USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 698 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 57 GLN : amide:sc= 0.473 K(o=0.71,f=-0.64) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.238 K(o=0.71,f=-1.9!) USER MOD Set 2.1: A 44 MET CE :methyl -174:sc= -0.323 (180deg=-0.406) USER MOD Set 2.2: A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 19 ASN : amide:sc= 1.93 K(o=2.9,f=-1.8) USER MOD Set 3.2: A 31 GLN : amide:sc= 0.988 K(o=2.9,f=0.12) USER MOD Set 4.1: A 28 SER OG : rot 180:sc= 0.0493 USER MOD Set 4.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 17 HIS : no HD1:sc= -0.116 X(o=-0.44,f=-0.44) USER MOD Set 5.2: B 365 SER OG : rot 180:sc= -0.324 USER MOD Single : A 21 LYS NZ :NH3+ -146:sc= 1.26 (180deg=0.982) USER MOD Single : A 25 GLN : amide:sc= 1.15 K(o=1.1,f=-0.29) 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 X(o=0,f=-0.24) USER MOD Single : A 38 THR OG1 : rot -160:sc= -1.03 USER MOD Single : A 41 SER OG : rot -99:sc= 1.45 USER MOD Single : A 42 LYS NZ :NH3+ 138:sc= 0.812 (180deg=-0.0464!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot -64:sc= -1.81 USER MOD Single : A 51 GLN : amide:sc= -1.46 K(o=-1.5,f=-3!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= -0.226 X(o=-0.23,f=-0.5) USER MOD Single : A 68 ASN : amide:sc= 1.2 K(o=1.2,f=-0.2) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0445 USER MOD Single : A 72 THR OG1 : rot 180:sc= -1.17 USER MOD Single : A 75 GLN : amide:sc= -0.0482 K(o=-0.048,f=-1.1) USER MOD Single : A 78 MET CE :methyl -109:sc= -1.85! (180deg=-2.83!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.213 K(o=-0.21,f=-0.73) USER MOD Single : A 90 GLN : amide:sc= 0.0578 K(o=0.058,f=-3.8!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.162 USER MOD Single : B 357 ASN :FLIP amide:sc= 0.778 F(o=-0.13,f=0.78) USER MOD Single : B 358 ASN : amide:sc= -2.37! C(o=-2.4!,f=-4.9!) USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -6.184 15.821 12.706 1.00 10.00 N ATOM 2 CA ASP A 16 -6.443 14.451 13.202 1.00 10.00 C ATOM 3 C ASP A 16 -5.906 13.419 12.225 1.00 10.00 C ATOM 4 O ASP A 16 -5.160 13.753 11.304 1.00 10.00 O ATOM 5 CB ASP A 16 -7.943 14.234 13.419 1.00 10.00 C ATOM 6 CG ASP A 16 -8.414 14.782 14.746 1.00 10.00 C ATOM 7 OD1 ASP A 16 -9.191 14.093 15.441 1.00 10.00 O ATOM 8 OD2 ASP A 16 -7.998 15.900 15.108 1.00 10.00 O ATOM 0 HA ASP A 16 -5.929 14.332 14.156 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -8.498 14.713 12.613 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -8.165 13.168 13.369 1.00 10.00 H new ATOM 13 N HIS A 17 -6.280 12.166 12.431 1.00 10.00 N ATOM 14 CA HIS A 17 -5.834 11.087 11.565 1.00 10.00 C ATOM 15 C HIS A 17 -6.852 10.846 10.452 1.00 10.00 C ATOM 16 O HIS A 17 -7.974 11.360 10.497 1.00 10.00 O ATOM 17 CB HIS A 17 -5.628 9.801 12.373 1.00 10.00 C ATOM 18 CG HIS A 17 -4.403 9.812 13.240 1.00 10.00 C ATOM 19 ND1 HIS A 17 -4.393 10.435 14.465 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.189 9.252 13.021 1.00 10.00 C ATOM 21 CE1 HIS A 17 -3.182 10.241 14.960 1.00 10.00 C ATOM 22 NE2 HIS A 17 -2.418 9.533 14.119 1.00 10.00 N ATOM 0 H HIS A 17 -6.892 11.871 13.192 1.00 10.00 H new ATOM 0 HA HIS A 17 -4.883 11.376 11.118 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.503 9.635 13.001 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.565 8.958 11.685 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -2.887 8.692 12.149 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -2.851 10.607 15.921 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -1.448 9.256 14.267 1.00 10.00 H new ATOM 30 N ILE A 18 -6.451 10.078 9.455 1.00 10.00 N ATOM 31 CA ILE A 18 -7.316 9.751 8.335 1.00 10.00 C ATOM 32 C ILE A 18 -7.475 8.236 8.244 1.00 10.00 C ATOM 33 O ILE A 18 -6.507 7.496 8.414 1.00 10.00 O ATOM 34 CB ILE A 18 -6.757 10.328 7.011 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.731 10.082 5.858 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.385 9.743 6.690 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.358 10.822 4.591 1.00 10.00 C ATOM 0 H ILE A 18 -5.520 9.665 9.398 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.294 10.204 8.500 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.641 11.404 7.139 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.772 9.013 5.648 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.732 10.385 6.166 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -5.018 10.167 5.755 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.690 9.983 7.495 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.465 8.660 6.591 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -8.090 10.604 3.813 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.345 11.894 4.786 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.370 10.502 4.260 1.00 10.00 H new ATOM 49 N ASN A 19 -8.691 7.773 8.011 1.00 10.00 N ATOM 50 CA ASN A 19 -8.946 6.341 7.934 1.00 10.00 C ATOM 51 C ASN A 19 -8.949 5.850 6.491 1.00 10.00 C ATOM 52 O ASN A 19 -9.944 5.987 5.775 1.00 10.00 O ATOM 53 CB ASN A 19 -10.283 5.995 8.601 1.00 10.00 C ATOM 54 CG ASN A 19 -10.334 6.407 10.062 1.00 10.00 C ATOM 55 OD1 ASN A 19 -9.934 5.653 10.950 1.00 10.00 O ATOM 56 ND2 ASN A 19 -10.832 7.608 10.322 1.00 10.00 N ATOM 0 H ASN A 19 -9.513 8.361 7.872 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.138 5.837 8.465 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.092 6.487 8.061 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.455 4.921 8.524 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -10.894 7.937 11.286 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.153 8.203 9.558 1.00 10.00 H new ATOM 63 N LEU A 20 -7.826 5.293 6.065 1.00 10.00 N ATOM 64 CA LEU A 20 -7.699 4.756 4.717 1.00 10.00 C ATOM 65 C LEU A 20 -7.954 3.255 4.754 1.00 10.00 C ATOM 66 O LEU A 20 -7.451 2.565 5.636 1.00 10.00 O ATOM 67 CB LEU A 20 -6.305 5.040 4.153 1.00 10.00 C ATOM 68 CG LEU A 20 -5.916 6.519 4.105 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.476 6.673 3.650 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.849 7.291 3.186 1.00 10.00 C ATOM 0 H LEU A 20 -6.985 5.200 6.635 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.431 5.237 4.069 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.570 4.506 4.755 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.248 4.632 3.144 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.009 6.930 5.110 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.215 7.731 3.621 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.817 6.155 4.347 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.361 6.244 2.655 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.554 8.340 3.167 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.790 6.879 2.179 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -7.872 7.208 3.553 1.00 10.00 H new ATOM 82 N LYS A 21 -8.727 2.744 3.813 1.00 10.00 N ATOM 83 CA LYS A 21 -9.046 1.324 3.802 1.00 10.00 C ATOM 84 C LYS A 21 -8.380 0.594 2.643 1.00 10.00 C ATOM 85 O LYS A 21 -8.638 0.876 1.472 1.00 10.00 O ATOM 86 CB LYS A 21 -10.561 1.129 3.747 1.00 10.00 C ATOM 87 CG LYS A 21 -11.272 1.626 4.995 1.00 10.00 C ATOM 88 CD LYS A 21 -12.665 2.144 4.681 1.00 10.00 C ATOM 89 CE LYS A 21 -13.616 1.019 4.308 1.00 10.00 C ATOM 90 NZ LYS A 21 -14.983 1.527 4.024 1.00 10.00 N ATOM 0 H LYS A 21 -9.143 3.282 3.053 1.00 10.00 H new ATOM 0 HA LYS A 21 -8.655 0.893 4.724 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.957 1.653 2.877 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -10.780 0.070 3.609 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.340 0.816 5.721 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -10.684 2.420 5.457 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.057 2.679 5.546 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -12.610 2.860 3.861 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -13.234 0.494 3.433 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.659 0.294 5.121 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -15.685 0.825 4.333 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.136 2.419 4.537 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.086 1.694 3.003 1.00 10.00 H new ATOM 104 N VAL A 22 -7.514 -0.341 2.987 1.00 10.00 N ATOM 105 CA VAL A 22 -6.818 -1.148 2.000 1.00 10.00 C ATOM 106 C VAL A 22 -7.453 -2.531 1.976 1.00 10.00 C ATOM 107 O VAL A 22 -7.591 -3.172 3.018 1.00 10.00 O ATOM 108 CB VAL A 22 -5.312 -1.271 2.322 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.566 -1.932 1.179 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.714 0.092 2.630 1.00 10.00 C ATOM 0 H VAL A 22 -7.273 -0.562 3.953 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.906 -0.665 1.027 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.208 -1.900 3.206 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.508 -2.007 1.430 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -4.970 -2.930 1.010 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.683 -1.335 0.275 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.653 -0.018 2.854 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.837 0.747 1.767 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.223 0.527 3.490 1.00 10.00 H new ATOM 120 N ALA A 23 -7.856 -2.989 0.801 1.00 10.00 N ATOM 121 CA ALA A 23 -8.503 -4.286 0.697 1.00 10.00 C ATOM 122 C ALA A 23 -7.829 -5.171 -0.337 1.00 10.00 C ATOM 123 O ALA A 23 -7.466 -4.715 -1.423 1.00 10.00 O ATOM 124 CB ALA A 23 -9.974 -4.112 0.356 1.00 10.00 C ATOM 0 H ALA A 23 -7.748 -2.490 -0.082 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.412 -4.779 1.665 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.448 -5.091 0.281 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.463 -3.531 1.138 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -10.067 -3.589 -0.596 1.00 10.00 H new ATOM 130 N GLY A 24 -7.668 -6.438 0.013 1.00 10.00 N ATOM 131 CA GLY A 24 -7.053 -7.384 -0.891 1.00 10.00 C ATOM 132 C GLY A 24 -8.093 -8.145 -1.683 1.00 10.00 C ATOM 133 O GLY A 24 -9.293 -8.013 -1.425 1.00 10.00 O ATOM 0 H GLY A 24 -7.954 -6.828 0.911 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -6.387 -6.857 -1.574 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.440 -8.085 -0.325 1.00 10.00 H new ATOM 137 N GLN A 25 -7.650 -8.956 -2.633 1.00 10.00 N ATOM 138 CA GLN A 25 -8.571 -9.730 -3.457 1.00 10.00 C ATOM 139 C GLN A 25 -8.988 -11.003 -2.723 1.00 10.00 C ATOM 140 O GLN A 25 -8.733 -12.118 -3.183 1.00 10.00 O ATOM 141 CB GLN A 25 -7.928 -10.077 -4.807 1.00 10.00 C ATOM 142 CG GLN A 25 -7.173 -8.920 -5.452 1.00 10.00 C ATOM 143 CD GLN A 25 -8.021 -7.673 -5.636 1.00 10.00 C ATOM 144 OE1 GLN A 25 -9.228 -7.747 -5.869 1.00 10.00 O ATOM 145 NE2 GLN A 25 -7.389 -6.516 -5.532 1.00 10.00 N ATOM 0 H GLN A 25 -6.664 -9.096 -2.853 1.00 10.00 H new ATOM 0 HA GLN A 25 -9.459 -9.126 -3.647 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -7.241 -10.912 -4.666 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -8.706 -10.416 -5.491 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -6.307 -8.674 -4.838 