ATOM 0 HE21 GLN A 89 -14.354 -9.376 -13.354 1.00 10.00 H new ATOM 0 HE22 GLN A 89 -14.219 -7.848 -14.230 1.00 10.00 H new ATOM 1194 N GLN A 90 -16.038 -8.113 -10.408 1.00 10.00 N ATOM 1195 CA GLN A 90 -17.264 -8.895 -10.422 1.00 10.00 C ATOM 1196 C GLN A 90 -16.937 -10.382 -10.449 1.00 10.00 C ATOM 1197 O GLN A 90 -16.089 -10.823 -11.224 1.00 10.00 O ATOM 1198 CB GLN A 90 -18.125 -8.526 -11.635 1.00 10.00 C ATOM 1199 CG GLN A 90 -18.694 -7.111 -11.594 1.00 10.00 C ATOM 1200 CD GLN A 90 -17.647 -6.041 -11.839 1.00 10.00 C ATOM 1201 OE1 GLN A 90 -16.654 -6.265 -12.534 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -17.859 -4.870 -11.265 1.00 10.00 N ATOM 0 H GLN A 90 -15.898 -7.541 -11.241 1.00 10.00 H new ATOM 0 HA GLN A 90 -17.826 -8.671 -9.516 1.00 10.00 H new ATOM 0 HB2 GLN A 90 -17.526 -8.638 -12.539 1.00 10.00 H new ATOM 0 HB3 GLN A 90 -18.950 -9.235 -11.709 1.00 10.00 H new ATOM 0 HG2 GLN A 90 -19.480 -7.020 -12.344 1.00 10.00 H new ATOM 0 HG3 GLN A 90 -19.159 -6.941 -10.623 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -18.694 -4.724 -10.697 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -17.188 -4.112 -11.390 1.00 10.00 H new ATOM 1211 N THR A 91 -17.597 -11.145 -9.588 1.00 10.00 N ATOM 1212 CA THR A 91 -17.382 -12.582 -9.514 1.00 10.00 C ATOM 1213 C THR A 91 -17.987 -13.284 -10.729 1.00 10.00 C ATOM 1214 O THR A 91 -17.531 -14.354 -11.141 1.00 10.00 O ATOM 1215 CB THR A 91 -17.998 -13.159 -8.224 1.00 10.00 C ATOM 1216 OG1 THR A 91 -17.991 -12.158 -7.196 1.00 10.00 O ATOM 1217 CG2 THR A 91 -17.230 -14.384 -7.746 1.00 10.00 C ATOM 0 H THR A 91 -18.289 -10.789 -8.928 1.00 10.00 H new ATOM 0 HA THR A 91 -16.306 -12.758 -9.504 1.00 10.00 H new ATOM 0 HB THR A 91 -19.022 -13.461 -8.442 1.00 10.00 H new ATOM 0 HG1 THR A 91 -18.385 -12.527 -6.378 1.00 10.00 H new ATOM 0 HG21 THR A 91 -17.688 -14.768 -6.835 1.00 10.00 H new ATOM 0 HG22 THR A 91 -17.256 -15.154 -8.517 1.00 10.00 H new ATOM 0 HG23 THR A 91 -16.195 -14.108 -7.543 1.00 10.00 H new ATOM 1225 N GLY A 92 -19.010 -12.664 -11.305 1.00 10.00 N ATOM 1226 CA GLY A 92 -19.668 -13.223 -12.467 1.00 10.00 C ATOM 1227 C GLY A 92 -20.336 -12.153 -13.303 1.00 10.00 C ATOM 1228 O GLY A 92 -20.373 -10.984 -12.904 1.00 10.00 O ATOM 0 H GLY A 92 -19.397 -11.777 -10.983 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -18.939 -13.758 -13.076 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -20.412 -13.952 -12.148 1.00 10.00 H new ATOM 1233 N ASP B 195 -14.165 6.361 14.689 1.00 10.00 N ATOM 1234 CA ASP B 195 -14.154 5.738 13.373 1.00 10.00 C ATOM 1235 C ASP B 195 -12.910 4.867 13.233 1.00 10.00 C ATOM 1236 O ASP B 195 -12.293 4.506 14.239 1.00 10.00 O ATOM 1237 CB ASP B 195 -14.184 6.804 12.272 1.00 10.00 C ATOM 1238 CG ASP B 195 -14.954 6.348 11.046 1.00 10.00 C ATOM 1239 OD1 ASP B 195 -15.785 