USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 970 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 19 ASN : amide:sc= -1.82! C(o=-2.8!,f=-3!) USER MOD Set 1.2: A 116 HIS : no HD1:sc= -0.979 K(o=-2.8,f=-4.2) USER MOD Set 2.1: A 63 GLN : amide:sc= -4.08! C(o=-4.7!,f=-14!) USER MOD Set 2.2: A 65 THR OG1 : rot -170:sc= -0.634 USER MOD Set 3.1: A 57 TYR OH : rot 180:sc= -0.043 USER MOD Set 3.2: A 62 GLN : amide:sc= 0 X(o=-0.043,f=-0.043) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.0917 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.163 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0562) USER MOD Single : A 31 HIS : no HE2:sc= -0.366 X(o=-0.37,f=-0.026) USER MOD Single : A 32 ASN : amide:sc= 0.15 X(o=0.15,f=-0.32) USER MOD Single : A 35 GLN :FLIP amide:sc= -0.938! C(o=-2.8!,f=-0.94!) USER MOD Single : A 40 TYR OH : rot -153:sc= 0.54 USER MOD Single : A 41 ASN : amide:sc= -1.03 X(o=-1,f=-0.67) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.115 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -0.0256 K(o=-0.026,f=-0.99) USER MOD Single : A 60 SER OG : rot 180:sc= -0.0318 USER MOD Single : A 61 ASN : amide:sc= -2.32! C(o=-2.3!,f=-1.9!) USER MOD Single : A 70 TYR OH : rot 21:sc= 0.00133 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.775 K(o=-0.78,f=-5.9!) USER MOD Single : A 81 SER OG : rot 170:sc= 0 USER MOD Single : A 84 MET CE :methyl -108:sc= -0.407 (180deg=-3.31) USER MOD Single : A 86 ASN : amide:sc= -0.165 K(o=-0.17,f=-2.6!) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.782 K(o=-0.78,f=-2.3!) USER MOD Single : A 92 THR OG1 : rot 90:sc= 0.369 USER MOD Single : A 94 SER OG : rot 1:sc= 0.34 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 60:sc=-0.00728 USER MOD Single : A 98 GLN :FLIP amide:sc= -2.3! C(o=-4.5!,f=-2.3!) USER MOD Single : A 101 LYS NZ :NH3+ 155:sc= -1.07 (180deg=-1.63) USER MOD Single : A 103 ASN : amide:sc= -4.97! C(o=-5!,f=-5.2!) USER MOD Single : A 105 MET CE :methyl 160:sc= -0.0432 (180deg=-0.331) USER MOD Single : A 106 SER OG : rot 180:sc= -0.768 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0136 USER MOD Single : A 112 GLN : amide:sc= -2.31 X(o=-2.3,f=-2.3) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot -72:sc= 0.368 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= -0.119 USER MOD Single : A 129 SER OG : rot 180:sc= -0.107 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.918 30.091 24.345 1.00 0.00 N ATOM 2 CA GLY A 1 -9.769 28.721 23.890 1.00 0.00 C ATOM 3 C GLY A 1 -8.690 27.972 24.646 1.00 0.00 C ATOM 4 O GLY A 1 -8.133 28.485 25.617 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.875 30.227 24.728 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.217 30.288 25.087 1.00 0.00 H new ATOM 0 H3 GLY A 1 -9.769 30.740 23.546 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.718 28.198 24.005 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.531 28.719 22.826 1.00 0.00 H new ATOM 8 N SER A 2 -8.394 26.755 24.203 1.00 0.00 N ATOM 9 CA SER A 2 -7.378 25.932 24.848 1.00 0.00 C ATOM 10 C SER A 2 -6.651 25.065 23.825 1.00 0.00 C ATOM 11 O SER A 2 -7.210 24.708 22.788 1.00 0.00 O ATOM 12 CB SER A 2 -8.015 25.047 25.922 1.00 0.00 C ATOM 13 OG SER A 2 -8.727 23.970 25.338 1.00 0.00 O ATOM 0 H SER A 2 -8.844 26.317 23.399 1.00 0.00 H new ATOM 0 HA SER A 2 -6.652 26.596 25.317 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.241 24.659 26.584 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.690 25.643 26.536 1.00 0.00 H new ATOM 0 HG SER A 2 -9.123 23.418 26.045 1.00 0.00 H new ATOM 19 N SER A 3 -5.400 24.731 24.124 1.00 0.00 N ATOM 20 CA SER A 3 -4.593 23.910 23.230 1.00 0.00 C ATOM 21 C SER A 3 -4.685 22.436 23.613 1.00 0.00 C ATOM 22 O SER A 3 -5.130 22.095 24.709 1.00 0.00 O ATOM 23 CB SER A 3 -3.133 24.366 23.262 1.00 0.00 C ATOM 24 OG SER A 3 -2.582 24.221 24.560 1.00 0.00 O ATOM 0 H SER A 3 -4.923 25.017 24.979 1.00 0.00 H new ATOM 0 HA SER A 3 -4.982 24.030 22.219 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.551 23.782 22.549 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.067 25.408 22.950 1.00 0.00 H new ATOM 0 HG SER A 3 -1.648 24.517 24.554 1.00 0.00 H new ATOM 30 N GLY A 4 -4.262 21.565 22.702 1.00 0.00 N ATOM 31 CA GLY A 4 -4.306 20.138 22.962 1.00 0.00 C ATOM 32 C GLY A 4 -3.139 19.399 22.338 1.00 0.00 C ATOM 33 O GLY A 4 -2.250 18.921 23.042 1.00 0.00 O ATOM 0 H GLY A 4 -3.889 21.822 21.788 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.306 19.968 24.039 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.240 19.730 22.575 1.00 0.00 H new ATOM 37 N SER A 5 -3.142 19.304 21.012 1.00 0.00 N ATOM 38 CA SER A 5 -2.078 18.612 20.293 1.00 0.00 C ATOM 39 C SER A 5 -1.635 19.416 19.074 1.00 0.00 C ATOM 40 O SER A 5 -2.420 19.657 18.157 1.00 0.00 O ATOM 41 CB SER A 5 -2.547 17.222 19.859 1.00 0.00 C ATOM 42 OG SER A 5 -2.459 16.297 20.929 1.00 0.00 O ATOM 0 H SER A 5 -3.869 19.697 20.414 1.00 0.00 H new ATOM 0 HA SER A 5 -1.227 18.506 20.966 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.576 17.276 19.505 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.940 16.875 19.023 1.00 0.00 H new ATOM 0 HG SER A 5 -2.766 15.417 20.627 1.00 0.00 H new ATOM 48 N SER A 6 -0.371 19.828 19.072 1.00 0.00 N ATOM 49 CA SER A 6 0.177 20.608 17.969 1.00 0.00 C ATOM 50 C SER A 6 1.523 20.046 17.522 1.00 0.00 C ATOM 51 O SER A 6 2.260 19.464 18.317 1.00 0.00 O ATOM 52 CB SER A 6 0.334 22.073 18.380 1.00 0.00 C ATOM 53 OG SER A 6 -0.895 22.609 18.837 1.00 0.00 O ATOM 0 H SER A 6 0.293 19.634 19.822 1.00 0.00 H new ATOM 0 HA SER A 6 -0.519 20.546 17.132 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.085 22.155 19.166 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.695 22.655 17.532 1.00 0.00 H new ATOM 0 HG SER A 6 -0.768 23.546 19.095 1.00 0.00 H new ATOM 59 N GLY A 7 1.837 20.224 16.242 1.00 0.00 N ATOM 60 CA GLY A 7 3.093 19.730 15.711 1.00 0.00 C ATOM 61 C GLY A 7 3.020 19.438 14.225 1.00 0.00 C ATOM 62 O GLY A 7 1.932 19.325 13.659 1.00 0.00 O ATOM 0 H GLY A 7 1.243 20.702 15.564 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.876 20.465 15.896 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.377 18.822 16.243 1.00 0.00 H new ATOM 66 N THR A 8 4.181 19.317 13.589 1.00 0.00 N ATOM 67 CA THR A 8 4.244 19.039 12.160 1.00 0.00 C ATOM 68 C THR A 8 3.121 18.101 11.732 1.00 0.00 C ATOM 69 O THR A 8 2.846 17.103 12.397 1.00 0.00 O ATOM 70 CB THR A 8 5.596 18.415 11.767 1.00 0.00 C ATOM 71 OG1 THR A 8 5.628 18.159 10.359 1.00 0.00 O ATOM 72 CG2 THR A 8 5.836 17.121 12.529 1.00 0.00 C ATOM 0 H THR A 8 5.091 19.407 14.042 1.00 0.00 H new ATOM 0 HA THR A 8 4.131 19.995 11.648 1.00 0.00 H new ATOM 0 HB THR A 8 6.385 19.121 12.024 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.492 17.764 10.118 1.00 0.00 H new ATOM 0 HG21 THR A 8 6.797 16.698 12.235 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.842 17.325 13.600 1.00 0.00 H new ATOM 0 HG23 THR A 8 5.042 16.411 12.299 1.00 0.00 H new ATOM 80 N ALA A 9 2.477 18.427 10.616 1.00 0.00 N ATOM 81 CA ALA A 9 1.386 17.612 10.098 1.00 0.00 C ATOM 82 C ALA A 9 1.809 16.864 8.838 1.00 0.00 C ATOM 83 O ALA A 9 2.400 17.447 7.929 1.00 0.00 O ATOM 84 CB ALA A 9 0.167 18.478 9.815 1.00 0.00 C ATOM 0 H ALA A 9 2.692 19.250 10.053 1.00 0.00 H new ATOM 0 HA ALA A 9 1.126 16.874 10.857 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.640 17.855 9.429 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -0.157 18.962 10.736 1.00 0.00 H new ATOM 0 HB3 ALA A 9 0.424 19.238 9.077 1.00 0.00 H new ATOM 90 N GLN A 10 1.505 15.571 8.792 1.00 0.00 N ATOM 91 CA GLN A 10 1.856 14.744 7.644 1.00 0.00 C ATOM 92 C GLN A 10 0.852 13.610 7.462 1.00 0.00 C ATOM 93 O GLN A 10 0.520 12.902 8.414 1.00 0.00 O ATOM 94 CB GLN A 10 3.265 14.172 7.813 1.00 0.00 C ATOM 95 CG GLN A 10 3.384 13.175 8.955 1.00 0.00 C ATOM 96 CD GLN A 10 4.787 12.621 9.102 1.00 0.00 C ATOM 97 OE1 GLN A 10 5.717 13.067 8.429 1.00 0.00 O ATOM 98 NE2 GLN A 10 4.948 11.643 9.985 1.00 0.00 N ATOM 0 H GLN A 10 1.016 15.074 9.537 1.00 0.00 H new ATOM 0 HA GLN A 10 1.831 15.373 6.754 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.565 13.686 6.885 1.00 0.00 H new ATOM 0 HB3 GLN A 10 3.963 14.992 7.983 1.00 0.00 H new ATOM 0 HG2 GLN A 10 3.089 13.658 9.886 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.688 12.353 8.788 1.00 0.00 H new ATOM 0 HE21 GLN A 10 4.150 11.304 10.521 1.00 0.00 H new ATOM 0 HE22 GLN A 10 5.870 11.231 10.127 1.00 0.00 H new ATOM 107 N LEU A 11 0.372 13.443 6.235 1.00 0.00 N ATOM 108 CA LEU A 11 -0.595 12.395 5.927 1.00 0.00 C ATOM 109 C LEU A 11 -0.204 11.081 6.595 1.00 0.00 C ATOM 110 O LEU A 11 0.790 10.455 6.225 1.00 0.00 O ATOM 111 CB LEU A 11 -0.701 12.200 4.414 1.00 0.00 C ATOM 112 CG LEU A 11 -2.045 11.687 3.896 1.00 0.00 C ATOM 113 CD1 LEU A 11 -3.193 12.372 4.621 1.00 0.00 C ATOM 114 CD2 LEU A 11 -2.156 11.904 2.394 1.00 0.00 C ATOM 0 H LEU A 11 0.637 14.020 5.437 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.565 12.704 6.315 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -0.487 13.153 3.929 1.00 0.00 H new ATOM 0 HB3 LEU A 11 0.076 11.502 4.102 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.104 10.617 4.094 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -4.141 11.994 4.239 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.124 12.165 5.689 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.138 13.448 4.455 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.119 11.533 2.043 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.075 12.968 2.173 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -1.354 11.366 1.888 1.00 0.00 H new ATOM 126 N THR A 12 -0.994 10.666 7.581 1.00 0.00 N ATOM 127 CA THR A 12 -0.731 9.426 8.300 1.00 0.00 C ATOM 128 C THR A 12 -1.982 8.558 8.375 1.00 0.00 C ATOM 129 O THR A 12 -3.070 8.986 7.986 1.00 0.00 O ATOM 130 CB THR A 12 -0.226 9.701 9.729 1.00 0.00 C ATOM 131 OG1 THR A 12 0.245 8.487 10.325 1.00 0.00 O ATOM 132 CG2 THR A 12 -1.330 10.298 10.588 1.00 0.00 C ATOM 0 H THR A 12 -1.821 11.171 7.899 1.00 0.00 H new ATOM 0 HA THR A 12 0.043 8.897 7.744 1.00 0.00 H new ATOM 0 HB THR A 12 0.593 10.417 9.669 1.00 0.00 H new ATOM 0 HG1 THR A 12 0.566 8.671 11.233 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.949 10.483 11.592 1.00 0.00 H new ATOM 0 HG22 THR A 12 -1.666 11.237 10.148 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.167 9.602 10.640 1.00 0.00 H new ATOM 140 N ILE A 13 -1.822 7.338 8.876 1.00 0.00 N ATOM 141 CA ILE A 13 -2.939 6.411 9.002 1.00 0.00 C ATOM 142 C ILE A 13 -2.765 5.502 10.214 1.00 0.00 C ATOM 143 O ILE A 13 -1.678 4.978 10.457 1.00 0.00 O ATOM 144 CB ILE A 13 -3.096 5.542 7.741 1.00 0.00 C ATOM 145 CG1 ILE A 13 -3.395 6.421 6.524 1.00 0.00 C ATOM 146 CG2 ILE A 13 -4.197 4.512 7.940 1.00 0.00 C ATOM 147 CD1 ILE A 13 -3.275 5.689 5.206 1.00 0.00 C ATOM 0 H ILE A 13 -0.929 6.968 9.201 1.00 0.00 H new ATOM 0 HA ILE A 13 -3.837 7.016 9.130 1.00 0.00 H new ATOM 0 HB ILE A 13 -2.159 5.013 7.563 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -4.404 6.824 6.616 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -2.711 7.270 6.522 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.295 3.906 7.039 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.946 3.870 8.784 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.140 5.021 8.139 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -3.501 6.373 4.388 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -2.260 5.309 5.092 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -3.978 4.856 5.187 1.00 0.00 H new ATOM 159 N GLU A 14 -3.844 5.318 10.969 1.00 0.00 N ATOM 160 CA GLU A 14 -3.809 4.470 12.155 1.00 0.00 C ATOM 161 C GLU A 14 -4.850 3.358 12.059 1.00 0.00 C ATOM 162 O GLU A 14 -6.052 3.620 12.029 1.00 0.00 O ATOM 163 CB GLU A 14 -4.053 5.305 13.413 1.00 0.00 C ATOM 164 CG GLU A 14 -4.122 4.480 14.688 1.00 0.00 C ATOM 165 CD GLU A 14 -4.762 5.234 15.837 1.00 0.00 C ATOM 166 OE1 GLU A 14 -5.928 5.658 15.693 1.00 0.00 O ATOM 167 OE2 GLU A 14 -4.097 5.400 16.881 1.00 0.00 O ATOM 0 H GLU A 14 -4.751 5.744 10.781 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.821 4.015 12.216 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -3.256 6.042 13.510 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -4.985 5.857 13.297 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -4.688 3.569 14.496 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.115 4.176 14.974 1.00 0.00 H new ATOM 174 N ALA A 15 -4.379 2.117 12.011 1.00 0.00 N ATOM 175 CA ALA A 15 -5.268 0.965 11.920 1.00 0.00 C ATOM 176 C ALA A 15 -6.246 0.933 13.090 1.00 0.00 C ATOM 177 O ALA A 15 -5.856 1.119 14.243 1.00 0.00 O ATOM 178 CB ALA A 15 -4.459 -0.323 11.870 1.00 0.00 C ATOM 0 H ALA A 15 -3.386 1.883 12.034 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.846 1.054 11.000 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.135 -1.175 11.802 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -3.805 -0.308 10.998 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -3.856 -0.409 12.774 1.00 0.00 H new ATOM 184 N VAL A 16 -7.518 0.696 12.785 1.00 0.00 N ATOM 185 CA VAL A 16 -8.552 0.639 13.812 1.00 0.00 C ATOM 186 C VAL A 16 -9.547 -0.481 13.528 1.00 0.00 C ATOM 187 O VAL A 16 -10.401 -0.378 12.647 1.00 0.00 O ATOM 188 CB VAL A 16 -9.313 1.973 13.916 1.00 0.00 C ATOM 189 CG1 VAL A 16 -10.383 1.895 14.994 1.00 0.00 C ATOM 190 CG2 VAL A 16 -8.348 3.116 14.193 1.00 0.00 C ATOM 0 H VAL A 16 -7.857 0.540 11.836 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.048 0.442 14.758 1.00 0.00 H new ATOM 0 HB VAL A 16 -9.805 2.166 12.963 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -10.910 2.847 15.053 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -11.090 1.103 14.748 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.916 1.679 15.955 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -8.903 4.052 14.263 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -7.826 2.932 15.132 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.623 3.184 13.382 1.00 0.00 H new ATOM 200 N PRO A 17 -9.436 -1.578 14.291 1.00 0.00 N ATOM 201 CA PRO A 17 -8.423 -1.713 15.342 1.00 0.00 C ATOM 202 C PRO A 17 -7.014 -1.846 14.775 1.00 0.00 C ATOM 203 O PRO A 17 -6.813 -1.779 13.563 1.00 0.00 O ATOM 204 CB PRO A 17 -8.832 -2.998 16.066 1.00 0.00 C ATOM 205 CG PRO A 17 -9.587 -3.782 15.049 1.00 0.00 C ATOM 206 CD PRO A 17 -10.292 -2.772 14.187 1.00 0.00 C ATOM 0 HA PRO A 17 -8.387 -0.836 15.989 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -7.960 -3.547 16.421 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -9.450 -2.782 16.938 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -8.914 -4.400 14.455 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -10.301 -4.454 15.525 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.380 -3.115 13.156 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -11.303 -2.574 14.544 1.00 0.00 H new ATOM 214 N SER A 18 -6.041 -2.036 15.660 1.00 0.00 N ATOM 215 CA SER A 18 -4.649 -2.176 15.248 