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -6.795 -9.239 -6.423 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -6.388 -6.497 -5.338 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.903 -5.642 -5.646 1.00 10.00 H new ATOM 154 N ASP A 26 -9.620 -10.817 -1.570 1.00 10.00 N ATOM 155 CA ASP A 26 -10.078 -11.928 -0.740 1.00 10.00 C ATOM 156 C ASP A 26 -11.164 -11.468 0.230 1.00 10.00 C ATOM 157 O ASP A 26 -12.052 -12.244 0.593 1.00 10.00 O ATOM 158 CB ASP A 26 -8.912 -12.561 0.033 1.00 10.00 C ATOM 159 CG ASP A 26 -8.236 -11.599 0.992 1.00 10.00 C ATOM 160 OD1 ASP A 26 -7.224 -10.978 0.605 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.704 -11.464 2.144 1.00 10.00 O ATOM 0 H ASP A 26 -9.829 -9.896 -1.184 1.00 10.00 H new ATOM 0 HA ASP A 26 -10.499 -12.684 -1.403 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.280 -13.422 0.592 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.174 -12.934 -0.677 1.00 10.00 H new ATOM 166 N GLY A 27 -11.098 -10.206 0.647 1.00 10.00 N ATOM 167 CA GLY A 27 -12.096 -9.679 1.561 1.00 10.00 C ATOM 168 C GLY A 27 -11.495 -9.002 2.777 1.00 10.00 C ATOM 169 O GLY A 27 -12.221 -8.447 3.601 1.00 10.00 O ATOM 0 H GLY A 27 -10.375 -9.542 0.370 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.725 -8.965 1.029 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.744 -10.492 1.889 1.00 10.00 H new ATOM 173 N SER A 28 -10.177 -9.060 2.908 1.00 10.00 N ATOM 174 CA SER A 28 -9.496 -8.433 4.032 1.00 10.00 C ATOM 175 C SER A 28 -9.562 -6.911 3.922 1.00 10.00 C ATOM 176 O SER A 28 -9.182 -6.343 2.895 1.00 10.00 O ATOM 177 CB SER A 28 -8.039 -8.896 4.077 1.00 10.00 C ATOM 178 OG SER A 28 -7.504 -9.015 2.767 1.00 10.00 O ATOM 0 H SER A 28 -9.558 -9.535 2.250 1.00 10.00 H new ATOM 0 HA SER A 28 -9.996 -8.731 4.954 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.445 -8.186 4.653 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.974 -9.856 4.589 1.00 10.00 H new ATOM 0 HG SER A 28 -6.571 -9.311 2.820 1.00 10.00 H new ATOM 184 N VAL A 29 -10.061 -6.250 4.963 1.00 10.00 N ATOM 185 CA VAL A 29 -10.163 -4.795 4.947 1.00 10.00 C ATOM 186 C VAL A 29 -9.401 -4.185 6.114 1.00 10.00 C ATOM 187 O VAL A 29 -9.865 -4.203 7.255 1.00 10.00 O ATOM 188 CB VAL A 29 -11.629 -4.309 4.993 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.690 -2.788 4.920 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.439 -4.936 3.867 1.00 10.00 C ATOM 0 H VAL A 29 -10.397 -6.693 5.818 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.723 -4.466 4.006 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.066 -4.624 5.941 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.730 -2.464 4.954 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -11.149 -2.361 5.765 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -11.234 -2.450 3.989 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.468 -4.581 3.918 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -12.005 -4.656 2.907 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.424 -6.021 3.969 1.00 10.00 H new ATOM 200 N VAL A 30 -8.229 -3.649 5.832 1.00 10.00 N ATOM 201 CA VAL A 30 -7.423 -3.034 6.870 1.00 10.00 C ATOM 202 C VAL A 30 -7.700 -1.535 6.934 1.00 10.00 C ATOM 203 O VAL A 30 -7.707 -0.843 5.912 1.00 10.00 O ATOM 204 CB VAL A 30 -5.913 -3.298 6.663 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.629 -4.787 6.705 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.422 -2.718 5.349 1.00 10.00 C ATOM 0 H VAL A 30 -7.816 -3.626 4.900 1.00 10.00 H new ATOM 0 HA VAL A 30 -7.704 -3.490 7.819 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.377 -2.804 7.474 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.563 -4.958 6.558 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -5.931 -5.188 7.673 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.189 -5.287 5.915 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.357 -2.922 5.237 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.968 -3.174 4.523 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.588 -1.641 5.342 1.00 10.00 H new ATOM 216 N GLN A 31 -7.962 -1.048 8.134 1.00 10.00 N ATOM 217 CA GLN A 31 -8.247 0.360 8.339 1.00 10.00 C ATOM 218 C GLN A 31 -6.998 1.083 8.821 1.00 10.00 C ATOM 219 O GLN A 31 -6.646 1.035 10.002 1.00 10.00 O ATOM 220 CB GLN A 31 -9.395 0.532 9.338 1.00 10.00 C ATOM 221 CG GLN A 31 -9.834 1.974 9.542 1.00 10.00 C ATOM 222 CD GLN A 31 -11.082 2.080 10.398 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.930 1.187 10.393 1.00 10.00 O ATOM 224 NE2 GLN A 31 -11.212 3.175 11.135 1.00 10.00 N ATOM 0 H GLN A 31 -7.983 -1.610 8.985 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.554 0.799 7.390 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.250 -0.051 8.996 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.091 0.117 10.299 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -9.026 2.535 10.011 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -10.021 2.435 8.572 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.488 3.893 11.113 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -12.036 3.299 11.724 1.00 10.00 H new ATOM 233 N PHE A 32 -6.322 1.734 7.893 1.00 10.00 N ATOM 234 CA PHE A 32 -5.110 2.465 8.200 1.00 10.00 C ATOM 235 C PHE A 32 -5.442 3.853 8.722 1.00 10.00 C ATOM 236 O PHE A 32 -5.781 4.752 7.951 1.00 10.00 O ATOM 237 CB PHE A 32 -4.229 2.580 6.961 1.00 10.00 C ATOM 238 CG PHE A 32 -3.252 1.450 6.808 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.560 0.350 6.027 1.00 10.00 C ATOM 240 CD2 PHE A 32 -2.025 1.491 7.446 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.660 -0.689 5.884 1.00 10.00 C ATOM 242 CE2 PHE A 32 -1.122 0.455 7.309 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.440 -0.636 6.526 1.00 10.00 C ATOM 0 H PHE A 32 -6.596 1.770 6.911 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.569 1.917 8.971 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.865 2.621 6.077 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.680 3.520 7.003 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.514 0.303 5.524 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.770 2.343 8.058 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.911 -1.541 5.270 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.168 0.499 7.814 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.735 -1.447 6.416 1.00 10.00 H new ATOM 253 N LYS A 33 -5.346 4.020 10.025 1.00 10.00 N ATOM 254 CA LYS A 33 -5.623 5.296 10.649 1.00 10.00 C ATOM 255 C LYS A 33 -4.317 6.060 10.825 1.00 10.00 C ATOM 256 O LYS A 33 -3.787 6.179 11.929 1.00 10.00 O ATOM 257 CB LYS A 33 -6.325 5.083 11.993 1.00 10.00 C ATOM 258 CG LYS A 33 -7.065 6.305 12.505 1.00 10.00 C ATOM 259 CD LYS A 33 -8.033 5.935 13.617 1.00 10.00 C ATOM 260 CE LYS A 33 -8.884 7.122 14.039 1.00 10.00 C ATOM 261 NZ LYS A 33 -9.935 6.728 15.013 1.00 10.00 N ATOM 0 H LYS A 33 -5.076 3.282 10.676 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.289 5.882 10.015 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.031 4.258 11.896 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.584 4.783 12.734 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -6.349 7.040 12.872 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.610 6.773 11.685 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.680 5.124 13.282 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -7.475 5.563 14.476 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -8.247 7.887 14.482 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -9.351 7.566 13.160 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -10.495 7.564 15.277 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -10.559 6.016 14.582 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -9.488 6.328 15.863 1.00 10.00 H new ATOM 275 N ILE A 34 -3.789 6.542 9.713 1.00 10.00 N ATOM 276 CA ILE A 34 -2.533 7.276 9.710 1.00 10.00 C ATOM 277 C ILE A 34 -2.783 8.769 9.554 1.00 10.00 C ATOM 278 O ILE A 34 -3.927 9.212 9.526 1.00 10.00 O ATOM 279 CB ILE A 34 -1.605 6.796 8.571 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.208 7.129 7.200 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.358 5.299 8.692 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.264 6.875 6.042 1.00 10.00 C ATOM 0 H ILE A 34 -4.215 6.437 8.792 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.045 7.086 10.666 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.652 7.319 8.659 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -3.112 6.537 7.057 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.508 8.177 7.190 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.703 4.972 7.884 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.887 5.084 9.651 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.307 4.767 8.627 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.759 7.133 5.106 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.370 7.487 6.160 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.983 5.822 6.026 1.00 10.00 H new ATOM 294 N LYS A 35 -1.717 9.544 9.464 1.00 10.00 N ATOM 295 CA LYS A 35 -1.851 10.979 9.290 1.00 10.00 C ATOM 296 C LYS A 35 -1.780 11.311 7.808 1.00 10.00 C ATOM 297 O LYS A 35 -1.148 10.593 7.034 1.00 10.00 O ATOM 298 CB LYS A 35 -0.764 11.729 10.066 1.00 10.00 C ATOM 299 CG LYS A 35 -0.837 11.510 11.568 1.00 10.00 C ATOM 300 CD LYS A 35 0.176 12.361 12.317 1.00 10.00 C ATOM 301 CE LYS A 35 0.110 12.101 13.815 1.00 10.00 C ATOM 302 NZ LYS A 35 1.005 13.004 14.583 1.00 10.00 N ATOM 0 H LYS A 35 -0.755 9.207 9.508 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.815 11.298 9.686 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.214 11.410 9.707 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.849 12.795 9.857 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.841 11.747 11.921 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.661 10.457 11.790 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.179 12.144 11.951 1.00 10.00 H new ATOM 0 HD3 LYS A 35 -0.014 13.416 12.119 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -0.916 12.231 14.159 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.384 11.065 14.014 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.926 12.790 15.598 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.988 12.863 14.275 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.728 13.992 14.415 1.00 10.00 H new ATOM 316 N ARG A 36 -2.421 12.399 7.411 1.00 10.00 N ATOM 317 CA ARG A 36 -2.437 12.812 6.010 1.00 10.00 C ATOM 318 C ARG A 36 -1.042 13.238 5.548 1.00 10.00 C ATOM 319 O ARG A 36 -0.789 13.395 4.352 1.00 10.00 O ATOM 320 CB ARG A 36 -3.440 13.952 5.810 1.00 10.00 C ATOM 321 CG ARG A 36 -4.870 13.559 6.155 1.00 10.00 C ATOM 322 CD ARG A 36 -5.794 14.767 6.225 1.00 10.00 C ATOM 323 NE ARG A 36 -6.193 15.244 4.902 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.388 15.008 4.345 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.301 14.280 4.984 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.673 15.502 3.148 1.00 10.00 N ATOM 0 H ARG A 36 -2.939 13.015 8.038 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.745 11.960 5.404 