7.126 10.529 1.00 10.00 O ATOM 1240 OD2 ASP B 195 -14.737 5.204 10.592 1.00 10.00 O ATOM 0 HA ASP B 195 -15.043 5.116 13.267 1.00 10.00 H new ATOM 0 HB2 ASP B 195 -14.637 7.715 12.664 1.00 10.00 H new ATOM 0 HB3 ASP B 195 -13.163 7.054 11.984 1.00 10.00 H new ATOM 1245 N THR B 196 -12.539 4.530 12.003 1.00 10.00 N ATOM 1246 CA THR B 196 -11.365 3.711 11.775 1.00 10.00 C ATOM 1247 C THR B 196 -10.325 4.460 10.945 1.00 10.00 C ATOM 1248 O THR B 196 -10.629 4.980 9.866 1.00 10.00 O ATOM 1249 CB THR B 196 -11.729 2.400 11.053 1.00 10.00 C ATOM 1250 OG1 THR B 196 -12.807 1.746 11.731 1.00 10.00 O ATOM 1251 CG2 THR B 196 -10.524 1.473 10.970 1.00 10.00 C ATOM 0 H THR B 196 -13.034 4.811 11.156 1.00 10.00 H new ATOM 0 HA THR B 196 -10.947 3.477 12.754 1.00 10.00 H new ATOM 0 HB THR B 196 -12.043 2.645 10.038 1.00 10.00 H new ATOM 0 HG1 THR B 196 -13.032 0.915 11.263 1.00 10.00 H new ATOM 0 HG21 THR B 196 -10.806 0.554 10.456 1.00 10.00 H new ATOM 0 HG22 THR B 196 -9.723 1.966 10.419 1.00 10.00 H new ATOM 0 HG23 THR B 196 -10.178 1.234 11.976 1.00 10.00 H new ATOM 1259 N ALA B 197 -9.101 4.505 11.457 1.00 10.00 N ATOM 1260 CA ALA B 197 -8.003 5.176 10.780 1.00 10.00 C ATOM 1261 C ALA B 197 -6.852 4.205 10.542 1.00 10.00 C ATOM 1262 O ALA B 197 -6.405 3.531 11.467 1.00 10.00 O ATOM 1263 CB ALA B 197 -7.532 6.365 11.604 1.00 10.00 C ATOM 0 H ALA B 197 -8.845 4.080 12.348 1.00 10.00 H new ATOM 0 HA ALA B 197 -8.355 5.536 9.813 1.00 10.00 H new ATOM 0 HB1 ALA B 197 -6.709 6.861 11.089 1.00 10.00 H new ATOM 0 HB2 ALA B 197 -8.356 7.067 11.733 1.00 10.00 H new ATOM 0 HB3 ALA B 197 -7.193 6.019 12.581 1.00 10.00 H new ATOM 1269 N GLY B 198 -6.391 4.135 9.307 1.00 10.00 N ATOM 1270 CA GLY B 198 -5.298 3.251 8.954 1.00 10.00 C ATOM 1271 C GLY B 198 -4.141 4.009 8.333 1.00 10.00 C ATOM 1272 O GLY B 198 -4.358 4.839 7.459 1.00 10.00 O ATOM 0 H GLY B 198 -6.759 4.683 8.529 1.00 10.00 H new ATOM 0 HA2 GLY B 198 -4.953 2.726 9.845 1.00 10.00 H new ATOM 0 HA3 GLY B 198 -5.654 2.494 8.255 1.00 10.00 H new ATOM 1276 N CYS B 199 -2.921 3.760 8.786 1.00 10.00 N ATOM 1277 CA CYS B 199 -1.768 4.451 8.223 1.00 10.00 C ATOM 1278 C CYS B 199 -0.791 3.451 7.613 1.00 10.00 C ATOM 1279 O CYS B 199 -0.368 2.501 8.270 1.00 10.00 O ATOM 1280 CB CYS B 199 -1.068 5.275 9.312 1.00 10.00 C ATOM 1281 SG CYS B 199 -2.159 6.403 10.212 1.00 10.00 S ATOM 0 H CYS B 199 -2.704 3.096 9.529 1.00 10.00 H new ATOM 0 HA CYS B 199 -2.113 5.121 7.436 1.00 10.00 H new ATOM 0 HB2 CYS B 199 -0.603 4.593 10.024 1.00 10.00 H new ATOM 0 HB3 CYS B 199 -0.266 5.853 8.854 1.00 10.00 H new ATOM 0 HG CYS B 199 -1.473 7.048 11.108 1.00 10.00 H new ATOM 1287 N ILE B 200 -0.461 3.652 6.342 1.00 10.00 N ATOM 1288 CA ILE B 200 0.481 2.779 5.647 1.00 10.00 C ATOM 1289 C ILE B 200 1.637 3.584 5.055 1.00 10.00 C ATOM 1290 O ILE B 200 1.415 