1.00 0.00 C ATOM 216 C SER A 18 -4.334 -3.622 14.878 1.00 0.00 C ATOM 217 O SER A 18 -3.381 -3.895 14.150 1.00 0.00 O ATOM 218 CB SER A 18 -3.714 -1.708 16.365 1.00 0.00 C ATOM 219 OG SER A 18 -2.378 -1.607 15.903 1.00 0.00 O ATOM 0 H SER A 18 -6.191 -2.097 16.667 1.00 0.00 H new ATOM 0 HA SER A 18 -4.493 -1.552 14.368 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.046 -0.740 16.740 1.00 0.00 H new ATOM 0 HB3 SER A 18 -3.761 -2.407 17.200 1.00 0.00 H new ATOM 0 HG SER A 18 -1.801 -1.305 16.635 1.00 0.00 H new ATOM 225 N ASN A 19 -5.143 -4.546 15.387 1.00 0.00 N ATOM 226 CA ASN A 19 -4.952 -5.965 15.112 1.00 0.00 C ATOM 227 C ASN A 19 -6.275 -6.720 15.201 1.00 0.00 C ATOM 228 O ASN A 19 -6.800 -6.947 16.290 1.00 0.00 O ATOM 229 CB ASN A 19 -3.943 -6.565 16.094 1.00 0.00 C ATOM 230 CG ASN A 19 -4.515 -6.717 17.490 1.00 0.00 C ATOM 231 OD1 ASN A 19 -5.142 -5.799 18.019 1.00 0.00 O ATOM 232 ND2 ASN A 19 -4.302 -7.881 18.093 1.00 0.00 N ATOM 0 H ASN A 19 -5.937 -4.337 15.992 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.565 -6.064 14.098 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.620 -7.540 15.729 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -3.058 -5.930 16.134 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -4.664 -8.042 19.033 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -3.777 -8.614 17.616 1.00 0.00 H new ATOM 239 N ALA A 20 -6.808 -7.106 14.046 1.00 0.00 N ATOM 240 CA ALA A 20 -8.068 -7.837 13.993 1.00 0.00 C ATOM 241 C ALA A 20 -7.831 -9.323 13.742 1.00 0.00 C ATOM 242 O ALA A 20 -6.741 -9.727 13.337 1.00 0.00 O ATOM 243 CB ALA A 20 -8.971 -7.256 12.916 1.00 0.00 C ATOM 0 H ALA A 20 -6.387 -6.925 13.135 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.560 -7.732 14.960 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.908 -7.812 12.888 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.177 -6.209 13.139 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -8.476 -7.330 11.948 1.00 0.00 H new ATOM 249 N ALA A 21 -8.857 -10.131 13.987 1.00 0.00 N ATOM 250 CA ALA A 21 -8.760 -11.571 13.786 1.00 0.00 C ATOM 251 C ALA A 21 -9.352 -11.979 12.441 1.00 0.00 C ATOM 252 O ALA A 21 -10.242 -11.310 11.916 1.00 0.00 O ATOM 253 CB ALA A 21 -9.458 -12.310 14.918 1.00 0.00 C ATOM 0 H ALA A 21 -9.765 -9.813 14.325 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.704 -11.843 13.786 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -9.378 -13.385 14.755 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.987 -12.051 15.866 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.510 -12.025 14.945 1.00 0.00 H new ATOM 259 N GLU A 22 -8.851 -13.080 11.888 1.00 0.00 N ATOM 260 CA GLU A 22 -9.330 -13.574 10.603 1.00 0.00 C ATOM 261 C GLU A 22 -10.850 -13.468 10.512 1.00 0.00 C ATOM 262 O GLU A 22 -11.570 -13.944 11.389 1.00 0.00 O ATOM 263 CB GLU A 22 -8.896 -15.027 10.397 1.00 0.00 C ATOM 264 CG GLU A 22 -7.480 -15.169 9.863 1.00 0.00 C ATOM 265 CD GLU A 22 -7.056 -16.617 9.713 1.00 0.00 C ATOM 266 OE1 GLU A 22 -7.253 -17.394 10.671 1.00 0.00 O ATOM 267 OE2 GLU A 22 -6.527 -16.973 8.640 1.00 0.00 O ATOM 0 H GLU A 22 -8.114 -13.646 12.310 1.00 0.00 H new ATOM 0 HA GLU A 22 -8.892 -12.957 9.819 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -8.973 -15.558 11.346 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -9.586 -15.509 9.705 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.409 -14.671 8.896 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.789 -14.660 10.535 1.00 0.00 H new ATOM 274 N GLY A 23 -11.330 -12.840 9.443 1.00 0.00 N ATOM 275 CA GLY A 23 -12.761 -12.682 9.256 1.00 0.00 C ATOM 276 C GLY A 23 -13.271 -11.355 9.783 1.00 0.00 C ATOM 277 O GLY A 23 -14.411 -10.971 9.521 1.00 0.00 O ATOM 0 H GLY A 23 -10.754 -12.438 8.703 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.997 -12.763 8.195 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.282 -13.495 9.761 1.00 0.00 H new ATOM 281 N LYS A 24 -12.426 -10.652 10.530 1.00 0.00 N ATOM 282 CA LYS A 24 -12.796 -9.361 11.096 1.00 0.00 C ATOM 283 C LYS A 24 -12.552 -8.237 10.093 1.00 0.00 C ATOM 284 O LYS A 24 -11.972 -8.457 9.030 1.00 0.00 O ATOM 285 CB LYS A 24 -12.003 -9.096 12.378 1.00 0.00 C ATOM 286 CG LYS A 24 -12.402 -9.995 13.535 1.00 0.00 C ATOM 287 CD LYS A 24 -13.715 -9.552 14.158 1.00 0.00 C ATOM 288 CE LYS A 24 -14.137 -10.480 15.288 1.00 0.00 C ATOM 289 NZ LYS A 24 -13.221 -10.380 16.458 1.00 0.00 N ATOM 0 H LYS A 24 -11.479 -10.956 10.757 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.859 -9.388 11.333 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.941 -9.231 12.173 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -12.141 -8.056 12.672 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.493 -11.023 13.184 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -11.618 -9.985 14.292 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -13.614 -8.536 14.539 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -14.492 -9.530 13.394 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -15.152 -10.235 15.599 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -14.154 -11.508 14.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.606 -10.935 17.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -12.285 -10.750 16.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -13.132 -9.384 16.745 1.00 0.00 H new ATOM 303 N GLU A 25 -12.996 -7.033 10.440 1.00 0.00 N ATOM 304 CA GLU A 25 -12.824 -5.876 9.570 1.00 0.00 C ATOM 305 C GLU A 25 -11.892 -4.850 10.207 1.00 0.00 C ATOM 306 O GLU A 25 -11.904 -4.654 11.423 1.00 0.00 O ATOM 307 CB GLU A 25 -14.179 -5.232 9.267 1.00 0.00 C ATOM 308 CG GLU A 25 -15.291 -6.239 9.024 1.00 0.00 C ATOM 309 CD GLU A 25 -16.639 -5.579 8.812 1.00 0.00 C ATOM 310 OE1 GLU A 25 -16.672 -4.347 8.612 1.00 0.00 O ATOM 311 OE2 GLU A 25 -17.662 -6.295 8.845 1.00 0.00 O ATOM 0 H GLU A 25 -13.477 -6.834 11.317 1.00 0.00 H new ATOM 0 HA GLU A 25 -12.376 -6.218 8.637 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -14.460 -4.587 10.100 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -14.080 -4.594 8.389 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -15.045 -6.843 8.151 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -15.353 -6.918 9.874 1.00 0.00 H new ATOM 318 N VAL A 26 -11.085 -4.197 9.378 1.00 0.00 N ATOM 319 CA VAL A 26 -10.146 -3.190 9.859 1.00 0.00 C ATOM 320 C VAL A 26 -10.374 -1.851 9.166 1.00 0.00 C ATOM 321 O VAL A 26 -10.391 -1.770 7.937 1.00 0.00 O ATOM 322 CB VAL A 26 -8.687 -3.630 9.634 1.00 0.00 C ATOM 323 CG1 VAL A 26 -7.726 -2.539 10.080 1.00 0.00 C ATOM 324 CG2 VAL A 26 -8.405 -4.933 10.368 1.00 0.00 C ATOM 0 H VAL A 26 -11.062 -4.347 8.369 1.00 0.00 H new ATOM 0 HA VAL A 26 -10.323 -3.077 10.929 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.537 -3.800 8.568 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.700 -2.867 9.914 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.914 -1.632 9.506 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.874 -2.335 11.140 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.370 -5.230 10.198 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.572 -4.792 11.436 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.071 -5.712 9.996 1.00 0.00 H new ATOM 334 N LEU A 27 -10.547 -0.802 9.962 1.00 0.00 N ATOM 335 CA LEU A 27 -10.773 0.536 9.426 1.00 0.00 C ATOM 336 C LEU A 27 -9.501 1.375 9.501 1.00 0.00 C ATOM 337 O LEU A 27 -9.095 1.810 10.580 1.00 0.00 O ATOM 338 CB LEU A 27 -11.901 1.230 10.191 1.00 0.00 C ATOM 339 CG LEU A 27 -12.013 2.742 9.997 1.00 0.00 C ATOM 340 CD1 LEU A 27 -12.927 3.065 8.826 1.00 0.00 C ATOM 341 CD2 LEU A 27 -12.519 3.407 11.269 1.00 0.00 C ATOM 0 H LEU A 27 -10.535 -0.852 10.981 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.060 0.437 8.379 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -12.847 0.775 9.896 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.769 1.029 11.254 1.00 0.00 H new ATOM 0 HG LEU A 27 -11.020 3.134 9.775 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.994 4.146 8.704 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.523 2.621 7.916 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.920 2.659 9.017 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.592 4.483 11.112 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -13.502 3.009 11.521 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -11.825 3.206 12.085 1.00 0.00 H new ATOM 353 N LEU A 28 -8.878 1.601 8.350 1.00 0.00 N ATOM 354 CA LEU A 28 -7.653 2.390 8.284 1.00 0.00 C ATOM 355 C LEU A 28 -7.969 3.881 8.226 1.00 0.00 C ATOM 356 O LEU A 28 -8.232 4.429 7.154 1.00 0.00 O ATOM 357 CB LEU A 28 -6.826 1.984 7.064 1.00 0.00 C ATOM 358 CG LEU A 28 -6.338 0.535 7.036 1.00 0.00 C ATOM 359 CD1 LEU A 28 -5.795 0.181 5.660 1.00 0.00 C ATOM 360 CD2 LEU A 28 -5.278 0.309 8.104 1.00 0.00 C ATOM 0 H LEU A 28 -9.201 1.249 7.449 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.075 2.195 9.187 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.423 2.163 6.170 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -5.958 2.640 7.004 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.185 -0.118 7.249 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.452 -0.854 5.659 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.582 0.303 4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.961 0.839 5.418 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.942 -0.727 8.070 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.431 0.971 7.922 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.700 0.521 9.086 1.00 0.00 H new ATOM 372 N LEU A 29 -7.939 4.533 9.383 1.00 0.00 N ATOM 373 CA LEU A 29 -8.220 5.962 9.463 1.00 0.00 C ATOM 374 C LEU A 29 -7.058 6.778 8.903 1.00 0.00 C ATOM 375 O LEU A 29 -5.919 6.313 8.869 1.00 0.00 O ATOM 376 CB LEU A 29 -8.490 6.368 10.913 1.00 0.00 C ATOM 377 CG LEU A 29 -9.948 6.294 11.370 1.00 0.00 C ATOM 378 CD1 LEU A 29 -10.046 6.494 12.874 1.00 0.00 C ATOM 379 CD2 LEU A 29 -10.789 7.329 10.637 1.00 0.00 C ATOM 0 H LEU A 29 -7.723 4.095 10.278 1.00 0.00 H new ATOM 0 HA LEU A 29 -9.107 6.167 8.863 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -7.893 5.731 11.565 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -8.137 7.389 11.055 1.00 0.00 H new ATOM 0 HG LEU A 29 -10.335 5.304 11.130 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.090 6.438 13.181 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.476 5.716 13.382 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.642 7.471 13.138 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -11.823 7.262 10.974 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -10.403 8.326 10.847 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -10.744 7.141 9.564 1.00 0.00 H new ATOM 391 N VAL A 30 -7.355 7.998 8.466 1.00 0.00 N ATOM 392 CA VAL A 30 -6.336 8.880 7.911 1.00 0.00 C ATOM 393 C VAL A 30 -6.382 10.255 8.567 1.00 0.00 C ATOM 394 O VAL A 30 -7.443 10.874 8.662 1.00 0.00 O ATOM 395 CB VAL A 30 -6.504 9.043 6.389 1.00 0.00 C ATOM 396 CG1 VAL A 30 -5.185 9.447 5.746 1.00 0.00 C ATOM 397 CG2 VAL A 30 -7.036 7.759 5.771 1.00 0.00 C ATOM 0 H VAL A 30 -8.293 8.398 8.486 1.00 0.00 H new ATOM 0 HA VAL A 30 -5.371 8.416 8.115 1.00 0.00 H new ATOM 0 HB VAL A 30 -7.229 9.836 6.204 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.323 9.557 4.670 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.850 10.394 6.168 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.436 8.679 5.938 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.149 7.892 4.695 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.337 6.945 5.965 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -8.004 7.518 6.210 1.00 0.00 H new ATOM 407 N HIS A 31 -5.225 10.729 9.019 1.00 0.00 N ATOM 408 CA HIS A 31 -5.133 12.033 9.666 1.00 0.00 C ATOM 409 C HIS A 31 -4.347 13.014 8.801 1.00 0.00 C ATOM 410 O HIS A 31 -3.862 12.659 7.727 1.00 0.00 O ATOM 411 CB HIS A 31 -4.471 11.900 11.037 1.00 0.00 C ATOM 412 CG HIS A 31 -4.956 10.721 11.824 1.00 0.00 C ATOM 413 ND1 HIS A 31 -6.285 10.514 12.128 1.00 0.00 N ATOM 414 CD2 HIS A 31 -4.281 9.682 12.369 1.00 0.00 C ATOM 415 CE1 HIS A 31 -6.406 9.400 12.828 1.00 0.00 C ATOM 416 NE2 HIS A 31 -5.204 8.876 12.987 1.00 0.00 N ATOM 0 H HIS A 31 -4.338 10.230 8.949 1.00 0.00 H new ATOM 0 HA HIS A 31 -6.144 12.419 9.795 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -3.392 11.819 10.904 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -4.654 12.809 11.610 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -7.054 11.125 11.855 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -3.214 9.518 12.326 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -7.330 8.988 13.206 1.00 0.00 H new ATOM 425 N ASN A 32 -4.226 14.249 9.277 1.00 0.00 N ATOM 426 CA ASN A 32 -3.499 15.281 8.547 1.00 0.00 C ATOM 427 C ASN A 32 -3.915 15.304 7.079 1.00 0.00 C ATOM 428 O ASN A 32 -3.146 15.720 6.211 1.00 0.00 O ATOM 429 CB ASN A 32 -1.991 15.048 8.658 1.00 0.00 C ATOM 430 CG ASN A 32 -1.502 15.101 10.092 1.00 0.00 C ATOM 431 OD1 ASN A 32 -1.834 16.021 10.839 1.00 0.00 O ATOM 432 ND2 ASN A 32 -0.707 14.111 10.483 1.00 0.00 N ATOM 0 H ASN A 32 -4.622 14.559 10.164 1.00 0.00 H new ATOM 0 HA ASN A 32 -3.744 16.246 8.991 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -1.744 14.077 8.228 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.466 15.800 8.070 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -0.346 14.093 11.437 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -0.458 13.369 9.829 1.00 0.00 H new ATOM 439 N LEU A 33 -5.136 14.856 6.809 1.00 0.00 N ATOM 440 CA LEU A 33 -5.656 14.826 5.446 1.00 0.00 C ATOM 441 C LEU A 33 -5.478 16.179 4.765 1.00 0.00 C ATOM 442 O LEU A 33 -5.288 17.208 5.414 1.00 0.00 O ATOM 443 CB LEU A 33 -7.135 14.435 5.452 1.00 0.00 C ATOM 444 CG LEU A 33 -7.433 12.937 5.393 1.00 0.00 C ATOM 445 CD1 LEU A 33 -8.909 12.676 5.652 1.00 0.00 C ATOM 446 CD2 LEU A 33 -7.016 12.362 4.047 1.00 0.00 C ATOM 0 H LEU A 33 -5.785 14.509 7.515 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.092 14.081 4.885 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.594 14.841 6.353 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.621 14.915 4.603 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.855 12.440 6.172 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -9.103 11.604 5.606 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.177 13.051 6.640 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.507 13.185 4.896 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -7.236 11.295 4.023 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -7.566 12.863 3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.947 12.516 3.901 1.00 0.00 H new ATOM 458 N PRO A 34 -5.544 16.181 3.426 1.00 0.00 N ATOM 459 CA PRO A 34 -5.396 17.401 2.627 1.00 0.00 C ATOM 460 C PRO A 34 -6.583 18.344 2.784 1.00 0.00 C ATOM 461 O PRO A 34 -7.622 17.964 3.324 1.00 0.00 O ATOM 462 CB PRO A 34 -5.314 16.878 1.191 1.00 0.00 C ATOM 463 CG PRO A 34 -6.027 15.570 1.224 