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.144 14.800 6.427 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.401 14.284 4.772 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.244 12.860 5.407 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.882 13.038 7.112 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.684 14.507 6.798 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.294 15.573 6.762 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.518 15.792 4.369 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -8.093 13.896 5.906 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.208 14.106 4.552 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.982 16.063 2.650 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.584 15.321 2.725 1.00 10.00 H new ATOM 340 N HIS A 37 -0.145 13.396 6.509 1.00 10.00 N ATOM 341 CA HIS A 37 1.231 13.804 6.238 1.00 10.00 C ATOM 342 C HIS A 37 2.179 12.608 6.322 1.00 10.00 C ATOM 343 O HIS A 37 3.401 12.768 6.313 1.00 10.00 O ATOM 344 CB HIS A 37 1.672 14.876 7.242 1.00 10.00 C ATOM 345 CG HIS A 37 0.576 15.814 7.658 1.00 10.00 C ATOM 346 ND1 HIS A 37 -0.222 15.547 8.745 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.183 16.979 7.092 1.00 10.00 C ATOM 348 CE1 HIS A 37 -1.078 16.554 8.817 1.00 10.00 C ATOM 349 NE2 HIS A 37 -0.871 17.444 7.835 1.00 10.00 N ATOM 0 H HIS A 37 -0.346 13.246 7.498 1.00 10.00 H new ATOM 0 HA HIS A 37 1.270 14.213 5.228 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.072 14.385 8.129 1.00 10.00 H new ATOM 0 HB3 HIS A 37 2.485 15.455 6.805 1.00 10.00 H new ATOM 0 HD2 HIS A 37 0.616 17.451 6.223 1.00 10.00 H new ATOM 0 HE1 HIS A 37 -1.846 16.647 9.571 1.00 10.00 H new ATOM 0 HE2 HIS A 37 -1.397 18.303 7.672 1.00 10.00 H new ATOM 357 N THR A 38 1.616 11.410 6.417 1.00 10.00 N ATOM 358 CA THR A 38 2.416 10.199 6.508 1.00 10.00 C ATOM 359 C THR A 38 2.581 9.552 5.133 1.00 10.00 C ATOM 360 O THR A 38 1.594 9.287 4.446 1.00 10.00 O ATOM 361 CB THR A 38 1.778 9.194 7.487 1.00 10.00 C ATOM 362 OG1 THR A 38 1.474 9.859 8.721 1.00 10.00 O ATOM 363 CG2 THR A 38 2.706 8.018 7.756 1.00 10.00 C ATOM 0 H THR A 38 0.608 11.253 6.433 1.00 10.00 H new ATOM 0 HA THR A 38 3.400 10.478 6.884 1.00 10.00 H new ATOM 0 HB THR A 38 0.864 8.808 7.035 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.373 9.195 9.434 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.227 7.328 8.450 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.920 7.502 6.820 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.637 8.381 8.191 1.00 10.00 H new ATOM 371 N PRO A 39 3.838 9.324 4.703 1.00 10.00 N ATOM 372 CA PRO A 39 4.138 8.703 3.404 1.00 10.00 C ATOM 373 C PRO A 39 3.438 7.360 3.216 1.00 10.00 C ATOM 374 O PRO A 39 3.427 6.520 4.122 1.00 10.00 O ATOM 375 CB PRO A 39 5.657 8.511 3.441 1.00 10.00 C ATOM 376 CG PRO A 39 6.148 9.519 4.416 1.00 10.00 C ATOM 377 CD PRO A 39 5.065 9.665 5.446 1.00 10.00 C ATOM 0 HA PRO A 39 3.790 9.319 2.575 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.920 7.500 3.752 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.099 8.666 2.457 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.081 9.194 4.876 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.349 10.471 3.924 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.222 8.995 6.292 1.00 10.00 H new ATOM 0 HD3 PRO A 39 5.024 10.678 5.845 1.00 10.00 H new ATOM 385 N LEU A 40 2.871 7.152 2.029 1.00 10.00 N ATOM 386 CA LEU A 40 2.165 5.912 1.725 1.00 10.00 C ATOM 387 C LEU A 40 3.133 4.737 1.633 1.00 10.00 C ATOM 388 O LEU A 40 2.715 3.579 1.619 1.00 10.00 O ATOM 389 CB LEU A 40 1.376 6.050 0.422 1.00 10.00 C ATOM 390 CG LEU A 40 0.166 6.985 0.491 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.479 7.123 -0.876 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.852 6.478 1.502 1.00 10.00 C ATOM 0 H LEU A 40 2.887 7.826 1.264 1.00 10.00 H new ATOM 0 HA LEU A 40 1.468 5.716 2.539 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.049 6.410 -0.356 1.00 10.00 H new ATOM 0 HB3 LEU A 40 1.034 5.061 0.116 1.00 10.00 H new ATOM 0 HG LEU A 40 0.515 7.966 0.814 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.337 7.791 -0.808 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.245 7.533 -1.580 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.808 6.144 -1.223 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.703 7.158 1.534 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.192 5.485 1.209 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.391 6.427 2.488 1.00 10.00 H new ATOM 404 N SER A 41 4.422 5.042 1.574 1.00 10.00 N ATOM 405 CA SER A 41 5.454 4.023 1.504 1.00 10.00 C ATOM 406 C SER A 41 5.402 3.134 2.743 1.00 10.00 C ATOM 407 O SER A 41 5.408 1.907 2.645 1.00 10.00 O ATOM 408 CB SER A 41 6.817 4.698 1.391 1.00 10.00 C ATOM 409 OG SER A 41 6.684 6.104 1.538 1.00 10.00 O ATOM 0 H SER A 41 4.778 5.998 1.573 1.00 10.00 H new ATOM 0 HA SER A 41 5.288 3.397 0.627 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.488 4.307 2.156 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.266 4.467 0.425 1.00 10.00 H new ATOM 0 HG SER A 41 6.682 6.527 0.654 1.00 10.00 H new ATOM 415 N LYS A 42 5.312 3.768 3.909 1.00 10.00 N ATOM 416 CA LYS A 42 5.249 3.042 5.172 1.00 10.00 C ATOM 417 C LYS A 42 3.937 2.271 5.278 1.00 10.00 C ATOM 418 O LYS A 42 3.880 1.204 5.890 1.00 10.00 O ATOM 419 CB LYS A 42 5.401 4.007 6.351 1.00 10.00 C ATOM 420 CG LYS A 42 6.792 4.608 6.461 1.00 10.00 C ATOM 421 CD LYS A 42 6.997 5.317 7.792 1.00 10.00 C ATOM 422 CE LYS A 42 8.477 5.535 8.074 1.00 10.00 C ATOM 423 NZ LYS A 42 8.730 5.977 9.473 1.00 10.00 N ATOM 0 H LYS A 42 5.281 4.783 4.004 1.00 10.00 H new ATOM 0 HA LYS A 42 6.072 2.328 5.203 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.672 4.811 6.249 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.167 3.480 7.276 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.538 3.821 6.350 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.949 5.314 5.645 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.481 6.277 7.780 1.00 10.00 H new ATOM 0 HD3 LYS A 42 6.554 4.727 8.594 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.020 4.609 7.885 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.869 6.282 7.384 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 9.561 5.478 9.850 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 8.906 7.002 9.487 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 7.900 5.761 10.061 1.00 10.00 H new ATOM 437 N LEU A 43 2.894 2.818 4.661 1.00 10.00 N ATOM 438 CA LEU A 43 1.580 2.191 4.660 1.00 10.00 C ATOM 439 C LEU A 43 1.635 0.871 3.899 1.00 10.00 C ATOM 440 O LEU A 43 1.173 -0.164 4.386 1.00 10.00 O ATOM 441 CB LEU A 43 0.548 3.138 4.025 1.00 10.00 C ATOM 442 CG LEU A 43 -0.870 2.580 3.875 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.895 3.642 4.234 1.00 10.00 C ATOM 444 CD2 LEU A 43 -1.105 2.081 2.456 1.00 10.00 C ATOM 0 H LEU A 43 2.936 3.701 4.152 1.00 10.00 H new ATOM 0 HA LEU A 43 1.278 1.987 5.687 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.498 4.046 4.626 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.909 3.429 3.039 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.981 1.738 4.559 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.899 3.231 4.123 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.745 3.959 5.266 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.778 4.499 3.571 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -2.118 1.689 2.371 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.975 2.905 1.754 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.390 1.291 2.225 1.00 10.00 H new ATOM 456 N MET A 44 2.225 0.911 2.710 1.00 10.00 N ATOM 457 CA MET A 44 2.353 -0.279 1.875 1.00 10.00 C ATOM 458 C MET A 44 3.238 -1.320 2.552 1.00 10.00 C ATOM 459 O MET A 44 2.931 -2.513 2.545 1.00 10.00 O ATOM 460 CB MET A 44 2.932 0.086 0.504 1.00 10.00 C ATOM 461 CG MET A 44 2.022 0.976 -0.327 1.00 10.00 C ATOM 462 SD MET A 44 2.671 1.290 -1.983 1.00 10.00 S ATOM 463 CE MET A 44 4.116 2.278 -1.609 1.00 10.00 C ATOM 0 H MET A 44 2.623 1.756 2.301 1.00 10.00 H new ATOM 0 HA MET A 44 1.358 -0.703 1.736 1.00 10.00 H new ATOM 0 HB2 MET A 44 3.888 0.590 0.646 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.134 -0.830 -0.051 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.041 0.509 -0.409 1.00 10.00 H new ATOM 0 HG3 MET A 44 1.881 1.926 0.189 1.00 10.00 H new ATOM 0 HE1 MET A 44 4.561 2.637 -2.537 1.00 10.00 H new ATOM 0 HE2 MET A 44 3.826 3.129 -0.992 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.843 1.670 -1.070 1.00 10.00 H new ATOM 473 N LYS A 45 4.329 -0.854 3.149 1.00 10.00 N ATOM 474 CA LYS A 45 5.268 -1.734 3.833 1.00 10.00 C ATOM 475 C LYS A 45 4.621 -2.406 5.041 1.00 10.00 C ATOM 476 O LYS A 45 4.916 -3.560 5.343 1.00 10.00 O ATOM 477 CB LYS A 45 6.508 -0.953 4.269 1.00 10.00 C ATOM 478 CG LYS A 45 7.399 -0.539 3.110 1.00 10.00 C ATOM 479 CD LYS A 45 8.720 -1.286 3.122 1.00 10.00 C ATOM 480 CE LYS A 45 9.690 -0.695 4.134 1.00 10.00 C ATOM 481 NZ LYS A 45 10.992 -1.414 4.145 1.00 10.00 N ATOM 0 H LYS A 45 4.585 0.133 3.173 1.00 10.00 H new ATOM 0 HA LYS A 45 5.565 -2.513 3.131 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.194 -0.062 4.813 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.087 -1.563 4.963 1.00 10.00 H new ATOM 0 HG2 LYS A 45 6.883 -0.728 2.169 1.00 10.00 H new ATOM 0 HG3 LYS A 45 7.587 0.533 3.161 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.543 -2.335 3.357 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.166 -1.253 2.128 1.00 10.00 H new ATOM 0 HE2 LYS A 45 9.859 0.357 3.903 1.00 10.00 H new ATOM 0 HE3 LYS A 45 9.245 -0.735 5.128 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.623 -0.979 4.848 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.835 -2.412 4.391 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.430 -1.354 3.203 1.00 10.00 H new ATOM 495 N ALA A 46 3.729 -1.689 5.717 1.00 10.00 N ATOM 496 CA ALA A 46 3.048 -2.229 6.890 1.00 10.00 C ATOM 497 C ALA A 46 2.197 -3.437 6.515 1.00 10.00 C ATOM 498 O ALA A 46 2.236 -4.471 7.184 1.00 10.00 O ATOM 499 CB ALA A 46 2.190 -1.161 7.550 1.00 10.00 C ATOM 0 H ALA A 46 3.461 -0.735 5.474 1.00 10.00 H new ATOM 0 HA ALA A 46 3.807 -2.553 7.602 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.691 -1.583 8.422 1.00 10.00 H new ATOM 0 HB2 ALA A 46 2.821 -0.328 7.861 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.443 -0.805 6.841 1.00 10.00 H new ATOM 505 N TYR A 47 1.433 -3.303 5.437 1.00 10.00 N ATOM 506 CA TYR A 47 0.587 -4.391 4.968 1.00 10.00 C ATOM 507 C TYR A 47 1.459 -5.539 4.467 1.00 10.00 C ATOM 508 O TYR A 47 1.155 -6.711 4.685 1.00 10.00 O ATOM 509 CB TYR A 47 -0.346 -3.906 3.853 1.00 10.00 C ATOM 510 CG TYR A 47 -1.387 -4.924 3.435 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.292 -5.589 2.220 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.464 -5.218 4.261 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.239 -6.520 1.839 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.416 -6.149 3.887 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.300 -6.796 2.674 1.00 10.00 C ATOM 516 OH TYR A 47 -4.238 -7.729 2.298 1.00 10.00 O ATOM 0 H TYR A 47 1.383 -2.454 4.874 1.00 10.00 H new ATOM 0 HA TYR A 47 -0.027 -4.743 5.797 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.852 -2.999 4.185 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.253 -3.636 2.983 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.463 -5.375 1.561 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.560 -4.712 5.210 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.148 -7.029 0.891 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.246 -6.369 4.542 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.920 -7.807 2.997 1.00 10.00 H new ATOM 526 N CYS A 48 2.560 -5.180 3.817 1.00 10.00 N ATOM 527 CA CYS A 48 3.497 -6.153 3.277 1.00 10.00 C ATOM 528 C CYS A 48 4.133 -6.983 4.394 1.00 10.00 C ATOM 529 O CYS A 48 4.204 -8.212 4.306 1.00 10.00 O ATOM 530 CB CYS A 48 4.584 -5.431 2.478 1.00 10.00 C ATOM 531 SG CYS A 48 5.546 -6.513 1.405 1.00 10.00 S ATOM 0 H CYS A 48 2.826 -4.209 3.651 1.00 10.00 H new ATOM 0 HA CYS A 48 2.951 -6.831 2.621 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.119 -4.654 1.871 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.259 -4.931 3.172 1.00 10.00 H new ATOM 0 HG CYS A 48 6.213 -7.361 2.130 1.00 10.00 H new ATOM 537 N GLU A 49 4.587 -6.299 5.441 1.00 10.00 N ATOM 538 CA GLU A 49 5.211 -6.956 6.584 1.00 10.00 C ATOM 539 C GLU A 49 4.252 -7.940 7.239 1.00 10.00 C ATOM 540 O GLU A 49 4.650 -9.034 7.642 1.00 10.00 O ATOM 541 CB GLU A 49 5.671 -5.918 7.612 1.00 10.00 C ATOM 542 CG GLU A 49 7.005 -5.276 7.276 1.00 10.00 C ATOM 543 CD GLU A 49 8.123 -6.291 7.162 1.00 10.00 C ATOM 544 OE1 GLU A 49 8.384 -7.010 8.147 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.745 -6.380 6.088 1.00 10.00 O ATOM 0 H GLU A 49 4.533 -5.284 5.520 1.00 10.00 H new ATOM 0 HA GLU A 49 6.078 -7.507 6.220 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.913 -5.139 7.693 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.743 -6.395 8.589 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.916 -4.731 6.336 1.00 10.00 H new ATOM 0 HG3 GLU A 49 7.258 -4.546 8.045 1.00 10.00 H new ATOM 552 N ARG A 50 2.986 -7.549 7.336 1.00 10.00 N ATOM 553 CA ARG A 50 1.969 -8.398 7.938 1.00 10.00 C ATOM 554 C ARG A 50 1.799 -9.689 7.147 1.00 10.00 C ATOM 555 O ARG A 50 1.777 -10.780 7.719 1.00 10.00 O ATOM 556 CB ARG A 50 0.636 -7.658 8.023 1.00 10.00 C ATOM 557 CG ARG A 50 -0.545 -8.576 8.290 1.00 10.00 C ATOM 558 CD ARG A 50 -1.837 -7.797 8.402 1.00 10.00 C ATOM 559 NE ARG A 50 -1.888 -6.998 9.622 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.885 -6.178 9.919 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.909 -6.060 9.090 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.872 -5.488 11.049 1.00 10.00 N ATOM 0 H ARG A 50 2.641 -6.648 7.005 1.00 10.00 H new ATOM 0 HA ARG A 50 2.297 -8.652 8.946 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.693 -6.911 8.815 1.00 10.00 H new ATOM 0 HB3 ARG A 50 0.466 -7.121 7.090 1.00 10.00 H new ATOM 0 HG2 ARG A 50 -0.628 -9.307 7.486 1.00 10.00 H new ATOM 0 HG3 ARG A 50 -0.374 -9.133 9.211 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -1.943 -7.144 7.536 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -2.680 -8.488 8.385 1.00 10.00 H new ATOM 0 HE ARG A 50 -1.114 -7.075 10.282 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.929 -6.600 8.225 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.678 -5.429 9.316 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -2.091 -5.586 11.697 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.643 -4.858 11.271 1.00 10.00 H new ATOM 576 N GLN A 51 1.695 -9.561 5.829 1.00 10.00 N ATOM 577 CA GLN A 51 1.522 -10.721 4.964 1.00 10.00 C ATOM 578 C GLN A 51 2.793 -11.566 4.935 1.00 10.00 C ATOM 579 O GLN A 51 2.744 -12.771 4.691 1.00 10.00 O ATOM 580 CB GLN A 51 1.149 -10.288 3.540 1.00 10.00 C ATOM 581 CG GLN A 51 -0.134 -9.472 3.455 1.00 10.00 C ATOM 582 CD GLN A 51 -1.243 -10.010 4.339 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.427 -9.555 5.466 1.00 10.00 O ATOM 584 NE2 GLN A 51 -1.982 -10.987 3.843 1.00 10.00 N ATOM 0 H GLN A 51 1.727 -8.668 5.338 1.00 10.00 H new ATOM 0 HA GLN A 51 0.709 -11.323 5.370 1.00 10.00 H new ATOM 0 HB2 GLN A 51 1.968 -9.702 3.124 1.00 10.00 H new ATOM 0 HB3 GLN A 51 1.044 -11.176 2.917 1.00 10.00 H new ATOM 0 HG2 GLN A 51 0.079 -8.441 3.737 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.478 -9.455 2.421 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -1.799 -11.338 2.903 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -2.736 -11.390 4.400 1.00 10.00 H new ATOM 593 N GLY A 52 3.925 -10.924 5.187 1.00 10.00 N ATOM 594 CA GLY A 52 5.193 -11.621 5.189 1.00 10.00 C ATOM 595 C GLY A 52 5.759 -11.768 3.797 1.00 10.00 C ATOM 596 O GLY A 52 6.526 -12.692 3.518 1.00 10.00 O ATOM 0 H GLY A 52 3.986 -9.927 5.391 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.903 -11.080 5.814 1.00 10.00 H new ATOM 0 HA3 GLY A 52 5.064 -12.608 5.634 1.00 10.00 H new ATOM 600 N LEU A 53 5.383 -10.848 2.923 1.00 10.00 N ATOM 601 CA LEU A 53 5.845 -10.869 1.546 1.00 10.00 C ATOM 602 C LEU A 53 6.867 -9.765 1.313 1.00 10.00 C ATOM 603 O LEU A 53 7.306 -9.104 2.255 1.00 10.00 O ATOM 604 CB LEU A 53 4.663 -10.695 0.587 1.00 10.00 C ATOM 605 CG LEU A 53 3.560 -11.748 0.716 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.374 -11.388 -0.165 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.090 -13.129 0.358 1.00 10.00 C ATOM 0 H LEU A 53 4.756 -10.074 3.145 1.00 10.00 H new ATOM 0 HA LEU A 53 6.317 -11.833 1.355 1.00 10.00 H new ATOM 0 HB2 LEU A 53 4.225 -9.711 0.751 1.00 10.00 H new ATOM 0 HB3 LEU A 53 5.040 -10.710 -0.436 1.00 10.00 H new ATOM 0 HG LEU A 53 3.226 -11.768 1.753 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.599 -12.148 -0.061 1.00 10.00 H new ATOM 0 HD12 LEU A 53 1.976 -10.420 0.139 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.695 -11.338 -1.205 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.290 -13.863 0.456 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.453 -13.124 -0.670 1.00 10.00 H new ATOM 0 HD23 LEU A 53 4.907 -13.391 1.031 1.00 10.00 H new ATOM 619 N SER A 54 7.248 -9.577 0.062 1.00 10.00 N ATOM 620 CA SER A 54 8.198 -8.542 -0.305 1.00 10.00 C ATOM 621 C SER A 54 7.462 -7.427 -1.039 1.00 10.00 C ATOM 622 O SER A 54 6.536 -7.696 -1.811 1.00 10.00 O ATOM 623 CB SER A 54 9.308 -9.132 -1.184 1.00 10.00 C ATOM 624 OG SER A 54 10.290 -8.161 -1.502 1.00 10.00 O ATOM 0 H SER A 54 6.910 -10.133 -0.723 1.00 10.00 H new ATOM 0 HA SER A 54 8.661 -8.132 0.593 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.777 -9.969 -0.667 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.875 -9.527 -2.103 1.00 10.00 H new ATOM 0 HG SER A 54 10.984 -8.569 -2.061 1.00 10.00 H new ATOM 630 N MET A 55 7.862 -6.178 -0.799 1.00 10.00 N ATOM 631 CA MET A 55 7.219 -5.033 -1.445 1.00 10.00 C ATOM 632 C MET A 55 7.453 -5.064 -2.948 1.00 10.00 C ATOM 633 O MET A 55 6.776 -4.382 -3.713 1.00 10.00 O ATOM 634 CB MET A 55 7.731 -3.713 -0.861 1.00 10.00 C ATOM 635 CG MET A 55 6.620 -2.720 -0.556 1.00 10.00 C ATOM 636 SD MET A 55 7.180 -1.006 -0.605 1.00 10.00 S ATOM 637 CE MET A 55 7.160 -0.696 -2.371 1.00 10.00 C ATOM 0 H MET A 55 8.624 -5.934 -0.166 1.00 10.00 H new ATOM 0 HA MET A 55 6.148 -5.101 -1.254 1.00 10.00 H new ATOM 0 HB2 MET A 55 8.286 -3.919 0.054 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.431 -3.260 -1.563 1.00 10.00 H new ATOM 0 HG2 MET A 55 5.812 -2.854 -1.275 1.00 10.00 H new ATOM 0 HG3 MET A 55 6.208 -2.935 0.430 1.00 10.00 H new ATOM 0 HE1 MET A 55 7.483 0.327 -2.565 1.00 10.00 H new ATOM 0 HE2 MET A 55 7.836 -1.390 -2.870 1.00 10.00 H new ATOM 0 HE3 MET A 55 6.149 -0.836 -2.754 1.00 10.00 H new ATOM 647 N ARG A 56 8.410 -5.875 -3.363 1.00 10.00 N ATOM 648 CA ARG A 56 8.732 -6.017 -4.770 1.00 10.00 C ATOM 649 C ARG A 56 7.830 -7.065 -5.421 1.00 10.00 C ATOM 650 O ARG A 56 7.793 -7.192 -6.643 1.00 10.00 O ATOM 651 CB ARG A 56 10.202 -6.405 -4.928 1.00 10.00 C ATOM 652 CG ARG A 56 10.746 -6.184 -6.326 1.00 10.00 C ATOM 653 CD ARG A 56 12.232 -6.489 -6.395 1.00 10.00 C ATOM 654 NE ARG A 56 12.814 -6.039 -7.655 1.00 10.00 N ATOM 655 CZ ARG A 56 13.866 -5.228 -7.743 1.00 10.00 C ATOM 656 NH1 ARG A 56 14.459 -4.778 -6.641 1.00 10.00 N ATOM 657 NH2 ARG A 56 14.323 -4.861 -8.934 1.00 10.00 N ATOM 0 H ARG A 56 8.980 -6.448 -2.741 1.00 10.00 H new ATOM 0 HA ARG A 56 8.563 -5.063 -5.270 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.798 -5.829 -4.221 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.321 -7.456 -4.664 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.209 -6.818 -7.032 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.570 -5.151 -6.628 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.743 -6.003 -5.564 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.390 -7.562 -6.283 1.00 10.00 H new ATOM 0 HE ARG A 56 12.388 -6.366 -8.522 1.00 10.00 H new ATOM 0 HH11 ARG A 56 14.108 -5.054 -5.724 1.00 10.00 H new ATOM 0 HH12 ARG A 56 15.265 -4.157 -6.713 1.00 10.00 H new ATOM 0 HH21 ARG A 56 13.868 -5.200 -9.782 1.00 10.00 H new ATOM 0 HH22 ARG A 56 15.129 -4.240 -9.002 1.00 10.00 H new ATOM 671 N GLN A 57 7.076 -7.787 -4.606 1.00 10.00 N ATOM 672 CA GLN A 57 6.189 -8.829 -5.105 1.00 10.00 C ATOM 673 C GLN A 57 4.760 -8.315 -5.278 1.00 10.00 C ATOM 674 O GLN A 57 4.074 -8.674 -6.235 1.00 10.00 O ATOM 675 CB GLN A 57 6.198 -10.023 -4.150 1.00 10.00 C ATOM 676 CG GLN A 57 5.318 -11.177 -4.602 1.00 10.00 C ATOM 677 CD GLN A 57 5.204 -12.261 -3.552 1.00 10.00 C ATOM 678 OE1 GLN A 57 6.125 -12.479 -2.765 1.00 10.00 O ATOM 679 NE2 GLN A 57 4.069 -12.940 -3.529 1.00 10.00 N ATOM 0 H GLN A 57 7.060 -7.670 -3.593 1.00 10.00 H new ATOM 0 HA GLN A 57 6.556 -9.139 -6.083 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.222 -10.381 -4.040 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.869 -9.691 -3.165 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.323 -10.800 -4.841 1.00 10.00 H new ATOM 0 HG3 GLN A 57 5.726 -11.604 -5.518 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.332 -12.725 -4.201 1.00 10.00 H new ATOM 0 HE22 GLN A 57 3.930 -13.679 -2.839 1.00 10.00 H new ATOM 688 N ILE A 58 4.311 -7.478 -4.358 1.00 10.00 N ATOM 689 CA ILE A 58 2.957 -6.946 -4.425 1.00 10.00 C ATOM 690 C ILE A 58 2.929 -5.557 -5.058 1.00 10.00 C ATOM 691 O ILE A 58 3.940 -4.858 -5.094 1.00 10.00 O ATOM 692 CB ILE A 58 2.286 -6.893 -3.036 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.248 -6.330 -1.985 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.796 -8.278 -2.633 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.642 -6.229 -0.599 1.00 10.00 C ATOM 0 H ILE A 58 4.858 -7.153 -3.561 1.00 10.00 H new ATOM 0 HA ILE A 58 2.392 -7.633 -5.055 1.00 10.00 H new ATOM 0 HB ILE A 58 1.427 -6.225 -3.095 1.00 10.00 H new ATOM 0 HG12 ILE A 58 4.134 -6.963 -1.940 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.579 -5.341 -2.301 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.325 -8.226 -1.651 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.071 -8.635 -3.365 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.641 -8.966 -2.594 1.00 10.00 H new ATOM 0 HD11 ILE A 58 3.380 -5.823 0.092 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.773 -5.572 -0.629 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.337 -7.220 -0.262 1.00 10.00 H new ATOM 707 N ARG A 59 1.770 -5.180 -5.576 1.00 10.00 N ATOM 708 CA ARG A 59 1.587 -3.883 -6.212 1.00 10.00 C ATOM 709 C ARG A 59 0.372 -3.184 -5.615 1.00 10.00 C ATOM 710 O ARG A 59 -0.637 -3.826 -5.325 1.00 10.00 O ATOM 711 CB ARG A 59 1.401 -4.043 -7.726 1.00 10.00 C ATOM 712 CG ARG A 59 2.596 -4.658 -8.441 1.00 10.00 C ATOM 713 CD ARG A 59 3.815 -3.747 -8.378 1.00 10.00 C ATOM 714 NE ARG A 59 4.982 -4.346 -9.024 1.00 10.00 N ATOM 715 CZ ARG A 59 5.874 -5.105 -8.394 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.744 -5.354 -7.098 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.903 -5.612 -9.058 1.00 10.00 N ATOM 0 H ARG A 59 0.932 -5.762 -5.568 1.00 10.00 H new ATOM 0 HA ARG A 59 2.478 -3.281 -6.034 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.524 -4.663 -7.909 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.196 -3.065 -8.161 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.836 -5.620 -7.989 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.338 -4.851 -9.482 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.582 -2.797 -8.859 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.050 -3.528 -7.336 1.00 10.00 H new ATOM 0 HE ARG A 59 5.120 -4.171 -10.019 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.957 -4.963 -6.580 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.431 -5.937 -6.619 1.00 10.00 H new ATOM 0 HH21 ARG A 59 7.012 -5.420 -10.054 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.586 -6.194 -8.573 1.00 10.00 H new ATOM 731 N PHE A 60 0.469 -1.877 -5.436 1.00 10.00 N ATOM 732 CA PHE A 60 -0.623 -1.098 -4.868 1.00 10.00 C ATOM 733 C PHE A 60 -1.099 -0.046 -5.860 1.00 10.00 C ATOM 734 O PHE A 60 -0.291 0.615 -6.519 1.00 10.00 O ATOM 735 CB PHE A 60 -0.185 -0.419 -3.568 1.00 10.00 C ATOM 736 CG PHE A 60 0.017 -1.371 -2.423 1.00 10.00 C ATOM 737 CD1 PHE A 60 1.218 -2.047 -2.266 1.00 10.00 C ATOM 738 CD2 PHE A 60 -0.993 -1.586 -1.497 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.408 -2.912 -1.208 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.809 -2.452 -0.439 1.00 10.00 C ATOM 741 CZ PHE A 60 0.393 -3.117 -0.294 1.00 10.00 C ATOM 0 H PHE A 60 1.296 -1.330 -5.676 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.445 -1.780 -4.649 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.745 0.121 -3.747 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -0.934 0.320 -3.285 1.00 10.00 H new ATOM 0 HD1 PHE A 60 2.014 -1.894 -2.980 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.935 -1.069 -1.606 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.350 -3.428 -1.095 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.604 -2.610 0.275 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.539 -3.796 0.533 1.00 10.00 H new ATOM 751 N ARG A 61 -2.409 0.102 -5.971 1.00 10.00 N ATOM 752 CA ARG A 61 -2.992 1.078 -6.881 1.00 10.00 C ATOM 753 C ARG A 61 -4.039 1.917 -6.166 1.00 10.00 C ATOM 754 O ARG A 61 -4.645 1.477 -5.192 1.00 10.00 O ATOM 755 CB ARG A 61 -3.618 0.388 -8.097 1.00 10.00 C ATOM 756 CG ARG A 61 -2.614 0.001 -9.171 1.00 10.00 C ATOM 757 CD ARG A 61 -3.304 -0.423 -10.455 1.00 10.00 C ATOM 758 NE ARG A 61 -2.353 -0.601 -11.553 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.696 -0.618 -12.843 1.00 10.00 C ATOM 760 NH1 ARG A 61 -3.969 -0.514 -13.197 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.764 -0.751 -13.779 1.00 10.00 N ATOM 0 H ARG A 61 -3.091 -0.442 -5.442 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.191 1.731 -7.227 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.142 -0.508 -7.764 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.365 1.051 -8.534 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.954 0.844 -9.374 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -1.988 -0.814 -8.808 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -3.843 -1.356 -10.287 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -4.044 0.327 -10.734 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.367 -0.719 -11.318 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.691 -0.421 -12.483 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -4.227 -0.527 -14.184 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.783 -0.841 -13.513 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -2.029 -0.764 -14.764 1.00 10.00 H new ATOM 775 N PHE A 62 -4.233 3.129 -6.650 1.00 10.00 N ATOM 776 CA PHE A 62 -5.207 4.039 -6.084 1.00 10.00 C ATOM 777 C PHE A 62 -6.109 4.565 -7.191 1.00 10.00 C ATOM 778 O PHE A 62 -5.814 5.589 -7.814 1.00 10.00 O ATOM 779 CB PHE A 62 -4.515 5.204 -5.363 1.00 10.00 C ATOM 780 CG PHE A 62 -5.474 6.203 -4.775 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.262 5.869 -3.686 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.593 7.473 -5.319 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.149 6.782 -3.152 1.00 10.00 C ATOM 784 CE2 PHE A 62 -6.478 8.390 -4.788 1.00 10.00 C ATOM 785 CZ PHE A 62 -7.259 8.043 -3.704 1.00 10.00 C ATOM 0 H PHE A 62 -3.720 3.509 -7.446 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.807 3.500 -5.351 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -3.885 4.805 -4.567 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.856 5.715 -6.065 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.182 4.884 -3.250 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.986 7.748 -6.169 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -7.757 6.510 -2.302 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -6.559 9.377 -5.220 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.955 8.757 -3.288 1.00 10.00 H new ATOM 795 N ASP A 63 -7.182 3.827 -7.457 1.00 10.00 N ATOM 796 CA ASP A 63 -8.156 4.192 -8.483 1.00 10.00 C ATOM 797 C ASP A 63 -7.495 4.339 -9.859 1.00 10.00 C ATOM 798 O ASP A 63 -7.262 5.451 -10.341 1.00 10.00 O ATOM 799 CB ASP A 63 -8.899 5.482 -8.100 1.00 10.00 C ATOM 800 CG ASP A 63 -9.925 5.894 -9.139 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.655 5.014 -9.649 1.00 10.00 O ATOM 802 OD2 ASP A 63 -10.009 7.100 -9.455 1.00 10.00 O ATOM 0 H ASP A 63 -7.402 2.959 -6.968 1.00 10.00 H new ATOM 0 HA ASP A 63 -8.882 3.382 -8.547 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -9.396 5.340 -7.140 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -8.177 6.288 -7.968 1.00 10.00 H new ATOM 807 N GLY A 64 -7.157 3.206 -10.463 1.00 10.00 N ATOM 808 CA GLY A 64 -6.548 3.211 -11.784 1.00 10.00 C ATOM 809 C GLY A 64 -5.043 3.427 -11.772 1.00 10.00 C ATOM 810 O GLY A 64 -4.290 2.630 -12.333 1.00 10.00 O ATOM 0 H GLY A 64 -7.294 2.279 -10.061 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.764 2.263 -12.276 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.012 3.994 -12.383 1.00 10.00 H new ATOM 814 N GLN A 65 -4.602 4.500 -11.135 1.00 10.00 N ATOM 815 CA GLN A 65 -3.182 4.831 -11.087 1.00 10.00 C ATOM 816 C GLN A 65 -2.472 4.134 -9.928 1.00 10.00 C ATOM 817 O GLN A 65 -3.052 3.953 -8.861 1.00 10.00 O ATOM 818 CB GLN A 65 -3.007 6.347 -10.971 1.00 10.00 C ATOM 819 CG GLN A 65 -3.387 7.090 -12.238 1.00 10.00 C ATOM 820 CD GLN A 65 -2.528 6.686 -13.417 1.00 10.00 C ATOM 821 OE1 GLN A 65 -2.851 5.749 -14.147 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.426 7.388 -13.607 1.00 10.00 N ATOM 0 H GLN A 65 -5.206 5.159 -10.643 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.727 4.476 -12.012 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.616 6.715 -10.145 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.969 6.569 -10.725 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.434 6.897 -12.470 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.290 8.163 -12.071 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -1.196 8.157 -12.978 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -0.804 7.161 -14.383 1.00 10.00 H new ATOM 831 N PRO A 66 -1.206 3.713 -10.130 1.00 10.00 N ATOM 832 CA PRO A 66 -0.415 3.050 -9.091 1.00 10.00 C ATOM 833 C PRO A 66 0.093 4.034 -8.039 1.00 10.00 C ATOM 834 O PRO A 66 0.213 5.232 -8.304 1.00 10.00 O ATOM 835 CB PRO A 66 0.768 2.429 -9.861 1.00 10.00 C ATOM 836 CG PRO A 66 0.469 2.636 -11.309 1.00 10.00 C ATOM 837 CD PRO A 66 -0.449 3.821 -11.384 1.00 10.00 C ATOM 0 HA PRO A 66 -1.006 2.317 -8.542 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.708 2.907 -9.584 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.870 1.368 -9.631 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.384 2.817 -11.873 1.00 10.00 H new ATOM 0 HG3 PRO A 66 -0.001 1.752 -11.739 1.00 10.00 H new ATOM 0 HD2 PRO A 66 0.103 4.759 -11.446 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -1.100 3.776 -12.257 1.00 10.00 H new ATOM 845 N ILE A 67 0.380 3.524 -6.849 1.00 10.00 N ATOM 846 CA ILE A 67 0.872 4.357 -5.762 1.00 10.00 C ATOM 847 C ILE A 67 2.397 4.372 -5.747 1.00 10.00 C ATOM 848 O ILE A 67 3.038 3.324 -5.864 1.00 10.00 O ATOM 849 CB ILE A 67 0.351 3.862 -4.393 1.00 10.00 C ATOM 850 CG1 ILE A 67 -1.180 3.912 -4.358 1.00 10.00 C ATOM 851 CG2 ILE A 67 0.935 4.694 -3.259 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.778 3.360 -3.081 1.00 10.00 C ATOM 0 H ILE A 67 0.280 2.537 -6.613 1.00 10.00 H new ATOM 0 HA ILE A 67 0.500 5.367 -5.932 1.00 10.00 H new ATOM 0 HB ILE A 67 0.671 2.829 -4.257 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.504 4.945 -4.483 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.573 3.350 -5.205 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.554 4.328 -2.306 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.022 4.613 -3.271 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.647 5.737 -3.388 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.865 3.428 -3.129 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.485 2.317 -2.963 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.415 3.937 -2.230 1.00 10.00 H new ATOM 864 N ASN A 68 2.970 5.558 -5.613 1.00 10.00 N ATOM 865 CA ASN A 68 4.416 5.712 -5.577 1.00 10.00 C ATOM 866 C ASN A 68 4.896 5.796 -4.132 1.00 10.00 C ATOM 867 O ASN A 68 4.139 6.180 -3.239 1.00 10.00 O ATOM 868 CB ASN A 68 4.848 6.974 -6.338 1.00 10.00 C ATOM 869 CG ASN A 68 4.331 7.021 -7.767 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.017 6.613 -8.707 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.118 7.525 -7.940 1.00 10.00 N ATOM 0 H ASN A 68 2.452 6.433 -5.527 1.00 10.00 H new ATOM 0 HA ASN A 68 4.865 4.843 -6.059 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.492 7.853 -5.801 1.00 10.00 H new ATOM 0 HB3 ASN A 68 5.937 7.027 -6.351 1.00 10.00 H new ATOM 0 HD21 ASN A 68 2.720 7.586 -8.877 1.00 10.00 H new ATOM 0 HD22 ASN A 68 2.582 7.852 -7.136 1.00 10.00 H new ATOM 878 N GLU A 69 6.157 5.451 -3.905 1.00 10.00 N ATOM 879 CA GLU A 69 6.735 5.488 -2.563 1.00 10.00 C ATOM 880 C GLU A 69 6.867 6.921 -2.059 1.00 10.00 C ATOM 881 O GLU A 69 6.993 7.160 -0.861 1.00 10.00 O ATOM 882 CB GLU A 69 