USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1088 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 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 2 ASN : amide:sc= -0.665 X(o=-0.67,f=-0.53) USER MOD Set 2.2: A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot -78:sc= -0.0292 USER MOD Single : A 14 SER OG : rot -94:sc= 0.0217 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -32:sc= -0.529 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 89:sc= 0.0703 USER MOD Single : A 33 THR OG1 : rot -16:sc= 0.537 USER MOD Single : A 38 LYS NZ :NH3+ 153:sc= 0.1 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl -173:sc= -1.01 (180deg=-1.22) USER MOD Single : B 1 MET N :NH3+ -119:sc= -0.755 (180deg=-2.51!) USER MOD Single : B 2 ASN : amide:sc= -0.102 X(o=-0.1,f=-0.1) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 13 THR OG1 : rot -45:sc= 0.00231 USER MOD Single : B 14 SER OG : rot 180:sc= -0.0658 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.0181) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 THR OG1 : rot 82:sc= 1.13 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot 94:sc= 0.00274 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 ASN : amide:sc= -0.108 K(o=-0.11,f=-0.81!) USER MOD Single : B 75 LYS NZ :NH3+ -168:sc= 0.00381 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ASN A 2 -8.704 10.483 -1.831 1.00 0.00 N ATOM 20 CA ASN A 2 -7.761 11.501 -2.413 1.00 0.00 C ATOM 21 C ASN A 2 -6.588 11.913 -1.475 1.00 0.00 C ATOM 22 O ASN A 2 -5.500 12.183 -1.982 1.00 0.00 O ATOM 23 CB ASN A 2 -8.359 12.788 -3.056 1.00 0.00 C ATOM 24 CG ASN A 2 -9.082 13.802 -2.151 1.00 0.00 C ATOM 25 OD1 ASN A 2 -10.274 13.694 -1.872 1.00 0.00 O ATOM 26 ND2 ASN A 2 -8.367 14.823 -1.714 1.00 0.00 N ATOM 0 HA ASN A 2 -7.389 10.903 -3.245 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -7.547 13.314 -3.558 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -9.062 12.475 -3.828 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -8.803 15.540 -1.134 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -7.379 14.895 -1.957 1.00 0.00 H new ATOM 33 N LYS A 3 -6.864 11.973 -0.159 1.00 0.00 N ATOM 34 CA LYS A 3 -5.980 12.416 0.967 1.00 0.00 C ATOM 35 C LYS A 3 -6.798 13.311 1.957 1.00 0.00 C ATOM 36 O LYS A 3 -6.430 13.340 3.130 1.00 0.00 O ATOM 37 CB LYS A 3 -4.600 13.067 0.657 1.00 0.00 C ATOM 38 CG LYS A 3 -3.598 13.079 1.840 1.00 0.00 C ATOM 39 CD LYS A 3 -2.169 13.505 1.456 1.00 0.00 C ATOM 40 CE LYS A 3 -1.171 13.352 2.618 1.00 0.00 C ATOM 41 NZ LYS A 3 0.183 13.783 2.229 1.00 0.00 N ATOM 0 H LYS A 3 -7.782 11.693 0.186 1.00 0.00 H new ATOM 0 HA LYS A 3 -5.670 11.466 1.402 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.145 12.536 -0.179 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -4.765 14.094 0.331 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -3.971 13.754 2.610 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.562 12.082 2.280 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -1.831 12.906 0.611 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -2.180 14.544 1.126 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.510 13.941 3.470 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -1.144 12.311 2.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.829 13.666 3.