1.00 0.00 C ATOM 464 CD PRO A 34 -5.768 14.991 2.587 1.00 0.00 C ATOM 0 HA PRO A 34 -4.527 17.985 2.932 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -5.785 17.568 0.491 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -4.279 16.757 0.872 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -7.095 15.704 1.053 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -5.660 14.906 0.442 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.615 14.403 2.941 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -4.900 14.331 2.585 1.00 0.00 H new ATOM 472 N GLN A 35 -6.423 19.575 2.309 1.00 0.00 N ATOM 473 CA GLN A 35 -7.483 20.572 2.397 1.00 0.00 C ATOM 474 C GLN A 35 -8.580 20.292 1.375 1.00 0.00 C ATOM 475 O GLN A 35 -9.767 20.444 1.666 1.00 0.00 O ATOM 476 CB GLN A 35 -6.913 21.975 2.180 1.00 0.00 C ATOM 477 CG GLN A 35 -5.899 22.051 1.050 1.00 0.00 C ATOM 478 CD GLN A 35 -4.487 21.748 1.512 1.00 0.00 C ATOM 479 OE1 GLN A 35 -3.947 20.620 1.066 1.00 0.00 O flip ATOM 480 NE2 GLN A 35 -3.888 22.520 2.261 1.00 0.00 N flip ATOM 0 H GLN A 35 -5.569 19.906 1.859 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.918 20.515 3.395 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -7.732 22.662 1.969 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -6.442 22.314 3.103 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -6.180 21.347 0.267 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -5.927 23.047 0.608 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -4.342 23.376 2.580 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -2.938 22.303 2.563 1.00 0.00 H new ATOM 489 N ASP A 36 -8.176 19.884 0.178 1.00 0.00 N ATOM 490 CA ASP A 36 -9.124 19.583 -0.888 1.00 0.00 C ATOM 491 C ASP A 36 -8.759 18.277 -1.587 1.00 0.00 C ATOM 492 O ASP A 36 -8.073 18.262 -2.609 1.00 0.00 O ATOM 493 CB ASP A 36 -9.163 20.725 -1.904 1.00 0.00 C ATOM 494 CG ASP A 36 -10.508 20.840 -2.595 1.00 0.00 C ATOM 495 OD1 ASP A 36 -11.205 19.810 -2.711 1.00 0.00 O ATOM 496 OD2 ASP A 36 -10.863 21.959 -3.020 1.00 0.00 O ATOM 0 H ASP A 36 -7.198 19.754 -0.079 1.00 0.00 H new ATOM 0 HA ASP A 36 -10.112 19.472 -0.440 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -8.936 21.664 -1.400 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -8.386 20.569 -2.652 1.00 0.00 H new ATOM 501 N PRO A 37 -9.227 17.153 -1.024 1.00 0.00 N ATOM 502 CA PRO A 37 -8.962 15.821 -1.576 1.00 0.00 C ATOM 503 C PRO A 37 -9.694 15.583 -2.893 1.00 0.00 C ATOM 504 O PRO A 37 -10.854 15.171 -2.903 1.00 0.00 O ATOM 505 CB PRO A 37 -9.489 14.877 -0.493 1.00 0.00 C ATOM 506 CG PRO A 37 -10.524 15.669 0.229 1.00 0.00 C ATOM 507 CD PRO A 37 -10.052 17.096 0.195 1.00 0.00 C ATOM 0 HA PRO A 37 -7.907 15.678 -1.808 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.915 13.973 -0.929 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -8.691 14.562 0.180 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -11.497 15.568 -0.251 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -10.637 15.320 1.255 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -10.887 17.795 0.148 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.474 17.349 1.084 1.00 0.00 H new ATOM 515 N ARG A 38 -9.009 15.845 -4.001 1.00 0.00 N ATOM 516 CA ARG A 38 -9.595 15.659 -5.323 1.00 0.00 C ATOM 517 C ARG A 38 -10.073 14.222 -5.509 1.00 0.00 C ATOM 518 O ARG A 38 -11.040 13.966 -6.225 1.00 0.00 O ATOM 519 CB ARG A 38 -8.579 16.015 -6.409 1.00 0.00 C ATOM 520 CG ARG A 38 -9.211 16.546 -7.685 1.00 0.00 C ATOM 521 CD ARG A 38 -8.157 16.951 -8.703 1.00 0.00 C ATOM 522 NE ARG A 38 -8.736 17.200 -10.021 1.00 0.00 N ATOM 523 CZ ARG A 38 -8.021 17.254 -11.139 1.00 0.00 C ATOM 524 NH1 ARG A 38 -6.708 17.076 -11.100 1.00 0.00 N ATOM 525 NH2 ARG A 38 -8.620 17.485 -12.301 1.00 0.00 N ATOM 0 H ARG A 38 -8.048 16.187 -4.010 1.00 0.00 H new ATOM 0 HA ARG A 38 -10.455 16.323 -5.408 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -7.889 16.762 -6.018 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -7.989 15.130 -6.647 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -9.860 15.783 -8.115 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -9.840 17.404 -7.450 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -7.645 17.849 -8.357 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -7.406 16.165 -8.780 1.00 0.00 H new ATOM 0 HE ARG A 38 -9.744 17.340 -10.086 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -6.244 16.897 -10.210 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -6.162 17.118 -11.960 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -9.630 17.621 -12.336 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -8.070 17.526 -13.159 1.00 0.00 H new ATOM 539 N GLY A 39 -9.385 13.287 -4.861 1.00 0.00 N ATOM 540 CA GLY A 39 -9.754 11.887 -4.969 1.00 0.00 C ATOM 541 C GLY A 39 -8.792 10.976 -4.232 1.00 0.00 C ATOM 542 O GLY A 39 -7.585 11.221 -4.213 1.00 0.00 O ATOM 0 H GLY A 39 -8.579 13.473 -4.264 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -10.759 11.747 -4.571 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -9.785 11.603 -6.021 1.00 0.00 H new ATOM 546 N TYR A 40 -9.326 9.924 -3.622 1.00 0.00 N ATOM 547 CA TYR A 40 -8.506 8.975 -2.877 1.00 0.00 C ATOM 548 C TYR A 40 -8.151 7.768 -3.739 1.00 0.00 C ATOM 549 O TYR A 40 -8.893 7.400 -4.648 1.00 0.00 O ATOM 550 CB TYR A 40 -9.240 8.517 -1.616 1.00 0.00 C ATOM 551 CG TYR A 40 -9.852 9.651 -0.825 1.00 0.00 C ATOM 552 CD1 TYR A 40 -9.076 10.718 -0.388 1.00 0.00 C ATOM 553 CD2 TYR A 40 -11.206 9.657 -0.515 1.00 0.00 C ATOM 554 CE1 TYR A 40 -9.631 11.756 0.335 1.00 0.00 C ATOM 555 CE2 TYR A 40 -11.770 10.691 0.207 1.00 0.00 C ATOM 556 CZ TYR A 40 -10.978 11.738 0.630 1.00 0.00 C ATOM 557 OH TYR A 40 -11.534 12.771 1.349 1.00 0.00 O ATOM 0 H TYR A 40 -10.323 9.706 -3.628 1.00 0.00 H new ATOM 0 HA TYR A 40 -7.582 9.478 -2.590 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -10.026 7.816 -1.898 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -8.543 7.974 -0.977 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -8.021 10.736 -0.618 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.829 8.839 -0.844 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -9.013 12.577 0.667 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.825 10.680 0.439 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.317 12.444 1.839 1.00 0.00 H new ATOM 567 N ASN A 41 -7.008 7.155 -3.445 1.00 0.00 N ATOM 568 CA ASN A 41 -6.552 5.989 -4.192 1.00 0.00 C ATOM 569 C ASN A 41 -5.749 5.049 -3.297 1.00 0.00 C ATOM 570 O ASN A 41 -4.644 5.379 -2.868 1.00 0.00 O ATOM 571 CB ASN A 41 -5.702 6.423 -5.387 1.00 0.00 C ATOM 572 CG ASN A 41 -6.544 6.925 -6.544 1.00 0.00 C ATOM 573 OD1 ASN A 41 -7.417 6.215 -7.044 1.00 0.00 O ATOM 574 ND2 ASN A 41 -6.285 8.154 -6.976 1.00 0.00 N ATOM 0 H ASN A 41 -6.381 7.447 -2.695 1.00 0.00 H new ATOM 0 HA ASN A 41 -7.430 5.455 -4.554 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -5.014 7.209 -5.074 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -5.094 5.582 -5.721 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -6.819 8.545 -7.752 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -5.552 8.707 -6.532 1.00 0.00 H new ATOM 581 N TRP A 42 -6.313 3.879 -3.021 1.00 0.00 N ATOM 582 CA TRP A 42 -5.649 2.891 -2.178 1.00 0.00 C ATOM 583 C TRP A 42 -4.908 1.863 -3.024 1.00 0.00 C ATOM 584 O TRP A 42 -5.229 1.663 -4.196 1.00 0.00 O ATOM 585 CB TRP A 42 -6.669 2.190 -1.279 1.00 0.00 C ATOM 586 CG TRP A 42 -7.120 3.032 -0.123 1.00 0.00 C ATOM 587 CD1 TRP A 42 -8.174 3.900 -0.103 1.00 0.00 C ATOM 588 CD2 TRP A 42 -6.527 3.086 1.180 1.00 0.00 C ATOM 589 NE1 TRP A 42 -8.273 4.491 1.134 1.00 0.00 N ATOM 590 CE2 TRP A 42 -7.275 4.008 1.939 1.00 0.00 C ATOM 591 CE3 TRP A 42 -5.440 2.445 1.779 1.00 0.00 C ATOM 592 CZ2 TRP A 42 -6.968 4.302 3.264 1.00 0.00 C ATOM 593 CZ3 TRP A 42 -5.136 2.739 3.095 1.00 0.00 C ATOM 594 CH2 TRP A 42 -5.898 3.660 3.826 1.00 0.00 C ATOM 0 H TRP A 42 -7.228 3.591 -3.368 1.00 0.00 H new ATOM 0 HA TRP A 42 -4.922 3.412 -1.554 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -7.537 1.910 -1.876 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -6.233 1.266 -0.898 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -8.833 4.094 -0.937 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -8.976 5.178 1.408 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.848 1.733 1.224 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -7.554 5.012 3.829 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -4.297 2.250 3.568 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.636 3.867 4.853 1.00 0.00 H new ATOM 605 N TYR A 43 -3.917 1.213 -2.425 1.00 0.00 N ATOM 606 CA TYR A 43 -3.129 0.206 -3.125 1.00 0.00 C ATOM 607 C TYR A 43 -2.684 -0.898 -2.171 1.00 0.00 C ATOM 608 O TYR A 43 -2.829 -0.781 -0.955 1.00 0.00 O ATOM 609 CB TYR A 43 -1.907 0.851 -3.782 1.00 0.00 C ATOM 610 CG TYR A 43 -2.250 2.004 -4.697 1.00 0.00 C ATOM 611 CD1 TYR A 43 -2.386 3.295 -4.200 1.00 0.00 C ATOM 612 CD2 TYR A 43 -2.439 1.805 -6.059 1.00 0.00 C ATOM 613 CE1 TYR A 43 -2.700 4.352 -5.032 1.00 0.00 C ATOM 614 CE2 TYR A 43 -2.751 2.856 -6.899 1.00 0.00 C ATOM 615 CZ TYR A 43 -2.881 4.128 -6.381 1.00 0.00 C ATOM 616 OH TYR A 43 -3.194 5.177 -7.214 1.00 0.00 O ATOM 0 H TYR A 43 -3.640 1.366 -1.455 1.00 0.00 H new ATOM 0 HA TYR A 43 -3.757 -0.238 -3.897 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -1.231 1.204 -3.004 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -1.369 0.093 -4.352 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -2.244 3.475 -3.145 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -2.340 0.810 -6.468 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -2.803 5.348 -4.628 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -2.892 2.683 -7.956 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.286 4.849 -8.133 1.00 0.00 H new ATOM 626 N LYS A 44 -2.140 -1.973 -2.733 1.00 0.00 N ATOM 627 CA LYS A 44 -1.671 -3.099 -1.935 1.00 0.00 C ATOM 628 C LYS A 44 -0.147 -3.173 -1.941 1.00 0.00 C ATOM 629 O LYS A 44 0.462 -3.555 -2.939 1.00 0.00 O ATOM 630 CB LYS A 44 -2.257 -4.408 -2.470 1.00 0.00 C ATOM 631 CG LYS A 44 -2.237 -5.541 -1.458 1.00 0.00 C ATOM 632 CD LYS A 44 -3.391 -6.505 -1.678 1.00 0.00 C ATOM 633 CE LYS A 44 -3.122 -7.437 -2.850 1.00 0.00 C ATOM 634 NZ LYS A 44 -4.213 -8.435 -3.027 1.00 0.00 N ATOM 0 H LYS A 44 -2.013 -2.087 -3.739 1.00 0.00 H new ATOM 0 HA LYS A 44 -2.006 -2.950 -0.909 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -3.285 -4.233 -2.787 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.698 -4.712 -3.355 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -1.292 -6.080 -1.532 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.292 -5.131 -0.450 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.553 -7.092 -0.774 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.307 -5.943 -1.861 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.014 -6.851 -3.763 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -2.177 -7.956 -2.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.992 -9.051 -3.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.299 -9.011 -2.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -5.111 -7.940 -3.204 1.00 0.00 H new ATOM 648 N GLY A 45 0.463 -2.804 -0.818 1.00 0.00 N ATOM 649 CA GLY A 45 1.910 -2.837 -0.715 1.00 0.00 C ATOM 650 C GLY A 45 2.502 -1.472 -0.426 1.00 0.00 C ATOM 651 O GLY A 45 1.876 -0.645 0.236 1.00 0.00 O ATOM 0 H GLY A 45 -0.019 -2.483 0.022 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.199 -3.530 0.075 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.329 -3.222 -1.645 1.00 0.00 H new ATOM 655 N GLU A 46 3.712 -1.236 -0.922 1.00 0.00 N ATOM 656 CA GLU A 46 4.389 0.038 -0.710 1.00 0.00 C ATOM 657 C GLU A 46 4.635 0.751 -2.037 1.00 0.00 C ATOM 658 O GLU A 46 5.683 1.363 -2.242 1.00 0.00 O ATOM 659 CB GLU A 46 5.717 -0.179 0.018 1.00 0.00 C ATOM 660 CG GLU A 46 5.555 -0.670 1.447 1.00 0.00 C ATOM 661 CD GLU A 46 6.873 -1.078 2.077 1.00 0.00 C ATOM 662 OE1 GLU A 46 7.796 -1.459 1.328 1.00 0.00 O ATOM 663 OE2 GLU A 46 6.980 -1.016 3.319 1.00 0.00 O ATOM 0 H GLU A 46 4.244 -1.910 -1.473 1.00 0.00 H new ATOM 0 HA GLU A 46 3.744 0.665 -0.094 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.314 -0.901 -0.540 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.275 0.757 0.026 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.098 0.116 2.048 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.872 -1.519 1.460 1.00 0.00 H new ATOM 670 N THR A 47 3.660 0.666 -2.937 1.00 0.00 N ATOM 671 CA THR A 47 3.769 1.300 -4.245 1.00 0.00 C ATOM 672 C THR A 47 2.407 1.765 -4.746 1.00 0.00 C ATOM 673 O THR A 47 1.386 1.129 -4.481 1.00 0.00 O ATOM 674 CB THR A 47 4.387 0.345 -5.283 1.00 0.00 C ATOM 675 OG1 THR A 47 3.706 -0.914 -5.256 1.00 0.00 O ATOM 676 CG2 THR A 47 5.868 0.132 -5.008 1.00 0.00 C ATOM 0 H THR A 47 2.786 0.164 -2.784 1.00 0.00 H new ATOM 0 HA THR A 47 4.422 2.164 -4.123 1.00 0.00 H new ATOM 0 HB THR A 47 4.278 0.796 -6.269 1.00 0.00 H new ATOM 0 HG1 THR A 47 4.104 -1.515 -5.920 1.00 0.00 H new ATOM 0 HG21 THR A 47 6.283 -0.546 -5.754 1.00 0.00 H new ATOM 0 HG22 THR A 47 6.389 1.088 -5.058 1.00 0.00 H new ATOM 0 HG23 THR A 47 5.995 -0.299 -4.015 1.00 0.00 H new ATOM 684 N VAL A 48 2.397 2.878 -5.473 1.00 0.00 N ATOM 685 CA VAL A 48 1.159 3.427 -6.014 1.00 0.00 C ATOM 686 C VAL A 48 0.999 3.074 -7.488 1.00 0.00 C ATOM 687 O VAL A 48 0.939 3.957 -8.345 1.00 0.00 O ATOM 688 CB VAL A 48 1.107 4.958 -5.855 1.00 0.00 C ATOM 689 CG1 VAL A 48 -0.154 5.519 -6.493 1.00 0.00 C ATOM 690 CG2 VAL A 48 1.188 5.344 -4.385 1.00 0.00 C ATOM 0 H VAL A 48 3.232 3.417 -5.701 1.00 0.00 H new ATOM 0 HA VAL A 48 0.341 2.983 -5.446 1.00 0.00 H new ATOM 0 HB VAL A 48 1.967 5.388 -6.368 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.173 6.602 -6.370 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.165 5.274 -7.555 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.030 5.084 -6.011 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.150 6.429 -4.291 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.349 4.904 -3.846 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.123 4.976 -3.963 1.00 0.00 H new ATOM 700 N ASP A 49 0.931 1.780 -7.777 1.00 0.00 N ATOM 701 CA ASP A 49 0.777 1.309 -9.149 1.00 0.00 C ATOM 702 C ASP A 49 -0.639 0.798 -9.392 1.00 0.00 C ATOM 703 O ASP A 49 -1.203 0.085 -8.562 1.00 0.00 O ATOM 704 CB ASP A 49 1.790 0.204 -9.449 1.00 0.00 C ATOM 705 CG ASP A 49 2.201 0.175 -10.908 1.00 0.00 C ATOM 706 OD1 ASP A 49 1.335 -0.108 -11.763 1.00 0.00 O ATOM 707 OD2 ASP A 49 3.388 0.435 -11.195 1.00 0.00 O ATOM 0 H ASP A 49 0.980 1.037 -7.080 1.00 0.00 H new ATOM 0 HA ASP A 49 0.960 2.150 -9.818 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.674 0.348 -8.828 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.362 -0.761 -9.176 1.00 0.00 H new ATOM 712 N ALA A 50 -1.209 1.168 -10.534 1.00 0.00 N ATOM 713 CA ALA A 50 -2.559 0.745 -10.887 1.00 0.00 C ATOM 714 C ALA A 50 -2.723 -0.762 -10.723 1.00 