8.107 4.816 -2.547 1.00 10.00 C ATOM 883 CG GLU A 69 8.049 3.300 -2.628 1.00 10.00 C ATOM 884 CD GLU A 69 9.241 2.646 -1.961 1.00 10.00 C ATOM 885 OE1 GLU A 69 9.194 2.427 -0.735 1.00 10.00 O ATOM 886 OE2 GLU A 69 10.232 2.349 -2.658 1.00 10.00 O ATOM 0 H GLU A 69 6.802 5.142 -4.632 1.00 10.00 H new ATOM 0 HA GLU A 69 6.060 4.944 -1.902 1.00 10.00 H new ATOM 0 HB2 GLU A 69 8.695 5.193 -3.384 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.631 5.102 -1.635 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.132 2.947 -2.156 1.00 10.00 H new ATOM 0 HG3 GLU A 69 8.007 2.995 -3.674 1.00 10.00 H new ATOM 893 N THR A 70 6.833 7.871 -2.975 1.00 10.00 N ATOM 894 CA THR A 70 6.960 9.272 -2.620 1.00 10.00 C ATOM 895 C THR A 70 5.594 9.948 -2.517 1.00 10.00 C ATOM 896 O THR A 70 5.503 11.174 -2.413 1.00 10.00 O ATOM 897 CB THR A 70 7.821 10.007 -3.658 1.00 10.00 C ATOM 898 OG1 THR A 70 7.646 9.401 -4.949 1.00 10.00 O ATOM 899 CG2 THR A 70 9.288 9.962 -3.265 1.00 10.00 C ATOM 0 H THR A 70 6.718 7.697 -3.973 1.00 10.00 H new ATOM 0 HA THR A 70 7.442 9.323 -1.644 1.00 10.00 H new ATOM 0 HB THR A 70 7.504 11.049 -3.698 1.00 10.00 H new ATOM 0 HG1 THR A 70 8.195 9.873 -5.609 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.881 10.488 -4.013 1.00 10.00 H new ATOM 0 HG22 THR A 70 9.420 10.441 -2.295 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.617 8.925 -3.205 1.00 10.00 H new ATOM 907 N ASP A 71 4.536 9.147 -2.532 1.00 10.00 N ATOM 908 CA ASP A 71 3.182 9.678 -2.458 1.00 10.00 C ATOM 909 C ASP A 71 2.684 9.745 -1.020 1.00 10.00 C ATOM 910 O ASP A 71 3.185 9.049 -0.132 1.00 10.00 O ATOM 911 CB ASP A 71 2.215 8.842 -3.301 1.00 10.00 C ATOM 912 CG ASP A 71 2.214 9.246 -4.761 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.334 10.456 -5.052 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.099 8.352 -5.626 1.00 10.00 O ATOM 0 H ASP A 71 4.590 8.130 -2.595 1.00 10.00 H new ATOM 0 HA ASP A 71 3.216 10.691 -2.859 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.485 7.789 -3.220 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.207 8.944 -2.899 1.00 10.00 H new ATOM 919 N THR A 72 1.698 10.600 -0.811 1.00 10.00 N ATOM 920 CA THR A 72 1.093 10.800 0.493 1.00 10.00 C ATOM 921 C THR A 72 -0.418 10.951 0.326 1.00 10.00 C ATOM 922 O THR A 72 -0.886 11.250 -0.776 1.00 10.00 O ATOM 923 CB THR A 72 1.660 12.064 1.174 1.00 10.00 C ATOM 924 OG1 THR A 72 2.175 12.960 0.181 1.00 10.00 O ATOM 925 CG2 THR A 72 2.762 11.711 2.160 1.00 10.00 C ATOM 0 H THR A 72 1.292 11.179 -1.547 1.00 10.00 H new ATOM 0 HA THR A 72 1.320 9.937 1.120 1.00 10.00 H new ATOM 0 HB THR A 72 0.850 12.545 1.722 1.00 10.00 H new ATOM 0 HG1 THR A 72 2.532 13.761 0.617 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.141 12.622 2.623 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.363 11.051 2.930 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.573 11.207 1.634 1.00 10.00 H new ATOM 933 N PRO A 73 -1.206 10.735 1.395 1.00 10.00 N ATOM 934 CA PRO A 73 -2.666 10.864 1.335 1.00 10.00 C ATOM 935 C PRO A 73 -3.091 12.239 0.828 1.00 10.00 C ATOM 936 O PRO A 73 -3.992 12.358 -0.002 1.00 10.00 O ATOM 937 CB PRO A 73 -3.108 10.663 2.789 1.00 10.00 C ATOM 938 CG PRO A 73 -2.007 9.889 3.419 1.00 10.00 C ATOM 939 CD PRO A 73 -0.746 10.336 2.738 1.00 10.00 C ATOM 0 HA PRO A 73 -3.115 10.149 0.646 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.258 11.618 3.292 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.053 10.122 2.844 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.960 10.079 4.491 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.161 8.817 3.292 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.277 11.167 3.265 1.00 10.00 H new ATOM 0 HD3 PRO A 73 -0.010 9.534 2.689 1.00 10.00 H new ATOM 947 N ALA A 74 -2.412 13.272 1.309 1.00 10.00 N ATOM 948 CA ALA A 74 -2.715 14.641 0.909 1.00 10.00 C ATOM 949 C ALA A 74 -2.260 14.915 -0.523 1.00 10.00 C ATOM 950 O ALA A 74 -2.793 15.796 -1.195 1.00 10.00 O ATOM 951 CB ALA A 74 -2.058 15.624 1.867 1.00 10.00 C ATOM 0 H ALA A 74 -1.646 13.188 1.978 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.796 14.772 0.948 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.291 16.643 1.559 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.434 15.455 2.876 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -0.978 15.479 1.853 1.00 10.00 H new ATOM 957 N GLN A 75 -1.284 14.145 -0.989 1.00 10.00 N ATOM 958 CA GLN A 75 -0.751 14.308 -2.338 1.00 10.00 C ATOM 959 C GLN A 75 -1.693 13.711 -3.375 1.00 10.00 C ATOM 960 O GLN A 75 -1.931 14.305 -4.425 1.00 10.00 O ATOM 961 CB GLN A 75 0.622 13.647 -2.446 1.00 10.00 C ATOM 962 CG GLN A 75 1.408 14.058 -3.680 1.00 10.00 C ATOM 963 CD GLN A 75 1.873 15.501 -3.625 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.082 16.058 -2.546 1.00 10.00 O ATOM 965 NE2 GLN A 75 2.042 16.116 -4.783 1.00 10.00 N ATOM 0 H GLN A 75 -0.844 13.399 -0.451 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.654 15.376 -2.535 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.204 13.893 -1.558 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.494 12.565 -2.453 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.274 13.405 -3.788 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.788 13.914 -4.565 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.858 15.620 -5.655 1.00 10.00 H new ATOM 0 HE22 GLN A 75 2.356 17.086 -4.804 1.00 10.00 H new ATOM 974 N LEU A 76 -2.234 12.539 -3.075 1.00 10.00 N ATOM 975 CA LEU A 76 -3.146 11.866 -3.992 1.00 10.00 C ATOM 976 C LEU A 76 -4.584 12.312 -3.754 1.00 10.00 C ATOM 977 O LEU A 76 -5.520 11.736 -4.311 1.00 10.00 O ATOM 978 CB LEU A 76 -3.040 10.347 -3.841 1.00 10.00 C ATOM 979 CG LEU A 76 -1.727 9.726 -4.321 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.755 8.218 -4.126 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.475 10.067 -5.779 1.00 10.00 C ATOM 0 H LEU A 76 -2.059 12.034 -2.206 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.860 12.140 -5.008 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.178 10.094 -2.790 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.861 9.887 -4.390 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.912 10.140 -3.727 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.815 7.789 -4.472 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.891 7.990 -3.069 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.580 7.792 -4.698 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.536 9.616 -6.101 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.291 9.681 -6.389 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.416 11.149 -5.895 1.00 10.00 H new ATOM 993 N GLU A 77 -4.744 13.342 -2.923 1.00 10.00 N ATOM 994 CA GLU A 77 -6.057 13.889 -2.595 1.00 10.00 C ATOM 995 C GLU A 77 -6.981 12.798 -2.070 1.00 10.00 C ATOM 996 O GLU A 77 -8.126 12.659 -2.505 1.00 10.00 O ATOM 997 CB GLU A 77 -6.666 14.579 -3.819 1.00 10.00 C ATOM 998 CG GLU A 77 -5.926 15.844 -4.219 1.00 10.00 C ATOM 999 CD GLU A 77 -6.233 17.011 -3.306 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -6.648 18.071 -3.821 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -6.079 16.870 -2.075 1.00 10.00 O ATOM 0 H GLU A 77 -3.969 13.818 -2.461 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.935 14.632 -1.807 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.665 13.884 -4.659 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.707 14.825 -3.610 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -4.853 15.652 -4.208 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -6.192 16.108 -5.242 1.00 10.00 H new ATOM 1008 N MET A 78 -6.463 12.024 -1.131 1.00 10.00 N ATOM 1009 CA MET A 78 -7.210 10.934 -0.532 1.00 10.00 C ATOM 1010 C MET A 78 -7.990 11.440 0.666 1.00 10.00 C ATOM 1011 O MET A 78 -7.584 12.404 1.320 1.00 10.00 O ATOM 1012 CB MET A 78 -6.259 9.815 -0.099 1.00 10.00 C ATOM 1013 CG MET A 78 -5.304 9.379 -1.197 1.00 10.00 C ATOM 1014 SD MET A 78 -4.000 8.288 -0.601 1.00 10.00 S ATOM 1015 CE MET A 78 -4.955 6.850 -0.137 1.00 10.00 C ATOM 0 H MET A 78 -5.517 12.134 -0.765 1.00 10.00 H new ATOM 0 HA MET A 78 -7.906 10.537 -1.271 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.682 10.151 0.762 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.845 8.955 0.226 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.867 8.870 -1.980 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.853 10.262 -1.651 1.00 10.00 H new ATOM 0 HE1 MET A 78 -4.977 6.763 0.949 1.00 10.00 H new ATOM 0 HE2 MET A 78 -5.973 6.952 -0.513 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.498 5.957 -0.564 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.107 10.796 0.948 1.00 10.00 N ATOM 1026 CA GLU A 79 -9.937 11.183 2.071 1.00 10.00 C ATOM 1027 C GLU A 79 -10.263 9.984 2.940 1.00 10.00 C ATOM 1028 O GLU A 79 -9.788 8.875 2.695 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.230 11.842 1.593 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.098 13.336 1.345 1.00 10.00 C ATOM 1031 CD GLU A 79 -10.640 14.103 2.575 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -10.282 15.290 2.438 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.633 13.526 3.685 1.00 10.00 O ATOM 0 H GLU A 79 -9.460 10.002 0.414 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.375 11.904 2.664 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.556 11.357 0.673 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.010 11.673 2.336 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.389 13.503 0.534 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.059 13.730 1.014 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.065 10.214 3.965 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.460 9.152 4.874 1.00 10.00 C ATOM 1042 C ASP A 80 -12.333 8.135 4.145 1.00 10.00 C ATOM 1043 O ASP A 80 -13.058 8.496 3.218 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.216 9.734 6.067 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.109 8.858 7.294 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -12.986 7.990 7.490 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.149 9.038 8.068 1.00 10.00 O ATOM 0 H ASP A 80 -11.456 11.129 4.189 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.564 8.650 5.238 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.824 10.725 6.295 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.266 9.860 5.803 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.234 6.866 4.546 1.00 10.00 N ATOM 1053 CA GLU A 81 -13.013 5.781 3.941 1.00 10.00 C ATOM 1054 C GLU A 81 -12.552 5.484 2.513 1.00 10.00 C ATOM 1055 O GLU A 81 -13.254 4.812 1.751 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.510 6.113 3.955 1.00 10.00 C ATOM 1057 CG GLU A 81 -15.166 5.942 5.314 1.00 10.00 C ATOM 1058 CD GLU A 81 -15.899 4.624 5.441 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -17.122 4.600 5.197 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -15.260 3.606 5.783 1.00 10.00 O ATOM 0 H GLU A 81 -11.614 6.561 5.296 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.845 4.887 4.541 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.647 