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 0.516 13.204 1.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.161 14.783 1.945 1.00 0.00 H new ATOM 54 N THR A 4 -7.871 14.019 1.540 1.00 0.00 N ATOM 55 CA THR A 4 -8.796 14.759 2.378 1.00 0.00 C ATOM 56 C THR A 4 -9.990 13.866 2.835 1.00 0.00 C ATOM 57 O THR A 4 -10.417 14.005 3.984 1.00 0.00 O ATOM 58 CB THR A 4 -9.210 15.962 1.509 1.00 0.00 C ATOM 59 OG1 THR A 4 -8.093 16.772 1.135 1.00 0.00 O ATOM 60 CG2 THR A 4 -10.140 16.824 2.313 1.00 0.00 C ATOM 0 H THR A 4 -8.114 14.083 0.552 1.00 0.00 H new ATOM 0 HA THR A 4 -8.356 15.093 3.318 1.00 0.00 H new ATOM 0 HB THR A 4 -9.675 15.573 0.603 1.00 0.00 H new ATOM 0 HG1 THR A 4 -8.402 17.521 0.584 1.00 0.00 H new ATOM 0 HG21 THR A 4 -10.447 17.683 1.717 1.00 0.00 H new ATOM 0 HG22 THR A 4 -11.020 16.246 2.595 1.00 0.00 H new ATOM 0 HG23 THR A 4 -9.630 17.170 3.212 1.00 0.00 H new ATOM 68 N GLU A 5 -10.551 12.995 1.959 1.00 0.00 N ATOM 69 CA GLU A 5 -11.507 11.935 2.412 1.00 0.00 C ATOM 70 C GLU A 5 -10.884 10.947 3.473 1.00 0.00 C ATOM 71 O GLU A 5 -11.600 10.298 4.240 1.00 0.00 O ATOM 72 CB GLU A 5 -12.070 11.125 1.215 1.00 0.00 C ATOM 73 CG GLU A 5 -12.675 11.889 0.019 1.00 0.00 C ATOM 74 CD GLU A 5 -13.898 12.747 0.357 1.00 0.00 C ATOM 75 OE1 GLU A 5 -15.050 12.313 0.362 1.00 0.00 O ATOM 76 OE2 GLU A 5 -13.557 14.043 0.654 1.00 0.00 O ATOM 0 H GLU A 5 -10.368 12.998 0.956 1.00 0.00 H new ATOM 0 HA GLU A 5 -12.321 12.470 2.900 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -11.264 10.498 0.833 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -12.838 10.456 1.602 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -11.906 12.531 -0.411 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -12.955 11.169 -0.750 1.00 0.00 H new ATOM 84 N LEU A 6 -9.535 10.879 3.485 1.00 0.00 N ATOM 85 CA LEU A 6 -8.683 10.234 4.487 1.00 0.00 C ATOM 86 C LEU A 6 -8.849 10.905 5.872 1.00 0.00 C ATOM 87 O LEU A 6 -9.176 10.213 6.824 1.00 0.00 O ATOM 88 CB LEU A 6 -7.237 10.439 3.903 1.00 0.00 C ATOM 89 CG LEU A 6 -6.477 9.134 3.628 1.00 0.00 C ATOM 90 CD1 LEU A 6 -7.147 8.203 2.599 1.00 0.00 C ATOM 91 CD2 LEU A 6 -4.991 9.350 3.329 1.00 0.00 C ATOM 0 H LEU A 6 -8.983 11.305 2.741 1.00 0.00 H new ATOM 0 HA LEU A 6 -8.924 9.184 4.655 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -7.309 11.006 2.975 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -6.658 11.043 4.601 1.00 0.00 H new ATOM 0 HG LEU A 6 -6.533 8.598 4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -6.540 7.307 2.469 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -8.138 7.921 2.955 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -7.238 8.721 1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.513 8.388 3.144 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -4.885 9.983 2.448 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -4.515 9.833 4.182 1.00 0.00 H new ATOM 103 N ILE A 7 -8.688 12.240 5.940 1.00 0.00 N ATOM 104 CA ILE A 7 -8.853 13.099 7.145 1.00 0.00 C ATOM 105 C ILE A 7 -10.241 12.915 7.819 1.00 0.00 C ATOM 106 O ILE A 7 -10.304 12.688 9.030 1.00 0.00 O ATOM 107 CB ILE A 7 -8.602 14.608 6.768 1.00 0.00 C ATOM 108 CG1 ILE A 7 -7.359 14.832 5.871 1.00 0.00 C ATOM 109 CG2 ILE A 7 -8.488 15.483 8.025 1.00 0.00 C ATOM 110 CD1 ILE A 7 -7.114 