0.00 C ATOM 715 O ALA A 50 -3.752 -1.235 -10.243 1.00 0.00 O ATOM 716 CB ALA A 50 -2.887 1.162 -12.313 1.00 0.00 C ATOM 0 H ALA A 50 -0.757 1.760 -11.231 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.256 1.236 -10.208 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -3.898 0.840 -12.563 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -2.820 2.247 -12.399 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -2.178 0.699 -13.000 1.00 0.00 H new ATOM 722 N ASN A 51 -1.701 -1.511 -11.126 1.00 0.00 N ATOM 723 CA ASN A 51 -1.734 -2.965 -11.024 1.00 0.00 C ATOM 724 C ASN A 51 -2.054 -3.404 -9.599 1.00 0.00 C ATOM 725 O ASN A 51 -2.821 -4.344 -9.386 1.00 0.00 O ATOM 726 CB ASN A 51 -0.393 -3.558 -11.463 1.00 0.00 C ATOM 727 CG ASN A 51 -0.047 -3.207 -12.897 1.00 0.00 C ATOM 728 OD1 ASN A 51 -0.911 -2.797 -13.673 1.00 0.00 O ATOM 729 ND2 ASN A 51 1.221 -3.367 -13.256 1.00 0.00 N ATOM 0 H ASN A 51 -0.841 -1.135 -11.526 1.00 0.00 H new ATOM 0 HA ASN A 51 -2.520 -3.333 -11.683 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.395 -3.195 -10.803 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -0.426 -4.642 -11.355 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.513 -3.147 -14.208 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.903 -3.710 -12.580 1.00 0.00 H new ATOM 736 N ARG A 52 -1.463 -2.718 -8.627 1.00 0.00 N ATOM 737 CA ARG A 52 -1.685 -3.037 -7.222 1.00 0.00 C ATOM 738 C ARG A 52 -2.689 -2.072 -6.597 1.00 0.00 C ATOM 739 O ARG A 52 -2.690 -1.862 -5.384 1.00 0.00 O ATOM 740 CB ARG A 52 -0.365 -2.986 -6.450 1.00 0.00 C ATOM 741 CG ARG A 52 0.732 -3.843 -7.063 1.00 0.00 C ATOM 742 CD ARG A 52 0.676 -5.272 -6.546 1.00 0.00 C ATOM 743 NE ARG A 52 1.526 -6.169 -7.324 1.00 0.00 N ATOM 744 CZ ARG A 52 1.183 -6.661 -8.509 1.00 0.00 C ATOM 745 NH1 ARG A 52 0.014 -6.345 -9.050 1.00 0.00 N ATOM 746 NH2 ARG A 52 2.011 -7.472 -9.157 1.00 0.00 N ATOM 0 H ARG A 52 -0.826 -1.937 -8.787 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.093 -4.046 -7.165 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.022 -1.952 -6.401 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.540 -3.313 -5.425 1.00 0.00 H new ATOM 0 HG2 ARG A 52 0.631 -3.843 -8.148 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.705 -3.409 -6.833 1.00 0.00 H new ATOM 0 HD2 ARG A 52 0.988 -5.292 -5.502 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -0.353 -5.629 -6.578 1.00 0.00 H new ATOM 0 HE ARG A 52 2.432 -6.432 -6.936 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -0.625 -5.722 -8.556 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -0.246 -6.725 -9.960 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.911 -7.717 -8.745 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.747 -7.850 -10.067 1.00 0.00 H new ATOM 760 N ARG A 53 -3.540 -1.489 -7.434 1.00 0.00 N ATOM 761 CA ARG A 53 -4.548 -0.546 -6.964 1.00 0.00 C ATOM 762 C ARG A 53 -5.803 -1.278 -6.499 1.00 0.00 C ATOM 763 O ARG A 53 -6.491 -1.919 -7.294 1.00 0.00 O ATOM 764 CB ARG A 53 -4.905 0.446 -8.073 1.00 0.00 C ATOM 765 CG ARG A 53 -5.977 1.446 -7.674 1.00 0.00 C ATOM 766 CD ARG A 53 -6.635 2.075 -8.892 1.00 0.00 C ATOM 767 NE ARG A 53 -5.877 3.219 -9.394 1.00 0.00 N ATOM 768 CZ ARG A 53 -6.349 4.076 -10.291 1.00 0.00 C ATOM 769 NH1 ARG A 53 -7.571 3.921 -10.783 1.00 0.00 N ATOM 770 NH2 ARG A 53 -5.599 5.093 -10.698 1.00 0.00 N ATOM 0 H ARG A 53 -3.552 -1.653 -8.441 1.00 0.00 H new ATOM 0 HA ARG A 53 -4.132 -0.000 -6.117 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -4.006 0.988 -8.367 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -5.244 -0.108 -8.948 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -6.733 0.947 -7.068 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -5.535 2.226 -7.054 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.728 1.328 -9.680 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.645 2.394 -8.634 1.00 0.00 H new ATOM 0 HE ARG A 53 -4.934 3.367 -9.036 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.151 3.142 -10.472 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.931 4.581 -11.472 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -4.659 5.216 -10.321 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -5.963 5.751 -11.387 1.00 0.00 H new ATOM 784 N ILE A 54 -6.095 -1.178 -5.206 1.00 0.00 N ATOM 785 CA ILE A 54 -7.267 -1.830 -4.636 1.00 0.00 C ATOM 786 C ILE A 54 -8.554 -1.182 -5.135 1.00 0.00 C ATOM 787 O ILE A 54 -9.417 -1.851 -5.705 1.00 0.00 O ATOM 788 CB ILE A 54 -7.245 -1.781 -3.097 1.00 0.00 C ATOM 789 CG1 ILE A 54 -6.002 -2.495 -2.560 1.00 0.00 C ATOM 790 CG2 ILE A 54 -8.509 -2.408 -2.529 1.00 0.00 C ATOM 791 CD1 ILE A 54 -5.737 -2.227 -1.095 1.00 0.00 C ATOM 0 H ILE A 54 -5.536 -0.652 -4.534 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.238 -2.871 -4.959 1.00 0.00 H new ATOM 0 HB ILE A 54 -7.207 -0.738 -2.782 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.116 -3.569 -2.710 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -5.134 -2.183 -3.141 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.479 -2.366 -1.440 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -9.380 -1.861 -2.889 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.575 -3.448 -2.850 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.842 -2.765 -0.783 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.590 -1.158 -0.941 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -6.588 -2.565 -0.504 1.00 0.00 H new ATOM 803 N ILE A 55 -8.675 0.123 -4.919 1.00 0.00 N ATOM 804 CA ILE A 55 -9.855 0.862 -5.350 1.00 0.00 C ATOM 805 C ILE A 55 -9.608 2.366 -5.310 1.00 0.00 C ATOM 806 O ILE A 55 -8.870 2.862 -4.459 1.00 0.00 O ATOM 807 CB ILE A 55 -11.078 0.531 -4.474 1.00 0.00 C ATOM 808 CG1 ILE A 55 -12.367 0.972 -5.170 1.00 0.00 C ATOM 809 CG2 ILE A 55 -10.950 1.198 -3.112 1.00 0.00 C ATOM 810 CD1 ILE A 55 -13.570 0.132 -4.803 1.00 0.00 C ATOM 0 H ILE A 55 -7.970 0.691 -4.448 1.00 0.00 H new ATOM 0 HA ILE A 55 -10.060 0.557 -6.376 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.119 -0.548 -4.326 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.570 2.013 -4.916 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.220 0.930 -6.249 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -11.822 0.955 -2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.049 0.839 -2.614 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.887 2.279 -3.241 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -14.448 0.502 -5.333 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -13.388 -0.906 -5.082 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -13.743 0.194 -3.729 1.00 0.00 H new ATOM 822 N GLY A 56 -10.231 3.088 -6.236 1.00 0.00 N ATOM 823 CA GLY A 56 -10.067 4.529 -6.288 1.00 0.00 C ATOM 824 C GLY A 56 -11.393 5.262 -6.344 1.00 0.00 C ATOM 825 O GLY A 56 -12.332 4.811 -6.999 1.00 0.00 O ATOM 0 H GLY A 56 -10.846 2.701 -6.951 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -9.509 4.860 -5.412 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.472 4.793 -7.163 1.00 0.00 H new ATOM 829 N TYR A 57 -11.470 6.395 -5.654 1.00 0.00 N ATOM 830 CA TYR A 57 -12.692 7.189 -5.625 1.00 0.00 C ATOM 831 C TYR A 57 -12.391 8.662 -5.887 1.00 0.00 C ATOM 832 O TYR A 57 -11.376 9.191 -5.433 1.00 0.00 O ATOM 833 CB TYR A 57 -13.395 7.034 -4.275 1.00 0.00 C ATOM 834 CG TYR A 57 -14.487 8.052 -4.040 1.00 0.00 C ATOM 835 CD1 TYR A 57 -15.676 8.003 -4.757 1.00 0.00 C ATOM 836 CD2 TYR A 57 -14.330 9.064 -3.101 1.00 0.00 C ATOM 837 CE1 TYR A 57 -16.677 8.932 -4.546 1.00 0.00 C ATOM 838 CE2 TYR A 57 -15.326 9.997 -2.882 1.00 0.00 C ATOM 839 CZ TYR A 57 -16.497 9.927 -3.607 1.00 0.00 C ATOM 840 OH TYR A 57 -17.491 10.854 -3.393 1.00 0.00 O ATOM 0 H TYR A 57 -10.701 6.783 -5.108 1.00 0.00 H new ATOM 0 HA TYR A 57 -13.350 6.825 -6.414 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -13.823 6.034 -4.211 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -12.656 7.116 -3.478 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -15.820 7.225 -5.492 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -13.414 9.123 -2.532 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -17.595 8.880 -5.113 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -15.188 10.776 -2.147 1.00 0.00 H new ATOM 0 HH TYR A 57 -17.206 11.485 -2.699 1.00 0.00 H new ATOM 850 N VAL A 58 -13.282 9.319 -6.623 1.00 0.00 N ATOM 851 CA VAL A 58 -13.114 10.731 -6.945 1.00 0.00 C ATOM 852 C VAL A 58 -14.246 11.567 -6.360 1.00 0.00 C ATOM 853 O VAL A 58 -15.409 11.403 -6.731 1.00 0.00 O ATOM 854 CB VAL A 58 -13.059 10.957 -8.468 1.00 0.00 C ATOM 855 CG1 VAL A 58 -12.702 12.402 -8.782 1.00 0.00 C ATOM 856 CG2 VAL A 58 -12.065 10.002 -9.112 1.00 0.00 C ATOM 0 H VAL A 58 -14.127 8.896 -7.007 1.00 0.00 H new ATOM 0 HA VAL A 58 -12.168 11.045 -6.504 1.00 0.00 H new ATOM 0 HB VAL A 58 -14.046 10.754 -8.884 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -12.668 12.542 -9.862 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -13.455 13.064 -8.354 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -11.727 12.637 -8.355 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -12.039 10.175 -10.188 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.073 10.172 -8.693 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.370 8.974 -8.917 1.00 0.00 H new ATOM 866 N ILE A 59 -13.899 12.464 -5.443 1.00 0.00 N ATOM 867 CA ILE A 59 -14.886 13.327 -4.806 1.00 0.00 C ATOM 868 C ILE A 59 -15.390 14.392 -5.774 1.00 0.00 C ATOM 869 O ILE A 59 -16.440 14.997 -5.556 1.00 0.00 O ATOM 870 CB ILE A 59 -14.309 14.017 -3.556 1.00 0.00 C ATOM 871 CG1 ILE A 59 -13.895 12.974 -2.517 1.00 0.00 C ATOM 872 CG2 ILE A 59 -15.325 14.984 -2.968 1.00 0.00 C ATOM 873 CD1 ILE A 59 -12.735 13.412 -1.650 1.00 0.00 C ATOM 0 H ILE A 59 -12.941 12.612 -5.125 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.717 12.688 -4.506 1.00 0.00 H new ATOM 0 HB ILE A 59 -13.424 14.583 -3.847 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -14.750 12.749 -1.879 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -13.627 12.050 -3.029 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -14.902 15.464 -2.085 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -15.576 15.743 -3.709 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -16.226 14.439 -2.688 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -12.496 12.623 -0.937 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -11.866 13.609 -2.278 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -13.006 14.319 -1.110 1.00 0.00 H new ATOM 885 N SER A 60 -14.636 14.615 -6.845 1.00 0.00 N ATOM 886 CA SER A 60 -15.004 15.609 -7.847 1.00 0.00 C ATOM 887 C SER A 60 -16.184 15.125 -8.684 1.00 0.00 C ATOM 888 O SER A 60 -16.999 15.922 -9.147 1.00 0.00 O ATOM 889 CB SER A 60 -13.812 15.916 -8.755 1.00 0.00 C ATOM 890 OG SER A 60 -13.789 15.050 -9.876 1.00 0.00 O ATOM 0 H SER A 60 -13.766 14.121 -7.042 1.00 0.00 H new ATOM 0 HA SER A 60 -15.299 16.520 -7.327 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.865 16.951 -9.092 1.00 0.00 H new ATOM 0 HB3 SER A 60 -12.885 15.811 -8.191 1.00 0.00 H new ATOM 0 HG SER A 60 -13.019 15.268 -10.442 1.00 0.00 H new ATOM 896 N ASN A 61 -16.268 13.812 -8.873 1.00 0.00 N ATOM 897 CA ASN A 61 -17.348 13.220 -9.655 1.00 0.00 C ATOM 898 C ASN A 61 -17.966 12.035 -8.919 1.00 0.00 C ATOM 899 O ASN A 61 -18.734 11.267 -9.496 1.00 0.00 O ATOM 900 CB ASN A 61 -16.828 12.771 -11.022 1.00 0.00 C ATOM 901 CG ASN A 61 -17.848 11.949 -11.787 1.00 0.00 C ATOM 902 OD1 ASN A 61 -19.019 12.320 -11.876 1.00 0.00 O ATOM 903 ND2 ASN A 61 -17.407 10.827 -12.343 1.00 0.00 N ATOM 0 H ASN A 61 -15.602 13.138 -8.496 1.00 0.00 H new ATOM 0 HA ASN A 61 -18.118 13.978 -9.798 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -16.557 13.648 -11.610 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -15.920 12.184 -10.887 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -18.047 10.233 -12.870 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -16.428 10.559 -12.243 1.00 0.00 H new ATOM 910 N GLN A 62 -17.625 11.896 -7.642 1.00 0.00 N ATOM 911 CA GLN A 62 -18.146 10.805 -6.827 1.00 0.00 C ATOM 912 C GLN A 62 -18.194 9.505 -7.624 1.00 0.00 C ATOM 913 O GLN A 62 -19.201 8.799 -7.616 1.00 0.00 O ATOM 914 CB GLN A 62 -19.543 11.150 -6.309 1.00 0.00 C ATOM 915 CG GLN A 62 -19.584 12.415 -5.466 1.00 0.00 C ATOM 916 CD GLN A 62 -20.779 12.457 -4.535 1.00 0.00 C ATOM 917 OE1 GLN A 62 -20.786 11.814 -3.484 1.00 0.00 O ATOM 918 NE2 GLN A 62 -21.800 13.217 -4.915 1.00 0.00 N ATOM 0 H GLN A 62 -16.991 12.525 -7.150 1.00 0.00 H new ATOM 0 HA GLN A 62 -17.475 10.666 -5.979 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -20.217 11.267 -7.157 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -19.918 10.316 -5.716 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -18.668 12.486 -4.879 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -19.609 13.284 -6.123 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -21.752 13.733 -5.794 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -22.632 13.285 -4.328 1.00 0.00 H new ATOM 927 N GLN A 63 -17.098 9.197 -8.310 1.00 0.00 N ATOM 928 CA GLN A 63 -17.016 7.983 -9.113 1.00 0.00 C ATOM 929 C GLN A 63 -16.184 6.918 -8.406 1.00 0.00 C ATOM 930 O GLN A 63 -15.217 7.232 -7.711 1.00 0.00 O ATOM 931 CB GLN A 63 -16.412 8.292 -10.484 1.00 0.00 C ATOM 932 CG GLN A 63 -15.945 7.056 -11.236 1.00 0.00 C ATOM 933 CD GLN A 63 -14.501 6.703 -10.940 1.00 0.00 C ATOM 934 OE1 GLN A 63 -14.177 6.224 -9.853 1.00 0.00 O ATOM 935 NE2 GLN A 63 -13.623 6.940 -11.908 1.00 0.00 N ATOM 0 H GLN A 63 -16.255 9.771 -8.326 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.027 7.598 -9.248 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -17.152 8.816 -11.088 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -15.568 8.969 -10.355 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -16.583 6.212 -10.972 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -16.062 7.221 -12.307 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.935 7.338 -12.794 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -12.636 6.724 -11.766 1.00 0.00 H new ATOM 944 N ILE A 64 -16.566 5.658 -8.587 1.00 0.00 N ATOM 945 CA ILE A 64 -15.854 4.548 -7.967 1.00 0.00 C ATOM 946 C ILE A 64 -15.317 3.583 -9.019 1.00 0.00 C ATOM 947 O ILE A 64 -16.053 3.128 -9.894 1.00 0.00 O ATOM 948 CB ILE A 64 -16.760 3.773 -6.991 1.00 0.00 C ATOM 949 CG1 ILE A 64 -17.298 4.710 -5.908 1.00 0.00 C ATOM 950 CG2 ILE A 64 -15.997 2.615 -6.367 1.00 0.00 C ATOM 951 CD1 ILE A 64 -16.343 4.909 -4.752 1.00 0.00 C ATOM 0 H ILE A 64 -17.365 5.381 -9.158 1.00 0.00 H new ATOM 0 HA ILE A 64 -15.020 4.978 -7.413 1.00 0.00 H new ATOM 0 HB ILE A 64 -17.606 3.367 -7.546 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -17.521 5.679 -6.355 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -18.238 4.310 -5.527 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -16.650 2.077 -5.680 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -15.658 1.938 -7.151 