7.142 3.623 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -15.020 5.475 3.233 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.405 6.008 6.092 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -15.865 6.761 5.482 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.364 5.968 2.158 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.819 5.747 0.822 1.00 10.00 C ATOM 1069 C ASP A 82 -10.425 4.286 0.643 1.00 10.00 C ATOM 1070 O ASP A 82 -10.222 3.569 1.622 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.612 6.647 0.568 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.706 7.341 -0.771 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -10.026 6.659 -1.770 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.492 8.573 -0.831 1.00 10.00 O ATOM 0 H ASP A 82 -10.763 6.514 2.775 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.594 5.997 0.098 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.540 7.392 1.360 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.700 6.052 0.607 1.00 10.00 H new ATOM 1079 N THR A 83 -10.310 3.849 -0.600 1.00 10.00 N ATOM 1080 CA THR A 83 -9.963 2.465 -0.887 1.00 10.00 C ATOM 1081 C THR A 83 -8.675 2.357 -1.701 1.00 10.00 C ATOM 1082 O THR A 83 -8.471 3.095 -2.666 1.00 10.00 O ATOM 1083 CB THR A 83 -11.104 1.760 -1.645 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.330 1.906 -0.915 1.00 10.00 O ATOM 1085 CG2 THR A 83 -10.804 0.282 -1.846 1.00 10.00 C ATOM 0 H THR A 83 -10.451 4.431 -1.426 1.00 10.00 H new ATOM 0 HA THR A 83 -9.805 1.975 0.074 1.00 10.00 H new ATOM 0 HB THR A 83 -11.198 2.225 -2.626 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.055 1.458 -1.400 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.628 -0.187 -2.384 1.00 10.00 H new ATOM 0 HG22 THR A 83 -9.886 0.172 -2.423 1.00 10.00 H new ATOM 0 HG23 THR A 83 -10.683 -0.200 -0.876 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.811 1.438 -1.286 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.551 1.188 -1.966 1.00 10.00 C ATOM 1095 C ILE A 84 -6.560 -0.227 -2.541 1.00 10.00 C ATOM 1096 O ILE A 84 -6.979 -1.174 -1.867 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.346 1.370 -1.010 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.242 2.834 -0.576 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.056 0.915 -1.674 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.209 3.084 0.504 1.00 10.00 C ATOM 0 H ILE A 84 -7.966 0.847 -0.469 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.443 1.913 -2.773 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.505 0.751 -0.127 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -4.998 3.444 -1.446 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.216 3.166 -0.217 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.224 1.052 -0.984 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.136 -0.139 -1.941 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -3.882 1.505 -2.574 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.196 4.144 0.757 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.462 2.503 1.391 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.225 2.785 0.143 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.118 -0.360 -3.786 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.094 -1.648 -4.475 1.00 10.00 C ATOM 1114 C ASP A 85 -4.795 -2.400 -4.227 1.00 10.00 C ATOM 1115 O ASP A 85 -3.711 -1.812 -4.241 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.266 -1.446 -5.982 1.00 10.00 C ATOM 1117 CG ASP A 85 -7.595 -0.824 -6.345 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.619 -1.533 -6.295 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -7.620 0.377 -6.695 1.00 10.00 O ATOM 0 H ASP A 85 -5.767 0.417 -4.346 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.919 -2.239 -4.077 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -5.461 -0.812 -6.353 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.171 -2.408 -6.485 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.910 -3.706 -4.012 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.751 -4.561 -3.781 1.00 10.00 C ATOM 1126 C VAL A 86 -3.700 -5.664 -4.832 1.00 10.00 C ATOM 1127 O VAL A 86 -4.678 -6.389 -5.028 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.783 -5.220 -2.386 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -2.490 -5.974 -2.121 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -4.022 -4.184 -1.305 1.00 10.00 C ATOM 0 H VAL A 86 -5.803 -4.199 -3.993 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.869 -3.924 -3.844 1.00 10.00 H new ATOM 0 HB VAL A 86 -4.609 -5.931 -2.367 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -2.532 -6.432 -1.133 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -2.360 -6.750 -2.875 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -1.649 -5.281 -2.165 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -4.040 -4.672 -0.331 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -3.221 -3.445 -1.325 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.977 -3.689 -1.481 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.568 -5.779 -5.512 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.385 -6.800 -6.535 1.00 10.00 C ATOM 1142 C PHE A 87 -1.028 -7.473 -6.369 1.00 10.00 C ATOM 1143 O PHE A 87 -0.197 -7.019 -5.584 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.495 -6.187 -7.937 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.883 -5.733 -8.294 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.870 -6.655 -8.604 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.199 -4.383 -8.325 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -6.146 -6.241 -8.937 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.472 -3.964 -8.656 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.448 -4.893 -8.963 1.00 10.00 C ATOM 0 H PHE A 87 -1.758 -5.175 -5.373 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.171 -7.547 -6.419 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.816 -5.337 -8.006 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.163 -6.921 -8.671 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.639 -7.710 -8.585 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.441 -3.651 -8.088 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.906 -6.970 -9.177 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.705 -2.910 -8.675 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.444 -4.566 -9.223 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.815 -8.557 -7.096 1.00 10.00 N ATOM 1161 CA GLN A 88 0.444 -9.284 -7.039 1.00 10.00 C ATOM 1162 C GLN A 88 1.110 -9.295 -8.407 1.00 10.00 C ATOM 1163 O GLN A 88 0.433 -9.348 -9.436 1.00 10.00 O ATOM 1164 CB GLN A 88 0.228 -10.724 -6.568 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.031 -10.863 -5.078 1.00 10.00 C ATOM 1166 CD GLN A 88 0.482 -12.177 -4.526 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.479 -12.723 -5.008 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -0.196 -12.698 -3.517 1.00 10.00 N ATOM 0 H GLN A 88 -1.502 -8.956 -7.736 1.00 10.00 H new ATOM 0 HA GLN A 88 1.090 -8.775 -6.323 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.615 -11.149 -7.112 1.00 10.00 H new ATOM 0 HB3 GLN A 88 1.106 -11.315 -6.829 1.00 10.00 H new ATOM 0 HG2 GLN A 88 0.447 -10.038 -4.550 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.102 -10.785 -4.889 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -1.015 -12.214 -3.149 1.00 10.00 H new ATOM 0 HE22 GLN A 88 0.100 -13.584 -3.107 1.00 10.00 H new ATOM 1177 N GLN A 89 2.433 -9.240 -8.413 1.00 10.00 N ATOM 1178 CA GLN A 89 3.188 -9.260 -9.655 1.00 10.00 C ATOM 1179 C GLN A 89 3.222 -10.676 -10.217 1.00 10.00 C ATOM 1180 O GLN A 89 3.198 -11.649 -9.460 1.00 10.00 O ATOM 1181 CB GLN A 89 4.612 -8.747 -9.417 1.00 10.00 C ATOM 1182 CG GLN A 89 5.376 -8.454 -10.699 1.00 10.00 C ATOM 1183 CD GLN A 89 4.709 -7.384 -11.547 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.044 -6.486 -11.034 1.00 10.00 O ATOM 1185 NE2 GLN A 89 4.888 -7.473 -12.856 1.00 10.00 N ATOM 0 H GLN A 89 3.006 -9.181 -7.571 1.00 10.00 H new ATOM 0 HA GLN A 89 2.701 -8.605 -10.378 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.566 -7.839 -8.816 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.163 -9.487 -8.836 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.388 -8.136 -10.449 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.465 -9.371 -11.282 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.447 -8.233 -13.244 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.467 -6.781 -13.476 1.00 10.00 H new ATOM 1194 N GLN A 90 3.259 -10.783 -11.538 1.00 10.00 N ATOM 1195 CA GLN A 90 3.294 -12.076 -12.206 1.00 10.00 C ATOM 1196 C GLN A 90 4.590 -12.810 -11.882 1.00 10.00 C ATOM 1197 O GLN A 90 5.636 -12.187 -11.691 1.00 10.00 O ATOM 1198 CB GLN A 90 3.150 -11.902 -13.723 1.00 10.00 C ATOM 1199 CG GLN A 90 1.750 -11.502 -14.172 1.00 10.00 C ATOM 1200 CD GLN A 90 1.377 -10.085 -13.774 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.238 -9.215 -13.643 1.00 10.00 O ATOM 1202 NE2 GLN A 90 0.091 -9.846 -13.575 1.00 10.00 N ATOM 0 H GLN A 90 3.266 -9.984 -12.172 1.00 10.00 H new ATOM 0 HA GLN A 90 2.456 -12.671 -11.843 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.858 -11.145 -14.060 1.00 10.00 H new ATOM 0 HB3 GLN A 90 3.424 -12.836 -14.213 1.00 10.00 H new ATOM 0 HG2 GLN A 90 1.681 -11.598 -15.256 1.00 10.00 H new ATOM 0 HG3 GLN A 90 1.026 -12.195 -13.744 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.591 -10.595 -13.694 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.218 -8.913 -13.303 1.00 10.00 H new ATOM 1211 N THR A 91 4.510 -14.132 -11.820 1.00 10.00 N ATOM 1212 CA THR A 91 5.658 -14.965 -11.508 1.00 10.00 C ATOM 1213 C THR A 91 6.704 -14.926 -12.623 1.00 10.00 C ATOM 1214 O THR A 91 7.908 -14.947 -12.361 1.00 10.00 O ATOM 1215 CB THR A 91 5.210 -16.417 -11.278 1.00 10.00 C ATOM 1216 OG1 THR A 91 3.783 -16.512 -11.434 1.00 10.00 O ATOM 1217 CG2 THR A 91 5.604 -16.895 -9.890 1.00 10.00 C ATOM 0 H THR A 91 3.649 -14.654 -11.984 1.00 10.00 H new ATOM 0 HA THR A 91 6.113 -14.570 -10.600 1.00 10.00 H new ATOM 0 HB THR A 91 5.705 -17.051 -12.014 1.00 10.00 H new ATOM 0 HG1 THR A 91 3.499 -17.439 -11.289 1.00 10.00 H new ATOM 0 HG21 THR A 91 5.275 -17.925 -9.753 1.00 10.00 H new ATOM 0 HG22 THR A 91 6.687 -16.842 -9.781 1.00 10.00 H new ATOM 0 HG23 THR A 91 5.132 -16.261 -9.139 1.00 10.00 H new ATOM 1225 N GLY A 92 6.238 -14.876 -13.865 1.00 10.00 N ATOM 1226 CA GLY A 92 7.135 -14.836 -14.998 1.00 10.00 C ATOM 1227 C GLY A 92 6.392 -15.023 -16.302 1.00 10.00 C ATOM 1228 O GLY A 92 5.305 -15.638 -16.274 1.00 10.00 O ATOM 0 H GLY A 92 5.247 -14.862 -14.106 1.00 10.00 H new ATOM 0 HA2 GLY A 92 7.662 -13.882 -15.012 1.00 10.00 H new ATOM 0 HA3 GLY A 92 7.890 -15.616 -14.893 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -14.960 -11.149 5.630 1.00 10.00 N ATOM 1234 CA ASN B 357 -14.213 -9.880 5.624 1.00 10.00 C ATOM 1235 C ASN B 357 -13.781 -9.527 7.036 1.00 10.00 C ATOM 1236 O ASN B 357 -14.545 -9.675 7.992 1.00 10.00 O ATOM 1237 CB ASN B 357 -15.057 -8.743 5.026 1.00 10.00 C ATOM 