16.243 5.327 1.00 0.00 C ATOM 0 H ILE A 7 -8.426 12.784 5.118 1.00 0.00 H new ATOM 0 HA ILE A 7 -8.110 12.786 7.878 1.00 0.00 H new ATOM 0 HB ILE A 7 -9.475 14.904 6.186 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -6.478 14.535 6.440 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -7.433 14.154 5.021 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -8.315 16.519 7.733 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.412 15.417 8.599 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -7.656 15.135 8.637 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -6.210 16.246 4.718 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -7.964 16.551 4.717 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -6.994 16.938 6.158 1.00 0.00 H new ATOM 122 N ASN A 8 -11.328 13.005 7.026 1.00 0.00 N ATOM 123 CA ASN A 8 -12.703 12.727 7.525 1.00 0.00 C ATOM 124 C ASN A 8 -12.953 11.254 7.982 1.00 0.00 C ATOM 125 O ASN A 8 -13.838 11.052 8.816 1.00 0.00 O ATOM 126 CB ASN A 8 -13.773 13.187 6.497 1.00 0.00 C ATOM 127 CG ASN A 8 -13.846 14.709 6.252 1.00 0.00 C ATOM 128 OD1 ASN A 8 -14.325 15.467 7.095 1.00 0.00 O ATOM 129 ND2 ASN A 8 -13.377 15.182 5.107 1.00 0.00 N ATOM 0 H ASN A 8 -11.288 13.266 6.041 1.00 0.00 H new ATOM 0 HA ASN A 8 -12.799 13.321 8.434 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -13.575 12.692 5.546 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -14.750 12.844 6.837 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -13.411 16.184 4.917 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -12.982 14.545 4.415 1.00 0.00 H new ATOM 136 N ALA A 9 -12.198 10.246 7.484 1.00 0.00 N ATOM 137 CA ALA A 9 -12.218 8.872 8.059 1.00 0.00 C ATOM 138 C ALA A 9 -11.664 8.784 9.494 1.00 0.00 C ATOM 139 O ALA A 9 -12.245 8.120 10.349 1.00 0.00 O ATOM 140 CB ALA A 9 -11.290 7.931 7.253 1.00 0.00 C ATOM 0 H ALA A 9 -11.569 10.354 6.689 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.271 8.593 8.032 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.318 6.932 7.688 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -11.628 7.885 6.218 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.269 8.312 7.285 1.00 0.00 H new ATOM 146 N VAL A 10 -10.515 9.435 9.714 1.00 0.00 N ATOM 147 CA VAL A 10 -9.751 9.422 10.972 1.00 0.00 C ATOM 148 C VAL A 10 -10.470 10.111 12.100 1.00 0.00 C ATOM 149 O VAL A 10 -10.676 9.546 13.177 1.00 0.00 O ATOM 150 CB VAL A 10 -8.280 9.899 10.830 1.00 0.00 C ATOM 151 CG1 VAL A 10 -7.355 9.091 11.711 1.00 0.00 C ATOM 152 CG2 VAL A 10 -7.781 9.822 9.396 1.00 0.00 C ATOM 0 H VAL A 10 -10.073 10.008 8.995 1.00 0.00 H new ATOM 0 HA VAL A 10 -9.683 8.368 11.240 1.00 0.00 H new ATOM 0 HB VAL A 10 -8.272 10.943 11.145 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -6.332 9.449 11.590 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -7.657 9.201 12.753 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.408 8.040 11.427 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -6.748 10.167 9.351 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.835 8.791 9.047 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.402 10.453 8.760 1.00 0.00 H new ATOM 162 N ALA A 11 -10.856 11.344 11.779 1.00 0.00 N ATOM 163 CA ALA A 11 -11.664 12.147 12.670 1.00 0.00 C ATOM 164 C ALA A 11 -13.101 11.614 