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -15.135 2.999 -5.822 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -16.790 5.584 -4.023 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -16.139 3.948 -4.279 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -15.411 5.338 -5.120 1.00 0.00 H new ATOM 963 N THR A 65 -14.027 3.274 -8.926 1.00 0.00 N ATOM 964 CA THR A 65 -13.390 2.363 -9.868 1.00 0.00 C ATOM 965 C THR A 65 -12.594 1.286 -9.140 1.00 0.00 C ATOM 966 O THR A 65 -11.460 1.501 -8.711 1.00 0.00 O ATOM 967 CB THR A 65 -12.452 3.115 -10.831 1.00 0.00 C ATOM 968 OG1 THR A 65 -13.155 4.196 -11.454 1.00 0.00 O ATOM 969 CG2 THR A 65 -11.904 2.178 -11.896 1.00 0.00 C ATOM 0 H THR A 65 -13.403 3.642 -8.207 1.00 0.00 H new ATOM 0 HA THR A 65 -14.189 1.894 -10.442 1.00 0.00 H new ATOM 0 HB THR A 65 -11.616 3.510 -10.254 1.00 0.00 H new ATOM 0 HG1 THR A 65 -12.607 4.569 -12.176 1.00 0.00 H new ATOM 0 HG21 THR A 65 -11.244 2.732 -12.564 1.00 0.00 H new ATOM 0 HG22 THR A 65 -11.345 1.373 -11.419 1.00 0.00 H new ATOM 0 HG23 THR A 65 -12.730 1.756 -12.469 1.00 0.00 H new ATOM 977 N PRO A 66 -13.199 0.097 -8.996 1.00 0.00 N ATOM 978 CA PRO A 66 -12.564 -1.038 -8.320 1.00 0.00 C ATOM 979 C PRO A 66 -11.404 -1.616 -9.123 1.00 0.00 C ATOM 980 O PRO A 66 -11.545 -1.913 -10.309 1.00 0.00 O ATOM 981 CB PRO A 66 -13.697 -2.061 -8.204 1.00 0.00 C ATOM 982 CG PRO A 66 -14.628 -1.722 -9.316 1.00 0.00 C ATOM 983 CD PRO A 66 -14.550 -0.230 -9.482 1.00 0.00 C ATOM 0 HA PRO A 66 -12.131 -0.751 -7.362 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.322 -3.080 -8.299 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -14.194 -1.993 -7.236 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -14.340 -2.232 -10.235 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -15.645 -2.036 -9.082 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.686 0.066 -10.522 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -15.320 0.280 -8.903 1.00 0.00 H new ATOM 991 N GLY A 67 -10.257 -1.773 -8.470 1.00 0.00 N ATOM 992 CA GLY A 67 -9.089 -2.315 -9.140 1.00 0.00 C ATOM 993 C GLY A 67 -9.033 -3.828 -9.072 1.00 0.00 C ATOM 994 O GLY A 67 -9.975 -4.487 -8.631 1.00 0.00 O ATOM 0 H GLY A 67 -10.115 -1.534 -7.488 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -9.094 -2.001 -10.184 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -8.189 -1.900 -8.687 1.00 0.00 H new ATOM 998 N PRO A 68 -7.906 -4.403 -9.519 1.00 0.00 N ATOM 999 CA PRO A 68 -7.704 -5.855 -9.519 1.00 0.00 C ATOM 1000 C PRO A 68 -7.549 -6.418 -8.111 1.00 0.00 C ATOM 1001 O PRO A 68 -7.927 -7.559 -7.843 1.00 0.00 O ATOM 1002 CB PRO A 68 -6.407 -6.032 -10.312 1.00 0.00 C ATOM 1003 CG PRO A 68 -5.682 -4.742 -10.146 1.00 0.00 C ATOM 1004 CD PRO A 68 -6.743 -3.679 -10.058 1.00 0.00 C ATOM 0 HA PRO A 68 -8.556 -6.386 -9.945 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.820 -6.868 -9.930 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -6.611 -6.239 -11.363 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -5.066 -4.754 -9.247 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -5.014 -4.558 -10.988 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -6.440 -2.862 -9.404 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -6.958 -3.243 -11.034 1.00 0.00 H new ATOM 1012 N ALA A 69 -6.992 -5.612 -7.214 1.00 0.00 N ATOM 1013 CA ALA A 69 -6.789 -6.030 -5.832 1.00 0.00 C ATOM 1014 C ALA A 69 -8.054 -5.823 -5.005 1.00 0.00 C ATOM 1015 O ALA A 69 -7.985 -5.542 -3.808 1.00 0.00 O ATOM 1016 CB ALA A 69 -5.623 -5.270 -5.216 1.00 0.00 C ATOM 0 H ALA A 69 -6.673 -4.665 -7.419 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.555 -7.095 -5.831 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.483 -5.592 -4.184 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.716 -5.472 -5.785 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -5.834 -4.201 -5.237 1.00 0.00 H new ATOM 1022 N TYR A 70 -9.206 -5.962 -5.650 1.00 0.00 N ATOM 1023 CA TYR A 70 -10.486 -5.786 -4.975 1.00 0.00 C ATOM 1024 C TYR A 70 -11.223 -7.117 -4.851 1.00 0.00 C ATOM 1025 O TYR A 70 -11.426 -7.821 -5.839 1.00 0.00 O ATOM 1026 CB TYR A 70 -11.353 -4.779 -5.732 1.00 0.00 C ATOM 1027 CG TYR A 70 -12.616 -4.393 -4.996 1.00 0.00 C ATOM 1028 CD1 TYR A 70 -12.604 -4.170 -3.624 1.00 0.00 C ATOM 1029 CD2 TYR A 70 -13.821 -4.248 -5.672 1.00 0.00 C ATOM 1030 CE1 TYR A 70 -13.755 -3.818 -2.948 1.00 0.00 C ATOM 1031 CE2 TYR A 70 -14.977 -3.895 -5.004 1.00 0.00 C ATOM 1032 CZ TYR A 70 -14.939 -3.681 -3.642 1.00 0.00 C ATOM 1033 OH TYR A 70 -16.088 -3.328 -2.972 1.00 0.00 O ATOM 0 H TYR A 70 -9.280 -6.196 -6.640 1.00 0.00 H new ATOM 0 HA TYR A 70 -10.290 -5.404 -3.973 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -10.767 -3.881 -5.926 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -11.621 -5.200 -6.701 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -11.678 -4.274 -3.078 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -13.854 -4.414 -6.739 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -13.728 -3.651 -1.881 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -15.905 -3.787 -5.545 1.00 0.00 H new ATOM 0 HH TYR A 70 -15.853 -2.901 -2.122 1.00 0.00 H new ATOM 1043 N SER A 71 -11.622 -7.453 -3.628 1.00 0.00 N ATOM 1044 CA SER A 71 -12.334 -8.700 -3.372 1.00 0.00 C ATOM 1045 C SER A 71 -13.739 -8.424 -2.844 1.00 0.00 C ATOM 1046 O SER A 71 -14.334 -9.261 -2.166 1.00 0.00 O ATOM 1047 CB SER A 71 -11.559 -9.558 -2.370 1.00 0.00 C ATOM 1048 OG SER A 71 -10.623 -10.393 -3.030 1.00 0.00 O ATOM 0 H SER A 71 -11.464 -6.879 -2.799 1.00 0.00 H new ATOM 0 HA SER A 71 -12.418 -9.242 -4.314 1.00 0.00 H new ATOM 0 HB2 SER A 71 -11.040 -8.914 -1.660 1.00 0.00 H new ATOM 0 HB3 SER A 71 -12.255 -10.169 -1.795 1.00 0.00 H new ATOM 0 HG SER A 71 -10.140 -10.930 -2.368 1.00 0.00 H new ATOM 1054 N ASN A 72 -14.262 -7.244 -3.160 1.00 0.00 N ATOM 1055 CA ASN A 72 -15.596 -6.857 -2.717 1.00 0.00 C ATOM 1056 C ASN A 72 -15.689 -6.867 -1.194 1.00 0.00 C ATOM 1057 O ASN A 72 -16.677 -7.331 -0.625 1.00 0.00 O ATOM 1058 CB ASN A 72 -16.646 -7.799 -3.309 1.00 0.00 C ATOM 1059 CG ASN A 72 -16.745 -7.681 -4.817 1.00 0.00 C ATOM 1060 OD1 ASN A 72 -16.982 -6.598 -5.352 1.00 0.00 O ATOM 1061 ND2 ASN A 72 -16.563 -8.799 -5.511 1.00 0.00 N ATOM 0 H ASN A 72 -13.783 -6.540 -3.721 1.00 0.00 H new ATOM 0 HA ASN A 72 -15.788 -5.843 -3.068 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -16.399 -8.827 -3.043 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -17.617 -7.580 -2.866 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -16.618 -8.782 -6.529 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -16.369 -9.675 -5.025 1.00 0.00 H new ATOM 1068 N ARG A 73 -14.652 -6.351 -0.541 1.00 0.00 N ATOM 1069 CA ARG A 73 -14.616 -6.301 0.916 1.00 0.00 C ATOM 1070 C ARG A 73 -14.179 -4.922 1.402 1.00 0.00 C ATOM 1071 O ARG A 73 -14.648 -4.440 2.432 1.00 0.00 O ATOM 1072 CB ARG A 73 -13.666 -7.370 1.460 1.00 0.00 C ATOM 1073 CG ARG A 73 -12.416 -7.560 0.618 1.00 0.00 C ATOM 1074 CD ARG A 73 -11.668 -8.826 1.008 1.00 0.00 C ATOM 1075 NE ARG A 73 -10.229 -8.699 0.794 1.00 0.00 N ATOM 1076 CZ ARG A 73 -9.341 -9.586 1.229 1.00 0.00 C ATOM 1077 NH1 ARG A 73 -9.742 -10.658 1.898 1.00 0.00 N ATOM 1078 NH2 ARG A 73 -8.048 -9.401 0.994 1.00 0.00 N ATOM 0 H ARG A 73 -13.827 -5.962 -0.997 1.00 0.00 H new ATOM 0 HA ARG A 73 -15.622 -6.496 1.287 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -13.373 -7.101 2.475 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.199 -8.319 1.523 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -12.690 -7.608 -0.436 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -11.761 -6.697 0.738 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.860 -9.052 2.057 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -12.048 -9.666 0.426 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.887 -7.885 0.283 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.735 -10.804 2.080 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -9.058 -11.337 2.231 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -7.736 -8.578 0.479 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.366 -10.082 1.328 1.00 0.00 H new ATOM 1092 N GLU A 74 -13.278 -4.295 0.653 1.00 0.00 N ATOM 1093 CA GLU A 74 -12.777 -2.972 1.009 1.00 0.00 C ATOM 1094 C GLU A 74 -13.764 -1.886 0.589 1.00 0.00 C ATOM 1095 O GLU A 74 -14.428 -1.999 -0.442 1.00 0.00 O ATOM 1096 CB GLU A 74 -11.418 -2.723 0.352 1.00 0.00 C ATOM 1097 CG GLU A 74 -10.282 -3.506 0.989 1.00 0.00 C ATOM 1098 CD GLU A 74 -10.089 -4.872 0.358 1.00 0.00 C ATOM 1099 OE1 GLU A 74 -10.645 -5.102 -0.737 1.00 0.00 O ATOM 1100 OE2 GLU A 74 -9.384 -5.709 0.958 1.00 0.00 O ATOM 0 H GLU A 74 -12.880 -4.681 -0.203 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.661 -2.935 2.092 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.481 -2.985 -0.704 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.188 -1.659 0.404 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.358 -2.935 0.900 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.481 -3.627 2.054 1.00 0.00 H new ATOM 1107 N THR A 75 -13.854 -0.833 1.395 1.00 0.00 N ATOM 1108 CA THR A 75 -14.759 0.273 1.109 1.00 0.00 C ATOM 1109 C THR A 75 -14.127 1.610 1.477 1.00 0.00 C ATOM 1110 O THR A 75 -13.802 1.855 2.640 1.00 0.00 O ATOM 1111 CB THR A 75 -16.090 0.121 1.870 1.00 0.00 C ATOM 1112 OG1 THR A 75 -16.744 -1.091 1.476 1.00 0.00 O ATOM 1113 CG2 THR A 75 -17.004 1.307 1.604 1.00 0.00 C ATOM 0 H THR A 75 -13.311 -0.723 2.251 1.00 0.00 H new ATOM 0 HA THR A 75 -14.957 0.250 0.037 1.00 0.00 H new ATOM 0 HB THR A 75 -15.871 0.084 2.937 1.00 0.00 H new ATOM 0 HG1 THR A 75 -17.588 -1.181 1.965 1.00 0.00 H new ATOM 0 HG21 THR A 75 -17.937 1.177 2.152 1.00 0.00 H new ATOM 0 HG22 THR A 75 -16.515 2.224 1.933 1.00 0.00 H new ATOM 0 HG23 THR A 75 -17.216 1.371 0.537 1.00 0.00 H new ATOM 1121 N ILE A 76 -13.955 2.472 0.481 1.00 0.00 N ATOM 1122 CA ILE A 76 -13.363 3.786 0.701 1.00 0.00 C ATOM 1123 C ILE A 76 -14.257 4.651 1.583 1.00 0.00 C ATOM 1124 O ILE A 76 -15.419 4.321 1.820 1.00 0.00 O ATOM 1125 CB ILE A 76 -13.109 4.519 -0.629 1.00 0.00 C ATOM 1126 CG1 ILE A 76 -12.882 3.511 -1.757 1.00 0.00 C ATOM 1127 CG2 ILE A 76 -11.916 5.454 -0.499 1.00 0.00 C ATOM 1128 CD1 ILE A 76 -14.144 3.152 -2.510 1.00 0.00 C ATOM 0 H ILE A 76 -14.217 2.284 -0.487 1.00 0.00 H new ATOM 0 HA ILE A 76 -12.410 3.622 1.204 1.00 0.00 H new ATOM 0 HB ILE A 76 -13.989 5.115 -0.872 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.154 3.920 -2.458 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.447 2.603 -1.340 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.749 5.965 -1.447 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -12.114 6.190 0.280 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.029 4.878 -0.236 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -13.908 2.433 -3.295 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -14.866 2.713 -1.822 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -14.569 4.051 -2.957 1.00 0.00 H new ATOM 1140 N TYR A 77 -13.708 5.760 2.064 1.00 0.00 N ATOM 1141 CA TYR A 77 -14.455 6.674 2.921 1.00 0.00 C ATOM 1142 C TYR A 77 -14.204 8.124 2.520 1.00 0.00 C ATOM 1143 O TYR A 77 -13.232 8.447 1.836 1.00 0.00 O ATOM 1144 CB TYR A 77 -14.069 6.463 4.386 1.00 0.00 C ATOM 1145 CG TYR A 77 -14.895 5.406 5.084 1.00 0.00 C ATOM 1146 CD1 TYR A 77 -14.769 4.064 4.747 1.00 0.00 C ATOM 1147 CD2 TYR A 77 -15.800 5.750 6.080 1.00 0.00 C ATOM 1148 CE1 TYR A 77 -15.523 3.096 5.382 1.00 0.00 C ATOM 1149 CE2 TYR A 77 -16.556 4.788 6.721 1.00 0.00 C ATOM 1150 CZ TYR A 77 -16.414 3.462 6.368 1.00 0.00 C ATOM 1151 OH TYR A 77 -17.165 2.500 7.004 1.00 0.00 O ATOM 0 H TYR A 77 -12.748 6.049 1.875 1.00 0.00 H new ATOM 0 HA TYR A 77 -15.517 6.461 2.798 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -13.017 6.183 4.439 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -14.175 7.407 4.921 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -14.071 3.773 3.976 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -15.914 6.787 6.358 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -15.415 2.057 5.107 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -17.254 5.072 7.494 1.00 0.00 H new ATOM 0 HH TYR A 77 -17.742 2.925 7.673 1.00 0.00 H new ATOM 1161 N PRO A 78 -15.101 9.021 2.957 1.00 0.00 N ATOM 1162 CA PRO A 78 -14.999 10.453 2.658 1.00 0.00 C ATOM 1163 C PRO A 78 -13.835 11.116 3.387 1.00 0.00 C ATOM 1164 O PRO A 78 -13.639 12.326 3.290 1.00 0.00 O ATOM 1165 CB PRO A 78 -16.332 11.015 3.156 1.00 0.00 C ATOM 1166 CG PRO A 78 -16.776 10.060 4.210 1.00 0.00 C ATOM 1167 CD PRO A 78 -16.283 8.707 3.776 1.00 0.00 C ATOM 0 HA PRO A 78 -14.812 10.636 1.600 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -16.212 12.021 3.558 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -17.061 11.080 2.348 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -16.364 10.332 5.182 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -17.861 10.066 4.310 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -16.025 8.080 4.630 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -17.038 8.169 3.202 1.00 0.00 H new ATOM 1175 N ASN A 79 -13.066 10.314 4.116 1.00 0.00 N ATOM 1176 CA ASN A 79 -11.921 10.824 4.862 1.00 0.00 C ATOM 1177 C ASN A 79 -10.628 10.162 4.394 1.00 0.00 C ATOM 1178 O ASN A 79 -9.604 10.229 5.073 1.00 0.00 O ATOM 1179 CB ASN A 79 -12.115 10.586 6.361 1.00 0.00 C ATOM 1180 CG ASN A 79 -13.365 11.259 6.896 1.00 0.00 C ATOM 1181 OD1 ASN A 79 -14.148 11.831 6.138 1.00 0.00 O ATOM 1182 ND2 ASN A 79 -13.555 11.195 8.208 1.00 0.00 N ATOM 0 H ASN A 79 -13.215 9.309 4.206 1.00 0.00 H new ATOM 0 HA ASN A 79 -11.847 11.896 4.678 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -12.173 9.514 6.552 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.245 10.959 6.901 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -14.377 11.631 8.626 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -12.879 10.710 8.798 1.00 0.00 H new ATOM 1189 N ALA A 80 -10.685 9.523 3.230 1.00 0.00 N ATOM 1190 CA ALA A 80 -9.519 8.852 2.670 1.00 0.00 C ATOM 1191 C ALA A 80 -9.207 7.567 3.430 1.00 0.00 C ATOM 1192 O ALA A 80 -8.066 7.106 3.447 1.00 0.00 O ATOM 1193 CB ALA A 80 -8.315 9.782 2.686 1.00 0.00 C ATOM 0 H ALA A 80 -11.526 9.456 2.657 1.00 0.00 H new ATOM 0 HA ALA A 80 -9.745 8.587 1.637 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.452 9.267 2.265 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.533 10.670 2.092 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.096 10.077 3.712 1.00 0.00 H new ATOM 1199 N SER A 81 -10.229 6.994 4.059 1.00 0.00 N ATOM 1200 CA SER A 81 -10.062 5.765 4.825 1.00 0.00 C ATOM 1201 C SER A 81 -10.544 4.558 4.027 1.00 0.00 C ATOM 1202 O SER A 81 -11.290 4.697 3.057 1.00 0.00 O ATOM 1203 CB SER A 81 -10.828 5.855 6.147 1.00 0.00 C ATOM 1204 OG SER A 81 -10.741 7.157 6.699 1.00 0.00 O ATOM 0 H SER A 81 -11.181 7.361 4.053 1.00 0.00 H new ATOM 0 HA SER A 81 -9.000 5.639 5.036 1.00 0.00 H new ATOM 0 HB2 SER A 81 -11.874 5.595 5.983 1.00 0.00 H new ATOM 0 HB3 SER A 81 -10.426 5.129 6.854 1.00 0.00 H new ATOM 0 HG SER A 81 -11.364 7.236 7.451 1.00 0.00 H new ATOM 1210 N LEU A 82 -10.111 3.372 4.441 1.00 0.00 N ATOM 1211 CA LEU A 82 -10.498 2.138 3.765 1.00 0.00 C ATOM 1212 C LEU A 82 -10.886 1.063 4.775 1.00 0.00 C ATOM 1213 O LEU A 82 -10.060 0.617 5.573 1.00 0.00 O ATOM 1214 CB LEU A 82 -9.352 1.636 2.884 1.00 0.00 C ATOM 1215 CG LEU A 82 -9.654 0.406 2.028 1.00 0.00 C ATOM 1216 CD1 LEU A 82 -10.200 0.821 0.671 1.00 0.00 C ATOM 1217 CD2 LEU A 82 -8.406 -0.449 1.864 1.00 0.00 C ATOM 0 H LEU A 82 -9.492 3.239 5.241 1.00 0.00 H new ATOM 0 HA LEU A 82 -11.364 2.351 3.138 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.046 2.447 2.224 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.500 1.408 3.525 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.413 -0.189 2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -10.409 -0.068 0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.119 1.391 0.807 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -9.464 1.438 0.156 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.640 -1.320 1.252 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -7.625 0.136 1.379 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.058 -0.777 2.844 1.00 0.00 H new ATOM 1229 N LEU A 83 -12.148 0.649 4.734 1.00 0.00 N ATOM 1230 CA LEU A 83 -12.646 -0.377 5.644 1.00 0.00 C ATOM 1231 C LEU A 83 -12.481 -1.768 5.040 1.00 0.00 C ATOM 1232 O LEU A 83 -13.237 -2.164 4.154 1.00 0.00 O ATOM 1233 CB LEU A 83 -14.119 -0.122 5.973 1.00 0.00 C ATOM 1234 CG LEU A 83 -14.853 -1.259 6.685 1.00 0.00 C ATOM 1235 CD1 LEU A 83 -14.432 -1.336 8.144 1.00 0.00 C ATOM 1236 CD2 LEU A 83 -16.360 -1.074 6.571 1.00 0.00 C ATOM 0 H LEU A 83 -12.845 1.008 4.081 1.00 0.00 H new ATOM 0 HA LEU A 83 -12.061 -0.329 6.562 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -14.183 0.771 6.595 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -14.645 0.098 5.044 1.00 0.00 H new ATOM 0 HG LEU A 83 -14.584 -2.198 6.202 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -14.965 -2.151 8.634 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -13.359 -1.516 8.204 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -14.670 -0.396 8.642 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -16.867 -1.892 7.083 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -16.646 -0.127 7.028 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -16.648 -1.071 5.520 1.00 0.00 H new ATOM 1248 N MET A 84 -11.489 -2.505 5.528 1.00 0.00 N ATOM 1249 CA MET A 84 -11.228 -3.854 5.039 1.00 0.00 C ATOM 1250 C MET A 84 -12.160 -4.863 5.702 1.00 0.00 C ATOM 1251 O MET A 84 -12.331 -4.856 6.921 1.00 0.00 O ATOM 1252 CB MET A 84 -9.771 -4.240 5.299 1.00 0.00 C ATOM 1253 CG MET A 84 -9.207 -5.210 4.273 1.00 0.00 C ATOM 1254 SD MET A 84 -7.430 -5.016 4.038 1.00 0.00 S ATOM 1255 CE MET A 84 -7.370 -3.434 3.199 1.00 0.00 C ATOM 0 H MET A 84 -10.853 -2.191 6.261 1.00 0.00 H new ATOM 0 HA MET A 84 -11.414 -3.867 3.965 1.00 0.00 H new ATOM 0 HB2 MET A 84 -9.160 -3.337 5.307 1.00 0.00 H new ATOM 0 HB3 MET A 84 -9.693 -4.687 6.290 1.00 0.00 H new ATOM 0 HG2 MET A 84 -9.418 -6.231 4.590 1.00 0.00 H new ATOM 0 HG3 MET A 84 -9.714 -5.060 3.320 1.00 0.00 H new ATOM 0 HE1 MET A 84 -7.106 -3.587 2.153 1.00 0.00 H new ATOM 0 HE2 MET A 84 -8.346 -2.953 3.260 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.622 -2.799 3.673 1.00 0.00 H new ATOM 1265 N ARG A 85 -12.760 -5.729 4.892 1.00 0.00 N ATOM 1266 CA ARG A 85 -13.675 -6.743 5.400 1.00 0.00 C ATOM 1267 C ARG A 85 -13.162 -8.145 5.087 1.00 0.00 C ATOM 1268 O ARG A 85 -12.557 -8.376 4.041 1.00 0.00 O ATOM 1269 CB ARG A 85 -15.068 -6.552 4.797 1.00 0.00 C ATOM 1270 CG ARG A 85 -15.701 -5.213 5.138 1.00 0.00 C ATOM 1271 CD ARG A 85 -17.159 -5.160 4.708 1.00 0.00 C ATOM 1272 NE ARG A 85 -17.313 -5.361 3.270 1.00 0.00 N ATOM 1273 CZ ARG A 85 -18.428 -5.079 2.604 1.00 0.00 C ATOM 1274 NH1 ARG A 85 -19.479 -4.586 3.244 1.00 0.00 N ATOM 1275 NH2 ARG A 85 -18.491 -5.290 1.296 1.00 0.00 N ATOM 0 H ARG A 85 -12.629 -5.748 3.881 1.00 0.00 H new ATOM 0 HA ARG A 85 -13.736 -6.631 6.482 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -15.002 -6.647 3.713 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -15.719 -7.352 5.148 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -15.631 -5.039 6.212 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -15.147 -4.412 4.648 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -17.723 -5.924 5.243 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -17.584 -4.196 4.987 1.00 0.00 H new ATOM 0 HE ARG A 85 -16.522 -5.738 2.748 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -19.433 -4.422 4.250 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -20.334 -4.370 2.731 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -17.684 -5.669 0.801 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -19.347 -5.073 0.785 1.00 0.00 H new ATOM 1289 N ASN A 86 -13.407 -9.078 6.002 1.00 0.00 N ATOM 1290 CA ASN A 86 -12.969 -10.457 5.824 1.00 0.00 C ATOM 1291 C ASN A 86 -11.450 -10.533 5.693 1.00 0.00 C ATOM 1292 O ASN A 86 -10.926 -11.168 4.778 1.00 0.00 O ATOM 1293 CB ASN A 86 -13.630 -11.069 4.587 1.00 0.00 C ATOM 1294 CG ASN A 86 -15.142 -11.091 4.691 1.00 0.00 C ATOM 1295 OD1 ASN A 86 -15.719 -10.543 5.631 1.00 0.00 O ATOM 1296 ND2 ASN A 86 -15.792 -11.727 3.724 1.00 0.00 N ATOM 0 H ASN A 86 -13.907 -8.904 6.874 1.00 0.00 H new ATOM 0 HA ASN A 86 -13.269 -11.024 6.706 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -13.338 -10.501 3.704 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -13.263 -12.086 4.448 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -16.811 -11.776 3.741 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.273 -12.167 2.964 1.00 0.00 H new ATOM 1303 N VAL A 87 -10.749 -9.880 6.615 1.00 0.00 N ATOM 1304 CA VAL A 87 -9.291 -9.875 6.604 1.00 0.00 C ATOM 1305 C VAL A 87 -8.735 -11.286 6.755 1.00 0.00 C ATOM 1306 O VAL A 87 -9.478 -12.235 7.007 1.00 0.00 O ATOM 1307 CB VAL A 87 -8.725 -8.989 7.730 1.00 0.00 C ATOM 1308 CG1 VAL A 87 -9.116 -7.535 7.513 1.00 0.00 C ATOM 1309 CG2 VAL A 87 -9.204 -9.481 9.087 1.00 0.00 C ATOM 0 H VAL A 87 -11.167 -9.348 7.378 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.983 -9.468 5.641 1.00 0.00 H new ATOM 0 HB VAL A 87 -7.637 -9.055 7.708 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -8.707 -6.924 8.318 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.719 -7.190 6.558 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -10.202 -7.447 7.507 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.794 -8.843 9.870 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -10.293 -9.446 9.123 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -8.868 -10.507 9.241 1.00 0.00 H new ATOM 1319 N THR A 88 -7.421 -11.418 6.598 1.00 0.00 N ATOM 1320 CA THR A 88 -6.764 -12.714 6.716 1.00 0.00 C ATOM 1321 C THR A 88 -5.301 -12.554 7.111 1.00 0.00 C ATOM 1322 O THR A 88 -4.797 -11.437 7.224 1.00 0.00 O ATOM 1323 CB THR A 88 -6.845 -13.506 5.397 1.00 0.00 C ATOM 1324 OG1 THR A 88 -6.364 -12.703 4.313 1.00 0.00 O ATOM 1325 CG2 THR A 88 -8.274 -13.945 5.116 1.00 0.00 C ATOM 0 H THR A 88 -6.791 -10.643 6.389 1.00 0.00 H new ATOM 0 HA THR A 88 -7.289 -13.266 7.495 1.00 0.00 H new ATOM 0 HB THR A 88 -6.222 -14.395 5.494 1.00 0.00 H new ATOM 0 HG1 THR A 88 -6.417 -13.214 3.479 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.306 -14.502 4.180 1.00 0.00 H new ATOM 0 HG22 THR A 88 -8.626 -14.580 5.929 1.00 0.00 H new ATOM 0 HG23 THR A 88 -8.916 -13.067 5.038 1.00 0.00 H new ATOM 1333 N ARG A 89 -4.623 -13.678 7.320 1.00 0.00 N ATOM 1334 CA ARG A 89 -3.217 -13.662 7.704 1.00 0.00 C ATOM 1335 C ARG A 89 -2.348 -13.137 6.564 1.00 0.00 C ATOM 1336 O ARG A 89 -1.414 -12.369 6.786 1.00 0.00 O ATOM 1337 CB ARG A 89 -2.759 -15.067 8.102 1.00 0.00 C ATOM 1338 CG ARG A 89 -3.539 -15.653 9.268 1.00 0.00 C ATOM 1339 CD ARG A 89 -3.267 -17.141 9.428 1.00 0.00 C ATOM 1340 NE ARG A 89 -4.257 -17.790 10.282 1.00 0.00 N ATOM 1341 CZ ARG A 89 -4.485 -19.098 10.280 1.00 0.00 C ATOM 1342 NH1 ARG A 89 -3.796 -19.893 9.473 1.00 0.00 N ATOM 1343 NH2 ARG A 89 -5.404 -19.614 11.087 1.00 0.00 N ATOM 0 H ARG A 89 -5.025 -14.611 7.230 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.107 -12.995 8.559 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.856 -15.729 7.242 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -1.701 -15.035 8.363 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -3.269 -15.132 10.186 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -4.606 -15.492 9.112 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -3.267 -17.617 8.447 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.273 -17.284 9.852 1.00 0.00 H new ATOM 0 HE ARG A 89 -4.804 -17.207 10.915 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -3.089 -19.500 8.852 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -3.973 -20.898 9.473 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -5.936 -19.006 11.709 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.578 -20.619 11.085 1.00 0.00 H new ATOM 1357 N ASN A 90 -2.664 -13.558 5.344 1.00 0.00 N ATOM 1358 CA ASN A 90 -1.912 -13.132 4.169 1.00 0.00 C ATOM 1359 C ASN A 90 -2.023 -11.623 3.971 1.00 0.00 C ATOM 1360 O ASN A 90 -1.061 -10.967 3.570 1.00 0.00 O ATOM 1361 CB ASN A 90 -2.418 -13.859 2.922 1.00 0.00 C ATOM 1362 CG ASN A 90 -1.992 -13.172 1.639 1.00 0.00 C ATOM 1363 OD1 ASN A 90 -2.457 -12.076 1.325 1.00 0.00 O ATOM 1364 ND2 ASN A 90 -1.103 -13.815 0.890 1.00 0.00 N ATOM 0 H ASN A 90 -3.436 -14.194 5.143 1.00 0.00 H new ATOM 0 HA ASN A 90 -0.864 -13.385 4.328 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.043 -14.883 2.924 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -3.506 -13.918 2.955 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -0.779 -13.402 0.015 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -0.744 -14.722 1.189 1.00 0.00 H new ATOM 1371 N ASP A 91 -3.201 -11.079 4.255 1.00 0.00 N ATOM 1372 CA ASP A 91 -3.438 -9.648 4.110 1.00 0.00 C ATOM 1373 C ASP A 91 -2.322 -8.843 4.768 1.00 0.00 C ATOM 1374 O ASP A 91 -1.850 -7.848 4.216 1.00 0.00 O ATOM 1375 CB ASP A 91 -4.787 -9.267 4.723 1.00 0.00 C ATOM 1376 CG ASP A 91 -5.926 -9.375 3.728 1.00 0.00 C ATOM 1377 OD1 ASP A 91 -5.657 -9.311 2.510 1.00 0.00 O ATOM 1378 OD2 ASP A 91 -7.086 -9.522 4.167 1.00 0.00 O ATOM 0 H ASP A 91 -4.007 -11.608 4.587 1.00 0.00 H new ATOM 0 HA ASP A 91 -3.452 -9.414 3.046 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -4.991 -9.914 5.576 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.735 -8.246 5.102 1.00 0.00 H new ATOM 1383 N THR A 92 -1.903 -9.279 5.952 1.00 0.00 N ATOM 1384 CA THR A 92 -0.844 -8.599 6.687 1.00 0.00 C ATOM 1385 C THR A 92 0.321 -8.244 5.770 1.00 0.00 C ATOM 1386 O THR A 92 0.927 -9.119 5.153 1.00 0.00 O ATOM 1387 CB THR A 92 -0.322 -9.464 7.849 1.00 0.00 C ATOM 1388 OG1 THR A 92 -1.418 -9.933 8.642 1.00 0.00 O ATOM 1389 CG2 THR A 92 0.640 -8.672 8.723 1.00 0.00 C ATOM 0 H THR A 92 -2.282 -10.101 6.423 1.00 0.00 H new ATOM 0 HA THR A 92 -1.277 -7.684 7.091 1.00 0.00 H new ATOM 0 HB THR A 92 0.211 -10.316 7.427 1.00 0.00 H new ATOM 0 HG1 THR A 92 -1.733 -10.792 8.290 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.996 -9.303 9.537 1.00 0.00 H new ATOM 0 HG22 THR A 92 1.488 -8.341 8.123 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.126 -7.804 9.135 1.00 0.00 H new ATOM 1397 N GLY A 93 0.629 -6.953 5.685 1.00 0.00 N ATOM 1398 CA GLY A 93 1.722 -6.506 4.841 1.00 0.00 C ATOM 1399 C GLY A 93 1.861 -4.996 4.824 1.00 0.00 C ATOM 1400 O GLY A 93 2.405 -4.406 5.758 1.00 0.00 O ATOM 0 H GLY A 93 0.142 -6.210 6.185 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.653 -6.950 5.193 1.00 0.00 H new ATOM 0 HA3 GLY A 93 1.562 -6.865 3.824 1.00 0.00 H new ATOM 1404 N SER A 94 1.370 -4.370 3.760 1.00 0.00 N ATOM 1405 CA SER A 94 1.447 -2.920 3.624 1.00 0.00 C ATOM 1406 C SER A 94 0.358 -2.403 2.688 1.00 0.00 C ATOM 1407 O SER A 94 -0.009 -3.067 1.719 1.00 0.00 O ATOM 1408 CB SER A 94 2.824 -2.509 3.098 1.00 0.00 C ATOM 1409 OG SER A 94 3.845 -2.854 4.018 1.00 0.00 O ATOM 0 H SER A 94 0.915 -4.843 2.980 1.00 0.00 H new ATOM 0 HA SER A 94 1.295 -2.479 4.609 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.012 -2.997 2.142 1.00 0.00 H new ATOM 0 HB3 SER A 94 2.842 -1.434 2.917 1.00 0.00 H new ATOM 0 HG SER A 94 3.448 -3.301 4.795 1.00 0.00 H new ATOM 1415 N TYR A 95 -0.153 -1.214 2.987 1.00 0.00 N ATOM 1416 CA TYR A 95 -1.202 -0.608 2.175 1.00 0.00 C ATOM 1417 C TYR A 95 -0.966 0.889 2.009 1.00 0.00 C ATOM 1418 O TYR A 95 -1.143 1.667 2.947 1.00 0.00 O ATOM 1419 CB TYR A 95 -2.573 -0.852 2.810 1.00 0.00 C ATOM 1420 CG TYR A 95 -3.028 -2.292 2.734 1.00 0.00 C ATOM 1421 CD1 TYR A 95 -2.567 -3.236 3.644 1.00 0.00 C ATOM 1422 CD2 TYR A 95 -3.919 -2.708 1.753 1.00 0.00 C ATOM 1423 CE1 TYR A 95 -2.980 -4.552 3.578 1.00 0.00 C ATOM 1424 CE2 TYR A 95 -4.339 -4.023 1.680 1.00 0.00 C ATOM 1425 CZ TYR A 95 -3.866 -4.941 2.595 1.00 0.00 C ATOM 1426 OH TYR A 95 -4.280 -6.251 2.526 1.00 0.00 O ATOM 0 H TYR A 95 0.142 -0.651 3.785 1.00 0.00 H new ATOM 0 HA TYR A 95 -1.177 -1.073 1.189 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -2.540 -0.545 3.855 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -3.311 -0.220 2.316 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -1.874 -2.935 4.416 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.290 -1.992 1.035 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -2.611 -5.273 4.292 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -5.033 -4.330 0.912 1.00 0.00 H new ATOM 0 HH TYR A 95 -4.904 -6.358 1.778 1.00 0.00 H new ATOM 1436 N THR A 96 -0.564 1.288 0.806 1.00 0.00 N ATOM 1437 CA THR A 96 -0.301 2.692 0.514 1.00 0.00 C ATOM 1438 C THR A 96 -1.563 3.398 0.031 1.00 0.00 C ATOM 1439 O THR A 96 -2.276 2.892 -0.837 1.00 0.00 O ATOM 1440 CB THR A 96 0.801 2.848 -0.551 1.00 0.00 C ATOM 1441 OG1 THR A 96 2.029 2.290 -0.070 1.00 0.00 O ATOM 1442 CG2 THR A 96 1.007 4.313 -0.904 1.00 0.00 C ATOM 0 H THR A 96 -0.413 0.658 0.018 1.00 0.00 H new ATOM 0 HA THR A 96 0.036 3.151 1.444 1.00 0.00 H new ATOM 0 HB THR A 96 0.488 2.315 -1.449 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.902 1.338 0.125 1.00 0.00 H new ATOM 0 HG21 THR A 96 1.790 4.399 -1.658 1.00 0.00 H new ATOM 0 HG22 THR A 96 0.078 4.727 -1.297 1.00 0.00 H new ATOM 0 HG23 THR A 96 1.301 4.865 -0.011 1.00 0.00 H new ATOM 1450 N LEU A 97 -1.833 4.569 0.596 1.00 0.00 N ATOM 1451 CA LEU A 97 -3.010 5.346 0.222 1.00 0.00 C ATOM 1452 C LEU A 97 -2.610 6.724 -0.297 1.00 0.00 C ATOM 1453 O LEU A 97 -2.198 7.591 0.472 1.00 0.00 O ATOM 1454 CB LEU A 97 -3.951 5.493 1.419 1.00 0.00 C ATOM 1455 CG LEU A 97 -5.049 6.548 1.284 1.00 0.00 C ATOM 1456 CD1 LEU A 97 -4.505 7.930 1.610 1.00 0.00 C ATOM 1457 CD2 LEU A 97 -5.643 6.523 -0.117 1.00 0.00 C ATOM 0 H LEU A 97 -1.253 5.002 1.315 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.528 4.813 -0.576 