4.587 4.375 1.00 10.00 O ATOM 1291 CB ILE B 200 -0.196 1.967 4.515 1.00 10.00 C ATOM 1292 CG1 ILE B 200 -1.443 1.248 5.036 1.00 10.00 C ATOM 1293 CG2 ILE B 200 0.791 0.963 3.929 1.00 10.00 C ATOM 1294 CD1 ILE B 200 -2.156 0.437 3.977 1.00 10.00 C ATOM 0 H ILE B 200 -0.831 4.412 5.771 1.00 10.00 H new ATOM 0 HA ILE B 200 0.860 2.081 6.394 1.00 10.00 H new ATOM 0 HB ILE B 200 -0.504 2.657 3.730 1.00 10.00 H new ATOM 0 HG12 ILE B 200 -1.157 0.589 5.856 1.00 10.00 H new ATOM 0 HG13 ILE B 200 -2.134 1.985 5.445 1.00 10.00 H new ATOM 0 HG21 ILE B 200 0.305 0.397 3.134 1.00 10.00 H new ATOM 0 HG22 ILE B 200 1.652 1.494 3.523 1.00 10.00 H new ATOM 0 HG23 ILE B 200 1.122 0.279 4.711 1.00 10.00 H new ATOM 0 HD11 ILE B 200 -3.030 -0.045 4.415 1.00 10.00 H new ATOM 0 HD12 ILE B 200 -2.472 1.094 3.167 1.00 10.00 H new ATOM 0 HD13 ILE B 200 -1.480 -0.323 3.585 1.00 10.00 H new ATOM 1306 N VAL B 201 2.862 3.159 5.324 1.00 10.00 N ATOM 1307 CA VAL B 201 4.034 3.831 4.780 1.00 10.00 C ATOM 1308 C VAL B 201 4.861 2.852 3.951 1.00 10.00 C ATOM 1309 O VAL B 201 5.150 1.738 4.403 1.00 10.00 O ATOM 1310 CB VAL B 201 4.916 4.460 5.889 1.00 10.00 C ATOM 1311 CG1 VAL B 201 5.232 3.448 6.982 1.00 10.00 C ATOM 1312 CG2 VAL B 201 6.200 5.036 5.298 1.00 10.00 C ATOM 0 H VAL B 201 3.071 2.354 5.914 1.00 10.00 H new ATOM 0 HA VAL B 201 3.678 4.642 4.145 1.00 10.00 H new ATOM 0 HB VAL B 201 4.352 5.275 6.342 1.00 10.00 H new ATOM 0 HG11 VAL B 201 5.852 3.918 7.745 1.00 10.00 H new ATOM 0 HG12 VAL B 201 4.304 3.098 7.433 1.00 10.00 H new ATOM 0 HG13 VAL B 201 5.767 2.602 6.551 1.00 10.00 H new ATOM 0 HG21 VAL B 201 6.803 5.472 6.094 1.00 10.00 H new ATOM 0 HG22 VAL B 201 6.764 4.242 4.809 1.00 10.00 H new ATOM 0 HG23 VAL B 201 5.951 5.806 4.568 1.00 10.00 H new ATOM 1322 N ILE B 202 5.201 3.240 2.729 1.00 10.00 N ATOM 1323 CA ILE B 202 6.002 2.386 1.867 1.00 10.00 C ATOM 1324 C ILE B 202 7.279 3.105 1.451 1.00 10.00 C ATOM 1325 O ILE B 202 7.251 4.259 1.026 1.00 10.00 O ATOM 1326 CB ILE B 202 5.230 1.880 0.616 1.00 10.00 C ATOM 1327 CG1 ILE B 202 5.127 2.964 -0.462 1.00 10.00 C ATOM 1328 CG2 ILE B 202 3.847 1.383 1.012 1.00 10.00 C ATOM 1329 CD1 ILE B 202 4.251 2.583 -1.631 1.00 10.00 C ATOM 0 H ILE B 202 4.936 4.134 2.316 1.00 10.00 H new ATOM 0 HA ILE B 202 6.254 1.501 2.452 1.00 10.00 H new ATOM 0 HB ILE B 202 5.794 1.049 0.191 1.00 10.00 H new ATOM 0 HG12 ILE B 202 4.737 3.876 -0.010 1.00 10.00 H new ATOM 0 HG13 ILE B 202 6.127 3.193 -0.830 1.00 10.00 H new ATOM 0 HG21 ILE B 202 3.319 1.032 0.125 1.00 10.00 H new ATOM 0 HG22 ILE B 202 3.945 0.564 1.724 1.00 10.00 H new ATOM 0 HG23 ILE B 202 3.285 2.197 1.470 1.00 10.00 H new ATOM 0 HD11 ILE B 202 4.229 3.401 -2.351 1.00 10.00 H new ATOM 0 HD12 ILE B 202 4.652 1.689 -2.110 1.00 10.00 H new ATOM 0 HD13 ILE B 202 3.239 2.383 -1.278 1.00 10.00 H new