12.943 1.00 0.00 C ATOM 165 O ALA A 11 -13.644 11.931 14.005 1.00 0.00 O ATOM 166 CB ALA A 11 -11.603 13.592 12.176 1.00 0.00 C ATOM 0 H ALA A 11 -10.616 11.804 10.901 1.00 0.00 H new ATOM 0 HA ALA A 11 -11.239 12.084 13.672 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.204 14.225 12.829 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.569 13.937 12.187 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.992 13.646 11.159 1.00 0.00 H new ATOM 172 N GLU A 12 -13.699 10.799 12.034 1.00 0.00 N ATOM 173 CA GLU A 12 -14.960 10.074 12.333 1.00 0.00 C ATOM 174 C GLU A 12 -14.694 8.826 13.233 1.00 0.00 C ATOM 175 O GLU A 12 -15.385 8.677 14.246 1.00 0.00 O ATOM 176 CB GLU A 12 -15.730 9.757 11.021 1.00 0.00 C ATOM 177 CG GLU A 12 -17.132 9.120 11.169 1.00 0.00 C ATOM 178 CD GLU A 12 -18.167 10.016 11.858 1.00 0.00 C ATOM 179 OE1 GLU A 12 -18.444 9.933 13.054 1.00 0.00 O ATOM 180 OE2 GLU A 12 -18.735 10.915 10.992 1.00 0.00 O ATOM 0 H GLU A 12 -13.331 10.630 11.098 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.615 10.718 12.920 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -15.836 10.684 10.458 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.115 9.087 10.420 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -17.502 8.853 10.179 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -17.038 8.193 11.735 1.00 0.00 H new ATOM 188 N THR A 13 -13.710 7.959 12.897 1.00 0.00 N ATOM 189 CA THR A 13 -13.350 6.772 13.743 1.00 0.00 C ATOM 190 C THR A 13 -12.695 6.966 15.146 1.00 0.00 C ATOM 191 O THR A 13 -12.602 6.016 15.931 1.00 0.00 O ATOM 192 CB THR A 13 -12.442 5.788 12.947 1.00 0.00 C ATOM 193 OG1 THR A 13 -11.242 6.464 12.610 1.00 0.00 O ATOM 194 CG2 THR A 13 -13.006 5.154 11.668 1.00 0.00 C ATOM 0 H THR A 13 -13.147 8.049 12.051 1.00 0.00 H new ATOM 0 HA THR A 13 -14.349 6.401 13.973 1.00 0.00 H new ATOM 0 HB THR A 13 -12.316 4.945 13.626 1.00 0.00 H new ATOM 0 HG1 THR A 13 -11.404 7.056 11.846 1.00 0.00 H new ATOM 0 HG21 THR A 13 -12.258 4.495 11.228 1.00 0.00 H new ATOM 0 HG22 THR A 13 -13.899 4.578 11.911 1.00 0.00 H new ATOM 0 HG23 THR A 13 -13.262 5.938 10.956 1.00 0.00 H new ATOM 202 N SER A 14 -12.248 8.183 15.422 1.00 0.00 N ATOM 203 CA SER A 14 -11.490 8.535 16.655 1.00 0.00 C ATOM 204 C SER A 14 -11.949 9.811 17.411 1.00 0.00 C ATOM 205 O SER A 14 -11.825 9.835 18.640 1.00 0.00 O ATOM 206 CB SER A 14 -9.991 8.641 16.271 1.00 0.00 C ATOM 207 OG SER A 14 -9.157 8.748 17.419 1.00 0.00 O ATOM 0 H SER A 14 -12.394 8.977 14.799 1.00 0.00 H new ATOM 0 HA SER A 14 -11.687 7.738 17.372 1.00 0.00 H new ATOM 0 HB2 SER A 14 -9.701 7.764 15.692 1.00 0.00 H new ATOM 0 HB3 SER A 14 -9.841 9.510 15.630 1.00 0.00 H new ATOM 0 HG SER A 14 -8.991 9.694 17.615 1.00 0.00 H new ATOM 213 N GLY A 15 -12.422 10.869 16.722 1.00 0.00 N ATOM 214 CA GLY A 15 -12.733 12.169 17.372 1.00 0.00 C ATOM 215 C GLY A 15 -11.516 12.980 17.869 1.00 0.00 C ATOM 216 O GLY A 15 -11.454 13.409 19.024 1.00 0.00 O ATOM 0 H GLY A 15 -12.598 10.854 15.717 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -13.291 12.783 16.665 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -13.392 11.981 18.220 1.00 0.00 H new ATOM 220 N LEU A 16 -10.584 13.192 16.938 1.00 0.00 N ATOM 221 CA LEU A 16 -9.355 13.998 17.116 1.00 0.00 C ATOM 222 C LEU A 16 -9.715 