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.423 4.528 1.605 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.353 5.731 2.299 1.00 0.00 H new ATOM 0 HG LEU A 97 -5.840 6.315 1.997 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -5.301 8.668 1.508 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -4.129 7.941 2.633 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.695 8.174 0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.423 7.280 -0.195 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -4.861 6.731 -0.847 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.071 5.540 -0.313 1.00 0.00 H new ATOM 1469 N GLN A 98 -2.737 6.917 -1.606 1.00 0.00 N ATOM 1470 CA GLN A 98 -2.390 8.190 -2.227 1.00 0.00 C ATOM 1471 C GLN A 98 -3.644 8.991 -2.564 1.00 0.00 C ATOM 1472 O GLN A 98 -4.555 8.490 -3.223 1.00 0.00 O ATOM 1473 CB GLN A 98 -1.565 7.956 -3.493 1.00 0.00 C ATOM 1474 CG GLN A 98 -1.332 9.217 -4.310 1.00 0.00 C ATOM 1475 CD GLN A 98 -0.256 9.041 -5.362 1.00 0.00 C ATOM 1476 OE1 GLN A 98 -0.662 8.648 -6.564 1.00 0.00 O flip ATOM 1477 NE2 GLN A 98 0.928 9.255 -5.099 1.00 0.00 N flip ATOM 0 H GLN A 98 -3.077 6.209 -2.256 1.00 0.00 H new ATOM 0 HA GLN A 98 -1.795 8.762 -1.515 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.601 7.530 -3.215 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -2.072 7.218 -4.115 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -2.264 9.509 -4.794 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.052 10.031 -3.642 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.196 9.556 -4.162 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.641 9.132 -5.818 1.00 0.00 H new ATOM 1486 N VAL A 99 -3.684 10.239 -2.107 1.00 0.00 N ATOM 1487 CA VAL A 99 -4.826 11.109 -2.360 1.00 0.00 C ATOM 1488 C VAL A 99 -4.416 12.328 -3.179 1.00 0.00 C ATOM 1489 O VAL A 99 -3.410 12.975 -2.887 1.00 0.00 O ATOM 1490 CB VAL A 99 -5.474 11.582 -1.046 1.00 0.00 C ATOM 1491 CG1 VAL A 99 -4.409 12.012 -0.049 1.00 0.00 C ATOM 1492 CG2 VAL A 99 -6.455 12.714 -1.312 1.00 0.00 C ATOM 0 H VAL A 99 -2.939 10.670 -1.560 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.552 10.523 -2.923 1.00 0.00 H new ATOM 0 HB VAL A 99 -6.026 10.748 -0.614 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -4.886 12.343 0.873 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.750 11.170 0.165 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.826 12.831 -0.470 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.903 13.035 -0.372 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.928 13.552 -1.768 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -7.237 12.366 -1.987 1.00 0.00 H new ATOM 1502 N ILE A 100 -5.202 12.637 -4.205 1.00 0.00 N ATOM 1503 CA ILE A 100 -4.922 13.779 -5.065 1.00 0.00 C ATOM 1504 C ILE A 100 -5.621 15.035 -4.556 1.00 0.00 C ATOM 1505 O ILE A 100 -6.732 14.971 -4.029 1.00 0.00 O ATOM 1506 CB ILE A 100 -5.363 13.513 -6.516 1.00 0.00 C ATOM 1507 CG1 ILE A 100 -4.542 12.371 -7.120 1.00 0.00 C ATOM 1508 CG2 ILE A 100 -5.220 14.775 -7.353 1.00 0.00 C ATOM 1509 CD1 ILE A 100 -4.908 11.009 -6.573 1.00 0.00 C ATOM 0 H ILE A 100 -6.038 12.112 -4.461 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.843 13.932 -5.044 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.413 13.219 -6.513 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -4.679 12.368 -8.201 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -3.484 12.556 -6.933 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.536 14.571 -8.376 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.843 15.564 -6.932 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.178 15.096 -7.352 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.287 10.248 -7.045 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.744 10.994 -5.496 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.957 10.802 -6.783 1.00 0.00 H new ATOM 1521 N LYS A 101 -4.964 16.179 -4.718 1.00 0.00 N ATOM 1522 CA LYS A 101 -5.522 17.452 -4.278 1.00 0.00 C ATOM 1523 C LYS A 101 -5.889 18.326 -5.473 1.00 0.00 C ATOM 1524 O LYS A 101 -5.259 18.250 -6.528 1.00 0.00 O ATOM 1525 CB LYS A 101 -4.523 18.187 -3.382 1.00 0.00 C ATOM 1526 CG LYS A 101 -4.339 17.542 -2.019 1.00 0.00 C ATOM 1527 CD LYS A 101 -2.971 17.854 -1.435 1.00 0.00 C ATOM 1528 CE LYS A 101 -1.871 17.085 -2.149 1.00 0.00 C ATOM 1529 NZ LYS A 101 -0.522 17.424 -1.617 1.00 0.00 N ATOM 0 H LYS A 101 -4.043 16.250 -5.151 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.428 17.247 -3.708 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.558 18.230 -3.887 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -4.858 19.215 -3.246 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -5.115 17.896 -1.340 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.461 16.462 -2.107 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -2.777 18.924 -1.512 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.962 17.604 -0.374 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.046 16.015 -2.039 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.907 17.306 -3.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.129 16.632 -1.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -0.165 18.277 -2.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.586 17.600 -0.594 1.00 0.00 H new ATOM 1543 N LEU A 102 -6.911 19.158 -5.299 1.00 0.00 N ATOM 1544 CA LEU A 102 -7.361 20.049 -6.363 1.00 0.00 C ATOM 1545 C LEU A 102 -6.198 20.862 -6.921 1.00 0.00 C ATOM 1546 O LEU A 102 -6.280 21.407 -8.021 1.00 0.00 O ATOM 1547 CB LEU A 102 -8.451 20.987 -5.841 1.00 0.00 C ATOM 1548 CG LEU A 102 -9.846 20.379 -5.692 1.00 0.00 C ATOM 1549 CD1 LEU A 102 -10.626 20.506 -6.991 1.00 0.00 C ATOM 1550 CD2 LEU A 102 -9.749 18.922 -5.266 1.00 0.00 C ATOM 0 H LEU A 102 -7.443 19.234 -4.432 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.770 19.438 -7.167 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -8.138 21.370 -4.870 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.519 21.842 -6.514 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.380 20.929 -4.917 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -11.616 20.068 -6.865 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.726 21.559 -7.254 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.096 19.982 -7.786 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -10.751 18.505 -5.165 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -9.196 18.359 -6.018 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -9.230 18.856 -4.310 1.00 0.00 H new ATOM 1562 N ASN A 103 -5.114 20.937 -6.156 1.00 0.00 N ATOM 1563 CA ASN A 103 -3.932 21.682 -6.575 1.00 0.00 C ATOM 1564 C ASN A 103 -3.023 20.817 -7.443 1.00 0.00 C ATOM 1565 O ASN A 103 -1.801 20.967 -7.422 1.00 0.00 O ATOM 1566 CB ASN A 103 -3.161 22.186 -5.353 1.00 0.00 C ATOM 1567 CG ASN A 103 -3.312 21.267 -4.156 1.00 0.00 C ATOM 1568 OD1 ASN A 103 -4.315 21.315 -3.445 1.00 0.00 O ATOM 1569 ND2 ASN A 103 -2.311 20.425 -3.927 1.00 0.00 N ATOM 0 H ASN A 103 -5.029 20.491 -5.243 1.00 0.00 H new ATOM 0 HA ASN A 103 -4.262 22.537 -7.165 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -2.105 22.279 -5.606 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -3.514 23.183 -5.089 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -2.355 19.784 -3.135 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -1.498 20.420 -4.543 1.00 0.00 H new ATOM 1576 N LEU A 104 -3.628 19.912 -8.204 1.00 0.00 N ATOM 1577 CA LEU A 104 -2.873 19.023 -9.081 1.00 0.00 C ATOM 1578 C LEU A 104 -1.693 18.402 -8.341 1.00 0.00 C ATOM 1579 O LEU A 104 -0.559 18.441 -8.817 1.00 0.00 O ATOM 1580 CB LEU A 104 -2.375 19.786 -10.309 1.00 0.00 C ATOM 1581 CG LEU A 104 -3.432 20.576 -11.083 1.00 0.00 C ATOM 1582 CD1 LEU A 104 -2.801 21.298 -12.263 1.00 0.00 C ATOM 1583 CD2 LEU A 104 -4.548 19.654 -11.553 1.00 0.00 C ATOM 0 H LEU A 104 -4.638 19.774 -8.232 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.538 18.222 -9.404 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.595 20.477 -9.991 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.911 19.074 -10.991 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.862 21.323 -10.415 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.568 21.854 -12.802 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.038 21.988 -11.902 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.344 20.570 -12.933 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.291 20.233 -12.102 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.134 18.884 -12.204 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.019 19.184 -10.690 1.00 0.00 H new ATOM 1595 N MET A 105 -1.969 17.827 -7.175 1.00 0.00 N ATOM 1596 CA MET A 105 -0.929 17.194 -6.371 1.00 0.00 C ATOM 1597 C MET A 105 -1.420 15.870 -5.793 1.00 0.00 C ATOM 1598 O MET A 105 -2.591 15.517 -5.933 1.00 0.00 O ATOM 1599 CB MET A 105 -0.491 18.126 -5.239 1.00 0.00 C ATOM 1600 CG MET A 105 0.433 19.243 -5.696 1.00 0.00 C ATOM 1601 SD MET A 105 1.535 19.812 -4.387 1.00 0.00 S ATOM 1602 CE MET A 105 2.665 18.427 -4.270 1.00 0.00 C ATOM 0 H MET A 105 -2.903 17.786 -6.766 1.00 0.00 H new ATOM 0 HA MET A 105 -0.075 16.994 -7.018 1.00 0.00 H new ATOM 0 HB2 MET A 105 -1.376 18.564 -4.777 1.00 0.00 H new ATOM 0 HB3 MET A 105 0.013 17.540 -4.471 1.00 0.00 H new ATOM 0 HG2 MET A 105 1.028 18.895 -6.540 1.00 0.00 H new ATOM 0 HG3 MET A 105 -0.165 20.082 -6.052 1.00 0.00 H new ATOM 0 HE1 MET A 105 3.586 18.749 -3.785 1.00 0.00 H new ATOM 0 HE2 MET A 105 2.206 17.631 -3.684 1.00 0.00 H new ATOM 0 HE3 MET A 105 2.892 18.057 -5.270 1.00 0.00 H new ATOM 1612 N SER A 106 -0.516 15.141 -5.145 1.00 0.00 N ATOM 1613 CA SER A 106 -0.857 13.854 -4.550 1.00 0.00 C ATOM 1614 C SER A 106 0.069 13.535 -3.380 1.00 0.00 C ATOM 1615 O SER A 106 1.288 13.670 -3.484 1.00 0.00 O ATOM 1616 CB SER A 106 -0.771 12.745 -5.600 1.00 0.00 C ATOM 1617 OG SER A 106 -1.220 13.203 -6.863 1.00 0.00 O ATOM 0 H SER A 106 0.457 15.420 -5.019 1.00 0.00 H new ATOM 0 HA SER A 106 -1.879 13.913 -4.177 1.00 0.00 H new ATOM 0 HB2 SER A 106 0.258 12.396 -5.681 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.373 11.893 -5.284 1.00 0.00 H new ATOM 0 HG SER A 106 -1.154 12.476 -7.517 1.00 0.00 H new ATOM 1623 N GLU A 107 -0.520 13.111 -2.266 1.00 0.00 N ATOM 1624 CA GLU A 107 0.251 12.774 -1.075 1.00 0.00 C ATOM 1625 C GLU A 107 0.386 11.261 -0.925 1.00 0.00 C ATOM 1626 O GLU A 107 -0.322 10.497 -1.580 1.00 0.00 O ATOM 1627 CB GLU A 107 -0.409 13.364 0.172 1.00 0.00 C ATOM 1628 CG GLU A 107 -0.059 14.823 0.414 1.00 0.00 C ATOM 1629 CD GLU A 107 -0.402 15.280 1.818 1.00 0.00 C ATOM 1630 OE1 GLU A 107 0.408 15.036 2.737 1.00 0.00 O ATOM 1631 OE2 GLU A 107 -1.480 15.884 1.998 1.00 0.00 O ATOM 0 H GLU A 107 -1.528 12.993 -2.164 1.00 0.00 H new ATOM 0 HA GLU A 107 1.247 13.202 -1.186 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.491 13.269 0.079 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.111 12.779 1.042 1.00 0.00 H new ATOM 0 HG2 GLU A 107 1.006 14.971 0.238 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -0.591 15.445 -0.306 1.00 0.00 H new ATOM 1638 N GLU A 108 1.301 10.837 -0.058 1.00 0.00 N ATOM 1639 CA GLU A 108 1.529 9.417 0.177 1.00 0.00 C ATOM 1640 C GLU A 108 1.547 9.108 1.671 1.00 0.00 C ATOM 1641 O GLU A 108 2.110 9.861 2.465 1.00 0.00 O ATOM 1642 CB GLU A 108 2.848 8.977 -0.462 1.00 0.00 C ATOM 1643 CG GLU A 108 2.779 8.844 -1.974 1.00 0.00 C ATOM 1644 CD GLU A 108 3.134 10.133 -2.690 1.00 0.00 C ATOM 1645 OE1 GLU A 108 4.109 10.794 -2.275 1.00 0.00 O ATOM 1646 OE2 GLU A 108 2.436 10.481 -3.665 1.00 0.00 O ATOM 0 H GLU A 108 1.895 11.457 0.492 1.00 0.00 H new ATOM 0 HA GLU A 108 0.709 8.863 -0.281 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.624 9.697 -0.204 1.00 0.00 H new ATOM 0 HB3 GLU A 108 3.147 8.020 -0.035 1.00 0.00 H new ATOM 0 HG2 GLU A 108 3.458 8.055 -2.297 1.00 0.00 H new ATOM 0 HG3 GLU A 108 1.774 8.538 -2.263 1.00 0.00 H new ATOM 1653 N VAL A 109 0.925 7.995 2.047 1.00 0.00 N ATOM 1654 CA VAL A 109 0.869 7.586 3.445 1.00 0.00 C ATOM 1655 C VAL A 109 0.701 6.076 3.569 1.00 0.00 C ATOM 1656 O VAL A 109 -0.355 5.528 3.250 1.00 0.00 O ATOM 1657 CB VAL A 109 -0.286 8.282 4.188 1.00 0.00 C ATOM 1658 CG1 VAL A 109 -1.553 8.262 3.346 1.00 0.00 C ATOM 1659 CG2 VAL A 109 -0.524 7.625 5.539 1.00 0.00 C ATOM 0 H VAL A 109 0.453 7.361 1.403 1.00 0.00 H new ATOM 0 HA VAL A 109 1.814 7.883 3.899 1.00 0.00 H new ATOM 0 HB VAL A 109 -0.009 9.322 4.359 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -2.358 8.758 3.888 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -1.373 8.783 2.406 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.837 7.230 3.140 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.344 8.130 6.050 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -0.779 6.575 5.393 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.380 7.698 6.143 1.00 0.00 H new ATOM 1669 N THR A 110 1.750 5.405 4.037 1.00 0.00 N ATOM 1670 CA THR A 110 1.720 3.958 4.203 1.00 0.00 C ATOM 1671 C THR A 110 0.958 3.565 5.463 1.00 0.00 C ATOM 1672 O THR A 110 1.471 3.688 6.575 1.00 0.00 O ATOM 1673 CB THR A 110 3.142 3.371 4.273 1.00 0.00 C ATOM 1674 OG1 THR A 110 4.053 4.207 3.551 1.00 0.00 O ATOM 1675 CG2 THR A 110 3.175 1.962 3.698 1.00 0.00 C ATOM 0 H THR A 110 2.631 5.842 4.308 1.00 0.00 H new ATOM 0 HA THR A 110 1.209 3.550 3.331 1.00 0.00 H new ATOM 0 HB THR A 110 3.442 3.327 5.320 1.00 0.00 H new ATOM 0 HG1 THR A 110 4.955 3.828 3.602 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.190 1.568 3.758 1.00 0.00 H new ATOM 0 HG22 THR A 110 2.502 1.321 4.268 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.857 1.987 2.656 1.00 0.00 H new ATOM 1683 N GLY A 111 -0.271 3.090 5.283 1.00 0.00 N ATOM 1684 CA GLY A 111 -1.084 2.686 6.415 1.00 0.00 C ATOM 1685 C GLY A 111 -1.604 1.269 6.279 1.00 0.00 C ATOM 1686 O GLY A 111 -2.411 0.980 5.395 1.00 0.00 O ATOM 0 H GLY A 111 -0.718 2.978 4.373 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -0.495 2.768 7.329 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.926 3.371 6.516 1.00 0.00 H new ATOM 1690 N GLN A 112 -1.140 0.383 7.154 1.00 0.00 N ATOM 1691 CA GLN A 112 -1.563 -1.012 7.125 1.00 0.00 C ATOM 1692 C GLN A 112 -1.869 -1.518 8.531 1.00 0.00 C ATOM 1693 O GLN A 112 -1.758 -0.775 9.506 1.00 0.00 O ATOM 1694 CB GLN A 112 -0.481 -1.882 6.482 1.00 0.00 C ATOM 1695 CG GLN A 112 0.811 -1.936 7.281 1.00 0.00 C ATOM 1696 CD GLN A 112 1.530 -0.602 7.319 1.00 0.00 C ATOM 1697 OE1 GLN A 112 1.600 0.050 8.361 1.00 0.00 O ATOM 1698 NE2 GLN A 112 2.071 -0.187 6.179 1.00 0.00 N ATOM 0 H GLN A 112 -0.471 0.606 7.891 1.00 0.00 H new ATOM 0 HA GLN A 112 -2.473 -1.076 6.529 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -0.866 -2.895 6.360 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -0.265 -1.501 5.484 1.00 0.00 H new ATOM 0 HG2 GLN A 112 0.591 -2.255 8.300 1.00 0.00 H new ATOM 0 HG3 GLN A 112 1.471 -2.688 6.848 1.00 0.00 H new ATOM 0 HE21 GLN A 112 1.990 -0.759 5.338 1.00 0.00 H new ATOM 0 HE22 GLN A 112 2.568 0.703 6.145 1.00 0.00 H new