1238 CG ASN B 357 -16.318 -8.420 5.818 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -16.735 -7.158 5.780 1.00 10.00 O flip ATOM 1240 ND2 ASN B 357 -16.919 -9.288 6.453 1.00 10.00 N flip ATOM 0 HA ASN B 357 -13.329 -10.007 4.999 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -14.443 -7.845 4.960 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -15.339 -9.011 4.008 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -16.571 -10.247 6.461 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -17.764 -9.048 6.971 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.546 -9.096 7.176 1.00 10.00 N ATOM 1248 CA ASN B 358 -12.010 -8.729 8.476 1.00 10.00 C ATOM 1249 C ASN B 358 -11.528 -7.286 8.485 1.00 10.00 C ATOM 1250 O ASN B 358 -10.831 -6.855 7.568 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.884 -9.687 8.896 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.907 -10.002 7.778 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -9.618 -9.174 6.917 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -9.395 -11.218 7.783 1.00 10.00 N ATOM 0 H ASN B 358 -11.889 -8.990 6.403 1.00 10.00 H new ATOM 0 HA ASN B 358 -12.816 -8.815 9.205 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.338 -9.249 9.732 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -11.324 -10.617 9.255 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -8.736 -11.497 7.056 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -9.658 -11.879 8.514 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.927 -6.522 9.502 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.498 -5.139 9.580 1.00 10.00 C ATOM 1263 C ARG B 359 -10.673 -4.903 10.845 1.00 10.00 C ATOM 1264 O ARG B 359 -11.127 -5.156 11.963 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.705 -4.185 9.542 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.781 -4.481 10.585 1.00 10.00 C ATOM 1267 CD ARG B 359 -15.079 -3.726 10.297 1.00 10.00 C ATOM 1268 NE ARG B 359 -16.073 -3.936 11.350 1.00 10.00 N ATOM 1269 CZ ARG B 359 -17.279 -3.362 11.374 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -17.650 -2.536 10.404 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -18.120 -3.626 12.367 1.00 10.00 N ATOM 0 H ARG B 359 -12.532 -6.833 10.262 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.872 -4.931 8.712 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -12.350 -3.164 9.685 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -13.156 -4.230 8.551 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.981 -5.552 10.606 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.413 -4.206 11.574 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -14.867 -2.661 10.204 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -15.487 -4.055 9.341 1.00 10.00 H new ATOM 0 HE ARG B 359 -15.829 -4.563 12.117 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -17.013 -2.336 9.633 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -18.572 -2.101 10.429 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -17.845 -4.267 13.111 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -19.041 -3.188 12.386 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.450 -4.435 10.638 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.507 -4.144 11.711 1.00 10.00 C ATOM 1287 C ASP B 360 -7.961 -2.723 11.559 1.00 10.00 C ATOM 1288 O ASP B 360 -7.698 -2.295 10.439 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.391 -5.196 11.770 1.00 10.00 C ATOM 1290 CG ASP B 360 -6.162 -4.820 10.976 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -6.185 -4.978 9.740 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.160 -4.397 11.589 1.00 10.00 O ATOM 0 H ASP B 360 -9.079 -4.244 9.707 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.031 -4.196 12.666 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.107 -5.354 12.810 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.778 -6.145 11.398 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.803 -1.954 12.650 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.306 -0.586 12.563 1.00 10.00 C ATOM 1299 C PRO B 361 -5.862 -0.444 13.045 1.00 10.00 C ATOM 1300 O PRO B 361 -5.494 -0.862 14.145 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.247 0.126 13.543 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.638 -0.920 14.556 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.206 -2.269 14.018 1.00 10.00 C ATOM 0 HA PRO B 361 -7.296 -0.202 11.543 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.750 0.970 14.022 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -9.123 0.522 13.029 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -8.160 -0.720 15.515 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.714 -0.903 14.726 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.384 -2.691 14.596 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.019 -2.995 14.044 1.00 10.00 H new ATOM 1311 N ILE B 362 -5.057 0.161 12.185 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.637 0.370 12.430 1.00 10.00 C ATOM 1313 C ILE B 362 -3.306 1.851 12.417 1.00 10.00 C ATOM 1314 O ILE B 362 -3.755 2.567 11.533 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.779 -0.333 11.351 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.308 -1.743 11.064 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.319 -0.392 11.775 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -2.893 -2.271 9.709 1.00 10.00 C ATOM 0 H ILE B 362 -5.374 0.525 11.287 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.410 -0.053 13.409 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.849 0.253 10.434 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.949 -2.423 11.837 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -4.396 -1.735 11.126 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.735 -0.890 11.001 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.941 0.620 11.920 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.233 -0.948 12.709 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -3.300 -3.272 9.569 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -3.274 -1.612 8.929 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -1.805 -2.310 9.651 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.542 2.320 13.388 1.00 10.00 N ATOM 1331 CA VAL B 363 -2.185 3.726 13.415 1.00 10.00 C ATOM 1332 C VAL B 363 -0.684 3.882 13.248 1.00 10.00 C ATOM 1333 O VAL B 363 0.101 3.331 14.018 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.596 4.393 14.753 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -2.346 5.894 14.713 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -4.049 4.100 15.090 1.00 10.00 C ATOM 0 H VAL B 363 -2.164 1.761 14.153 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.717 4.212 12.597 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.975 3.965 15.540 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.643 6.338 15.663 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -1.286 6.082 14.540 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.930 6.339 13.907 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.308 4.581 16.033 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.691 4.486 14.298 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.191 3.023 15.181 1.00 10.00 H new ATOM 1346 N ILE B 364 -0.298 4.632 12.226 1.00 10.00 N ATOM 1347 CA ILE B 364 1.106 4.906 11.955 1.00 10.00 C ATOM 1348 C ILE B 364 1.338 6.409 11.888 1.00 10.00 C ATOM 1349 O ILE B 364 0.644 7.116 11.155 1.00 10.00 O ATOM 1350 CB ILE B 364 1.580 4.275 10.619 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.339 2.763 10.613 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.055 4.574 10.374 1.00 10.00 C ATOM 1353 CD1 ILE B 364 1.588 2.110 9.267 1.00 10.00 C ATOM 0 H ILE B 364 -0.944 5.065 11.566 1.00 10.00 H new ATOM 0 HA ILE B 364 1.679 4.462 12.769 1.00 10.00 H new ATOM 0 HB ILE B 364 0.996 4.720 9.813 1.00 10.00 H new ATOM 0 HG12 ILE B 364 1.986 2.298 11.357 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.311 2.567 10.917 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.366 4.122 9.432 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.205 5.653 10.326 1.00 10.00 H new ATOM 0 HG23 ILE B 364 3.650 4.161 11.189 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.397 1.039 9.341 1.00 10.00 H new ATOM 0 HD12 ILE B 364 0.923 2.547 8.522 1.00 10.00 H new ATOM 0 HD13 ILE B 364 2.624 2.274 8.969 1.00 10.00 H new ATOM 1365 N SER B 365 2.284 6.898 12.664 1.00 10.00 N ATOM 1366 CA SER B 365 2.614 8.315 12.646 1.00 10.00 C ATOM 1367 C SER B 365 4.099 8.505 12.339 1.00 10.00 C ATOM 1368 O SER B 365 4.953 7.894 12.982 1.00 10.00 O ATOM 1369 CB SER B 365 2.249 8.953 13.981 1.00 10.00 C ATOM 1370 OG SER B 365 0.876 8.750 14.271 1.00 10.00 O ATOM 0 H SER B 365 2.838 6.340 13.314 1.00 10.00 H new ATOM 0 HA SER B 365 2.038 8.806 11.862 1.00 10.00 H new ATOM 0 HB2 SER B 365 2.861 8.525 14.775 1.00 10.00 H new ATOM 0 HB3 SER B 365 2.466 10.021 13.952 1.00 10.00 H new ATOM 0 HG SER B 365 0.659 9.164 15.132 1.00 10.00 H new ATOM 1376 N ASP B 366 4.404 9.350 11.367 1.00 10.00 N ATOM 1377 CA ASP B 366 5.797 9.605 11.004 1.00 10.00 C ATOM 1378 C ASP B 366 6.113 11.083 11.146 1.00 10.00 C ATOM 1379 O ASP B 366 5.378 11.934 10.646 1.00 10.00 O ATOM 1380 CB ASP B 366 6.097 9.142 9.574 1.00 10.00 C ATOM 1381 CG ASP B 366 7.589 9.009 9.316 1.00 10.00 C ATOM 1382 OD1 ASP B 366 8.046 9.376 8.218 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.306 8.512 10.212 1.00 10.00 O ATOM 0 H ASP B 366 3.718 9.868 10.818 1.00 10.00 H new ATOM 0 HA ASP B 366 6.428 9.033 11.684 1.00 10.00 H new ATOM 0 HB2 ASP B 366 5.612 8.182 9.395 1.00 10.00 H new ATOM 0 HB3 ASP B 366 5.669 9.852 8.866 1.00 10.00 H new ATOM 1388 N SER B 367 7.196 11.385 11.839 1.00 10.00 N ATOM 1389 CA SER B 367 7.601 12.763 12.045 1.00 10.00 C ATOM 1390 C SER B 367 9.054 12.961 11.639 1.00 10.00 C ATOM 1391 O SER B 367 9.918 12.150 11.993 1.00 10.00 O ATOM 1392 CB SER B 367 7.395 13.143 13.507 1.00 10.00 C ATOM 1393 OG SER B 367 6.122 12.704 13.957 1.00 10.00 O ATOM 0 H SER B 367 7.811 10.694 12.269 1.00 10.00 H new ATOM 0 HA SER B 367 6.987 13.411 11.420 1.00 10.00 H new ATOM 0 HB2 SER B 367 8.178 12.696 14.119 1.00 10.00 H new ATOM 0 HB3 SER B 367 7.476 14.224 13.624 1.00 10.00 H new ATOM 0 HG SER B 367 6.004 12.953 14.897 1.00 10.00 H new ATOM 1399 N PRO B 368 9.344 14.034 10.888 1.00 10.00 N ATOM 1400 CA PRO B 368 10.707 14.330 10.435 1.00 10.00 C ATOM 1401 C PRO B 368 11.650 14.602 11.600 1.00 10.00 C ATOM 1402 O PRO B 368 11.222 15.248 12.583 1.00 10.00 O ATOM 1403 CB PRO B 368 10.544 15.579 9.560 1.00 10.00 C ATOM 1404 CG PRO B 368 9.245 16.183 9.972 1.00 10.00 C ATOM 1405 CD PRO B 368 8.374 15.045 10.418 1.00 10.00 C ATOM 0 HA PRO B 368 11.150 13.490 9.900 1.00 10.00 H new ATOM 0 HB2 PRO B 368 11.368 16.276 9.713 1.00 10.00 H new ATOM 0 HB3 PRO B 368 10.539 15.319 8.501 1.00 10.00 H new ATOM 0 HG2 PRO B 368 9.389 16.902 10.779 1.00 10.00 H new ATOM 0 HG3 PRO B 368 8.786 16.722 9.143 1.00 10.00 H new ATOM 0 HD2 PRO B 368 7.693 15.348 11.213 1.00 10.00 H new ATOM 0 HD3 PRO B 368 7.761 14.664 9.601 1.00 10.00 H new TER 1413 PRO B 368