15.437 16.615 1.00 0.00 C ATOM 223 O LEU A 16 -10.639 16.090 17.114 1.00 0.00 O ATOM 224 CB LEU A 16 -8.075 13.152 16.738 1.00 0.00 C ATOM 225 CG LEU A 16 -8.147 12.378 15.406 1.00 0.00 C ATOM 226 CD1 LEU A 16 -8.724 13.129 14.259 1.00 0.00 C ATOM 227 CD2 LEU A 16 -7.231 11.233 14.915 1.00 0.00 C ATOM 0 H LEU A 16 -10.659 12.796 16.001 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.987 14.234 18.115 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.218 13.824 16.699 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.885 12.439 17.540 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.784 11.702 15.977 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.728 12.494 13.373 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.745 13.427 14.496 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.122 14.017 14.066 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.555 10.906 13.927 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.202 11.588 14.860 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.289 10.396 15.611 1.00 0.00 H new ATOM 239 N SER A 17 -8.954 15.899 15.646 1.00 0.00 N ATOM 240 CA SER A 17 -9.190 17.151 14.880 1.00 0.00 C ATOM 241 C SER A 17 -9.023 16.879 13.357 1.00 0.00 C ATOM 242 O SER A 17 -8.386 15.914 12.945 1.00 0.00 O ATOM 243 CB SER A 17 -8.261 18.287 15.351 1.00 0.00 C ATOM 244 OG SER A 17 -8.418 18.564 16.738 1.00 0.00 O ATOM 0 H SER A 17 -8.114 15.408 15.341 1.00 0.00 H new ATOM 0 HA SER A 17 -10.212 17.480 15.066 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.225 18.014 15.151 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.470 19.189 14.775 1.00 0.00 H new ATOM 0 HG SER A 17 -7.811 19.288 16.998 1.00 0.00 H new ATOM 250 N LYS A 18 -9.579 17.735 12.480 1.00 0.00 N ATOM 251 CA LYS A 18 -9.279 17.670 11.009 1.00 0.00 C ATOM 252 C LYS A 18 -7.777 17.986 10.722 1.00 0.00 C ATOM 253 O LYS A 18 -7.149 17.289 9.922 1.00 0.00 O ATOM 254 CB LYS A 18 -10.243 18.512 10.138 1.00 0.00 C ATOM 255 CG LYS A 18 -11.668 17.918 10.023 1.00 0.00 C ATOM 256 CD LYS A 18 -12.572 18.586 8.966 1.00 0.00 C ATOM 257 CE LYS A 18 -12.183 18.269 7.507 1.00 0.00 C ATOM 258 NZ LYS A 18 -13.150 18.840 6.552 1.00 0.00 N ATOM 0 H LYS A 18 -10.230 18.474 12.743 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.461 16.639 10.705 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -10.312 19.516 10.557 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -9.820 18.612 9.138 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -11.585 16.857 9.789 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -12.156 17.993 10.995 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -13.601 18.269 9.132 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.544 19.666 9.111 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -11.189 18.666 7.300 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -12.130 17.189 7.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -12.858 18.608 5.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -14.094 18.442 6.