ATOM 1707 N PHE A 113 -2.254 -2.786 8.627 1.00 0.00 N ATOM 1708 CA PHE A 113 -2.578 -3.391 9.914 1.00 0.00 C ATOM 1709 C PHE A 113 -2.033 -4.814 9.998 1.00 0.00 C ATOM 1710 O PHE A 113 -1.383 -5.297 9.072 1.00 0.00 O ATOM 1711 CB PHE A 113 -4.092 -3.399 10.131 1.00 0.00 C ATOM 1712 CG PHE A 113 -4.846 -4.152 9.073 1.00 0.00 C ATOM 1713 CD1 PHE A 113 -5.030 -3.605 7.813 1.00 0.00 C ATOM 1714 CD2 PHE A 113 -5.371 -5.407 9.338 1.00 0.00 C ATOM 1715 CE1 PHE A 113 -5.722 -4.296 6.836 1.00 0.00 C ATOM 1716 CE2 PHE A 113 -6.064 -6.102 8.365 1.00 0.00 C ATOM 1717 CZ PHE A 113 -6.241 -5.545 7.113 1.00 0.00 C ATOM 0 H PHE A 113 -2.349 -3.415 7.829 1.00 0.00 H new ATOM 0 HA PHE A 113 -2.109 -2.794 10.696 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -4.309 -3.840 11.104 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -4.452 -2.371 10.160 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -4.628 -2.627 7.592 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -5.237 -5.847 10.315 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -5.856 -3.859 5.857 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -6.467 -7.080 8.583 1.00 0.00 H new ATOM 0 HZ PHE A 113 -6.784 -6.086 6.352 1.00 0.00 H new ATOM 1727 N SER A 114 -2.304 -5.479 11.117 1.00 0.00 N ATOM 1728 CA SER A 114 -1.838 -6.845 11.325 1.00 0.00 C ATOM 1729 C SER A 114 -2.997 -7.763 11.701 1.00 0.00 C ATOM 1730 O SER A 114 -3.861 -7.397 12.497 1.00 0.00 O ATOM 1731 CB SER A 114 -0.769 -6.881 12.420 1.00 0.00 C ATOM 1732 OG SER A 114 0.503 -6.532 11.902 1.00 0.00 O ATOM 0 H SER A 114 -2.843 -5.094 11.893 1.00 0.00 H new ATOM 0 HA SER A 114 -1.404 -7.200 10.391 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.041 -6.193 13.221 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.726 -7.878 12.858 1.00 0.00 H new ATOM 0 HG SER A 114 1.168 -6.561 12.621 1.00 0.00 H new ATOM 1738 N VAL A 115 -3.008 -8.959 11.120 1.00 0.00 N ATOM 1739 CA VAL A 115 -4.059 -9.932 11.393 1.00 0.00 C ATOM 1740 C VAL A 115 -3.508 -11.144 12.135 1.00 0.00 C ATOM 1741 O VAL A 115 -2.422 -11.635 11.824 1.00 0.00 O ATOM 1742 CB VAL A 115 -4.738 -10.404 10.094 1.00 0.00 C ATOM 1743 CG1 VAL A 115 -5.961 -11.252 10.408 1.00 0.00 C ATOM 1744 CG2 VAL A 115 -5.113 -9.213 9.225 1.00 0.00 C ATOM 0 H VAL A 115 -2.301 -9.277 10.457 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.798 -9.432 12.019 1.00 0.00 H new ATOM 0 HB VAL A 115 -4.031 -11.021 9.539 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -6.427 -11.576 9.478 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.659 -12.125 10.986 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.674 -10.663 10.985 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -5.592 -9.566 8.311 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -5.802 -8.568 9.770 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.214 -8.651 8.970 1.00 0.00 H new ATOM 1754 N HIS A 116 -4.263 -11.623 13.119 1.00 0.00 N ATOM 1755 CA HIS A 116 -3.850 -12.779 13.906 1.00 0.00 C ATOM 1756 C HIS A 116 -5.041 -13.685 14.207 1.00 0.00 C ATOM 1757 O HIS A 116 -6.116 -13.228 14.596 1.00 0.00 O ATOM 1758 CB HIS A 116 -3.196 -12.327 15.212 1.00 0.00 C ATOM 1759 CG HIS A 116 -4.130 -11.599 16.129 1.00 0.00 C ATOM 1760 ND1 HIS A 116 -4.434 -12.041 17.399 1.00 0.00 N ATOM 1761 CD2 HIS A 116 -4.828 -10.452 15.954 1.00 0.00 C ATOM 1762 CE1 HIS A 116 -5.279 -11.199 17.966 1.00 0.00 C ATOM 1763 NE2 HIS A 116 -5.534 -10.226 17.110 1.00 0.00 N ATOM 0 H HIS A 116 -5.164 -11.228 13.390 1.00 0.00 H new ATOM 0 HA HIS A 116 -3.124 -13.344 13.322 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -2.798 -13.199 15.730 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -2.350 -11.680 14.980 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -4.829 -9.831 15.070 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -5.691 -11.291 18.960 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -6.155 -9.435 17.280 1.00 0.00 H new ATOM 1772 N PRO A 117 -4.847 -14.999 14.022 1.00 0.00 N ATOM 1773 CA PRO A 117 -5.894 -15.996 14.267 1.00 0.00 C ATOM 1774 C PRO A 117 -6.210 -16.151 15.751 1.00 0.00 C ATOM 1775 O PRO A 117 -5.334 -16.483 16.549 1.00 0.00 O ATOM 1776 CB PRO A 117 -5.291 -17.288 13.711 1.00 0.00 C ATOM 1777 CG PRO A 117 -3.817 -17.082 13.789 1.00 0.00 C ATOM 1778 CD PRO A 117 -3.591 -15.613 13.560 1.00 0.00 C ATOM 0 HA PRO A 117 -6.840 -15.717 13.802 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.601 -18.154 14.296 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.612 -17.465 12.685 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -3.431 -17.389 14.761 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -3.299 -17.678 13.038 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -2.733 -15.246 14.123 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -3.400 -15.395 12.509 1.00 0.00 H new ATOM 1786 N GLU A 118 -7.466 -15.909 16.113 1.00 0.00 N ATOM 1787 CA GLU A 118 -7.896 -16.022 17.501 1.00 0.00 C ATOM 1788 C GLU A 118 -7.311 -17.273 18.152 1.00 0.00 C ATOM 1789 O GLU A 118 -7.793 -18.385 17.933 1.00 0.00 O ATOM 1790 CB GLU A 118 -9.423 -16.058 17.585 1.00 0.00 C ATOM 1791 CG GLU A 118 -10.085 -14.752 17.179 1.00 0.00 C ATOM 1792 CD GLU A 118 -11.584 -14.762 17.408 1.00 0.00 C ATOM 1793 OE1 GLU A 118 -12.189 -15.852 17.330 1.00 0.00 O ATOM 1794 OE2 GLU A 118 -12.152 -13.680 17.665 1.00 0.00 O ATOM 0 H GLU A 118 -8.203 -15.634 15.464 1.00 0.00 H new ATOM 0 HA GLU A 118 -7.530 -15.147 18.039 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -9.795 -16.858 16.946 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -9.717 -16.303 18.606 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -9.640 -13.933 17.744 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -9.883 -14.559 16.125 1.00 0.00 H new ATOM 1801 N THR A 119 -6.267 -17.083 18.953 1.00 0.00 N ATOM 1802 CA THR A 119 -5.614 -18.194 19.634 1.00 0.00 C ATOM 1803 C THR A 119 -5.432 -17.898 21.118 1.00 0.00 C ATOM 1804 O THR A 119 -5.161 -16.767 21.522 1.00 0.00 O ATOM 1805 CB THR A 119 -4.240 -18.506 19.011 1.00 0.00 C ATOM 1806 OG1 THR A 119 -3.521 -17.289 18.779 1.00 0.00 O ATOM 1807 CG2 THR A 119 -4.399 -19.265 17.703 1.00 0.00 C ATOM 0 H THR A 119 -5.856 -16.170 19.146 1.00 0.00 H new ATOM 0 HA THR A 119 -6.263 -19.062 19.516 1.00 0.00 H new ATOM 0 HB THR A 119 -3.682 -19.130 19.709 1.00 0.00 H new ATOM 0 HG1 THR A 119 -3.929 -16.806 18.031 1.00 0.00 H new ATOM 0 HG21 THR A 119 -3.416 -19.474 17.282 1.00 0.00 H new ATOM 0 HG22 THR A 119 -4.921 -20.204 17.888 1.00 0.00 H new ATOM 0 HG23 THR A 119 -4.974 -18.662 17.000 1.00 0.00 H new ATOM 1815 N PRO A 120 -5.582 -18.938 21.952 1.00 0.00 N ATOM 1816 CA PRO A 120 -5.437 -18.814 23.406 1.00 0.00 C ATOM 1817 C PRO A 120 -3.992 -18.561 23.824 1.00 0.00 C ATOM 1818 O PRO A 120 -3.055 -18.939 23.121 1.00 0.00 O ATOM 1819 CB PRO A 120 -5.914 -20.171 23.927 1.00 0.00 C ATOM 1820 CG PRO A 120 -5.686 -21.113 22.796 1.00 0.00 C ATOM 1821 CD PRO A 120 -5.905 -20.314 21.541 1.00 0.00 C ATOM 0 HA PRO A 120 -6.000 -17.969 23.801 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -5.355 -20.473 24.813 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -6.966 -20.139 24.209 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -4.676 -21.522 22.827 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.374 -21.957 22.846 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -5.260 -20.653 20.731 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -6.932 -20.397 21.186 1.00 0.00 H new ATOM 1829 N LYS A 121 -3.819 -17.919 24.975 1.00 0.00 N ATOM 1830 CA LYS A 121 -2.488 -17.616 25.489 1.00 0.00 C ATOM 1831 C LYS A 121 -1.812 -18.875 26.023 1.00 0.00 C ATOM 1832 O LYS A 121 -2.401 -19.656 26.770 1.00 0.00 O ATOM 1833 CB LYS A 121 -2.574 -16.562 26.596 1.00 0.00 C ATOM 1834 CG LYS A 121 -1.249 -15.884 26.894 1.00 0.00 C ATOM 1835 CD LYS A 121 -1.403 -14.793 27.940 1.00 0.00 C ATOM 1836 CE LYS A 121 -1.711 -13.447 27.301 1.00 0.00 C ATOM 1837 NZ LYS A 121 -1.190 -12.315 28.115 1.00 0.00 N ATOM 0 H LYS A 121 -4.584 -17.599 25.569 1.00 0.00 H new ATOM 0 HA LYS A 121 -1.889 -17.223 24.667 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.304 -15.805 26.309 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.944 -17.033 27.507 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -0.531 -16.625 27.244 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -0.844 -15.456 25.977 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -2.203 -15.060 28.631 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -0.487 -14.718 28.526 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -1.272 -13.409 26.304 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -2.789 -13.341 27.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -1.420 -11.416 27.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.627 -12.336 29.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -0.158 -12.402 28.210 1.00 0.00 H new ATOM 1851 N PRO A 122 -0.545 -19.078 25.633 1.00 0.00 N ATOM 1852 CA PRO A 122 0.239 -20.239 26.062 1.00 0.00 C ATOM 1853 C PRO A 122 0.602 -20.179 27.542 1.00 0.00 C ATOM 1854 O PRO A 122 1.296 -21.055 28.057 1.00 0.00 O ATOM 1855 CB PRO A 122 1.501 -20.154 25.199 1.00 0.00 C ATOM 1856 CG PRO A 122 1.626 -18.711 24.852 1.00 0.00 C ATOM 1857 CD PRO A 122 0.220 -18.188 24.743 1.00 0.00 C ATOM 0 HA PRO A 122 -0.314 -21.170 25.942 1.00 0.00 H new ATOM 0 HB2 PRO A 122 2.377 -20.508 25.743 1.00 0.00 H new ATOM 0 HB3 PRO A 122 1.411 -20.770 24.304 1.00 0.00 H new ATOM 0 HG2 PRO A 122 2.184 -18.172 25.618 1.00 0.00 H new ATOM 0 HG3 PRO A 122 2.165 -18.581 23.913 1.00 0.00 H new ATOM 0 HD2 PRO A 122 0.153 -17.147 25.061 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -0.147 -18.233 23.718 1.00 0.00 H new ATOM 1865 N SER A 123 0.126 -19.141 28.221 1.00 0.00 N ATOM 1866 CA SER A 123 0.402 -18.965 29.642 1.00 0.00 C ATOM 1867 C SER A 123 0.074 -20.235 30.421 1.00 0.00 C ATOM 1868 O SER A 123 -1.092 -20.603 30.567 1.00 0.00 O ATOM 1869 CB SER A 123 -0.403 -17.790 30.199 1.00 0.00 C ATOM 1870 OG SER A 123 0.053 -17.424 31.490 1.00 0.00 O ATOM 0 H SER A 123 -0.453 -18.409 27.810 1.00 0.00 H new ATOM 0 HA SER A 123 1.465 -18.754 29.756 1.00 0.00 H new ATOM 0 HB2 SER A 123 -0.320 -16.937 29.526 1.00 0.00 H new ATOM 0 HB3 SER A 123 -1.458 -18.058 30.245 1.00 0.00 H new ATOM 0 HG SER A 123 -0.477 -16.670 31.822 1.00 0.00 H new ATOM 1876 N ILE A 124 1.111 -20.901 30.918 1.00 0.00 N ATOM 1877 CA ILE A 124 0.934 -22.129 31.683 1.00 0.00 C ATOM 1878 C ILE A 124 1.423 -21.960 33.117 1.00 0.00 C ATOM 1879 O ILE A 124 2.319 -21.160 33.388 1.00 0.00 O ATOM 1880 CB ILE A 124 1.681 -23.309 31.033 1.00 0.00 C ATOM 1881 CG1 ILE A 124 3.130 -22.921 30.734 1.00 0.00 C ATOM 1882 CG2 ILE A 124 0.971 -23.751 29.762 1.00 0.00 C ATOM 1883 CD1 ILE A 124 4.033 -24.107 30.479 1.00 0.00 C ATOM 0 H ILE A 124 2.082 -20.611 30.805 1.00 0.00 H new ATOM 0 HA ILE A 124 -0.134 -22.345 31.690 1.00 0.00 H new ATOM 0 HB ILE A 124 1.686 -24.146 31.732 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.150 -22.266 29.863 1.00 0.00 H new ATOM 0 HG13 ILE A 124 3.525 -22.348 31.573 1.00 0.00 H new ATOM 0 HG21 ILE A 124 1.511 -24.585 29.315 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -0.045 -24.064 30.003 1.00 0.00 H new ATOM 0 HG23 ILE A 124 0.937 -22.921 29.057 1.00 0.00 H new ATOM 0 HD11 ILE A 124 5.045 -23.757 30.274 1.00 0.00 H new ATOM 0 HD12 ILE A 124 4.043 -24.752 31.358 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.663 -24.668 29.621 1.00 0.00 H new ATOM 1895 N SER A 125 0.830 -22.719 34.032 1.00 0.00 N ATOM 1896 CA SER A 125 1.204 -22.652 35.440 1.00 0.00 C ATOM 1897 C SER A 125 1.671 -24.015 35.944 1.00 0.00 C ATOM 1898 O SER A 125 2.692 -24.122 36.622 1.00 0.00 O ATOM 1899 CB SER A 125 0.023 -22.163 36.281 1.00 0.00 C ATOM 1900 OG SER A 125 -0.336 -20.837 35.932 1.00 0.00 O ATOM 0 H SER A 125 0.088 -23.388 33.824 1.00 0.00 H new ATOM 0 HA SER A 125 2.028 -21.945 35.538 1.00 0.00 H new ATOM 0 HB2 SER A 125 -0.831 -22.825 36.135 1.00 0.00 H new ATOM 0 HB3 SER A 125 0.283 -22.207 37.339 1.00 0.00 H new ATOM 0 HG SER A 125 -1.094 -20.548 36.482 1.00 0.00 H new ATOM 1906 N GLY A 126 0.915 -25.055 35.606 1.00 0.00 N ATOM 1907 CA GLY A 126 1.266 -26.397 36.032 1.00 0.00 C ATOM 1908 C GLY A 126 1.320 -27.376 34.876 1.00 0.00 C ATOM 1909 O GLY A 126 0.887 -27.080 33.763 1.00 0.00 O ATOM 0 H GLY A 126 0.066 -24.992 35.045 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.235 -26.375 36.531 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.538 -26.745 36.765 1.00 0.00 H new ATOM 1913 N PRO A 127 1.865 -28.574 35.136 1.00 0.00 N ATOM 1914 CA PRO A 127 1.988 -29.624 34.121 1.00 0.00 C ATOM 1915 C PRO A 127 0.638 -30.214 33.729 1.00 0.00 C ATOM 1916 O PRO A 127 0.563 -31.126 32.906 1.00 0.00 O ATOM 1917 CB PRO A 127 2.855 -30.682 34.808 1.00 0.00 C ATOM 1918 CG PRO A 127 2.625 -30.473 36.265 1.00 0.00 C ATOM 1919 CD PRO A 127 2.402 -28.996 36.440 1.00 0.00 C ATOM 0 HA PRO A 127 2.412 -29.244 33.191 1.00 0.00 H new ATOM 0 HB2 PRO A 127 2.568 -31.688 34.502 1.00 0.00 H new ATOM 0 HB3 PRO A 127 3.907 -30.559 34.552 1.00 0.00 H new ATOM 0 HG2 PRO A 127 1.761 -31.042 36.610 1.00 0.00 H new ATOM 0 HG3 PRO A 127 3.482 -30.810 36.848 1.00 0.00 H new ATOM 0 HD2 PRO A 127 1.701 -28.789 37.249 1.00 0.00 H new ATOM 0 HD3 PRO A 127 3.329 -28.476 36.680 1.00 0.00 H new ATOM 1927 N SER A 128 -0.428 -29.688 34.326 1.00 0.00 N ATOM 1928 CA SER A 128 -1.776 -30.165 34.042 1.00 0.00 C ATOM 1929 C SER A 128 -2.456 -29.282 33.000 1.00 0.00 C ATOM 1930 O SER A 128 -2.937 -29.769 31.977 1.00 0.00 O ATOM 1931 CB SER A 128 -2.610 -30.195 35.324 1.00 0.00 C ATOM 1932 OG SER A 128 -2.667 -28.913 35.925 1.00 0.00 O ATOM 0 H SER A 128 -0.383 -28.932 35.009 1.00 0.00 H new ATOM 0 HA SER A 128 -1.700 -31.176 33.643 1.00 0.00 H new ATOM 0 HB2 SER A 128 -3.619 -30.539 35.097 1.00 0.00 H new ATOM 0 HB3 SER A 128 -2.180 -30.910 36.025 1.00 0.00 H new ATOM 0 HG SER A 128 -3.207 -28.958 36.742 1.00 0.00 H new ATOM 1938 N SER A 129 -2.493 -27.981 33.269 1.00 0.00 N ATOM 1939 CA SER A 129 -3.118 -27.029 32.358 1.00 0.00 C ATOM 1940 C SER A 129 -4.375 -27.623 31.730 1.00 0.00 C ATOM 1941 O SER A 129 -4.626 -27.455 30.538 1.00 0.00 O ATOM 1942 CB SER A 129 -2.133 -26.618 31.262 1.00 0.00 C ATOM 1943 OG SER A 129 -1.659 -27.749 30.551 1.00 0.00 O ATOM 0 H SER A 129 -2.097 -27.562 34.111 1.00 0.00 H new ATOM 0 HA SER A 129 -3.401 -26.147 32.932 1.00 0.00 H new ATOM 0 HB2 SER A 129 -2.619 -25.928 30.572 1.00 0.00 H new ATOM 0 HB3 SER A 129 -1.292 -26.085 31.706 1.00 0.00 H new ATOM 0 HG SER A 129 -1.032 -27.459 29.855 1.00 0.00 H new ATOM 1949 N GLY A 130 -5.163 -28.320 32.544 1.00 0.00 N ATOM 1950 CA GLY A 130 -6.385 -28.929 32.052 1.00 0.00 C ATOM 1951 C GLY A 130 -6.131 -30.240 31.335 1.00 0.00 C ATOM 1952 O GLY A 130 -6.423 -30.372 30.147 1.00 0.00 O ATOM 0 H GLY A 130 -4.977 -28.473 33.535 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -7.064 -29.101 32.887 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -6.884 -28.238 31.373 1.00 0.00 H new TER 1956 GLY A 130