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.182 19.873 6.666 1.00 0.00 H new ATOM 271 N LYS A 19 -7.173 18.973 11.418 1.00 0.00 N ATOM 272 CA LYS A 19 -5.701 19.154 11.415 1.00 0.00 C ATOM 273 C LYS A 19 -4.977 17.922 12.040 1.00 0.00 C ATOM 274 O LYS A 19 -4.042 17.458 11.388 1.00 0.00 O ATOM 275 CB LYS A 19 -5.261 20.479 12.094 1.00 0.00 C ATOM 276 CG LYS A 19 -5.676 21.786 11.373 1.00 0.00 C ATOM 277 CD LYS A 19 -5.112 22.015 9.952 1.00 0.00 C ATOM 278 CE LYS A 19 -3.577 22.132 9.876 1.00 0.00 C ATOM 279 NZ LYS A 19 -3.121 22.390 8.499 1.00 0.00 N ATOM 0 H LYS A 19 -7.676 19.654 11.987 1.00 0.00 H new ATOM 0 HA LYS A 19 -5.397 19.227 10.371 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.671 20.499 13.104 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.175 20.471 12.191 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -6.764 21.809 11.313 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -5.374 22.627 11.997 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.432 21.192 9.313 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.552 22.925 9.544 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -3.240 22.937 10.529 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -3.123 21.212 10.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.084 22.463 8.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -3.422 21.609 7.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -3.535 23.281 8.157 1.00 0.00 H new ATOM 292 N ASP A 20 -5.395 17.351 13.206 1.00 0.00 N ATOM 293 CA ASP A 20 -4.739 16.120 13.762 1.00 0.00 C ATOM 294 C ASP A 20 -4.896 14.813 12.934 1.00 0.00 C ATOM 295 O ASP A 20 -4.007 13.966 13.010 1.00 0.00 O ATOM 296 CB ASP A 20 -5.160 15.863 15.237 1.00 0.00 C ATOM 297 CG ASP A 20 -4.334 16.660 16.254 1.00 0.00 C ATOM 298 OD1 ASP A 20 -3.260 16.267 16.709 1.00 0.00 O ATOM 299 OD2 ASP A 20 -4.926 17.852 16.586 1.00 0.00 O ATOM 0 H ASP A 20 -6.165 17.710 13.771 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.678 16.364 13.702 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.213 16.118 15.356 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.063 14.799 15.455 1.00 0.00 H new ATOM 305 N ALA A 21 -5.981 14.643 12.169 1.00 0.00 N ATOM 306 CA ALA A 21 -6.174 13.504 11.243 1.00 0.00 C ATOM 307 C ALA A 21 -5.298 13.568 9.968 1.00 0.00 C ATOM 308 O ALA A 21 -4.822 12.517 9.534 1.00 0.00 O ATOM 309 CB ALA A 21 -7.666 13.445 10.887 1.00 0.00 C ATOM 0 H ALA A 21 -6.764 15.297 12.171 1.00 0.00 H new ATOM 0 HA ALA A 21 -5.849 12.595 11.749 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.845 12.615 10.204 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.251 13.300 11.795 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -7.963 14.378 10.409 1.00 0.00 H new ATOM 315 N THR A 22 -5.077 14.761 9.374 1.00 0.00 N ATOM 316 CA THR A 22 -4.188 14.911 8.169 1.00 0.00 C ATOM 317 C THR A 22 -2.677 14.804 8.436 1.00 0.00 C ATOM 318 O THR A 22 -1.912 14.206 7.678 1.00 0.00 O ATOM 319 CB THR A 22 -4.577 16.089 7.279 1.00 0.00 C ATOM 320 OG1 THR A 22 -4.246 15.763 5.930 1.00 0.00 O ATOM 321 CG2 THR A 22 -4.364 17.579 7.449 1.00 0.00 C ATOM 0 H THR A 22 -5.492 15.636 9.695 1.00 0.00 H new ATOM 0 HA THR A 22 -4.392 14.013 7.586 1.00 0.00 H new ATOM 0 HB THR A 22 -5.589 16.115 7.683 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.449 15.193 5.917 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.786 18.107 6.594 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.856 17.915 8.362 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.296 17.789 7.514 1.00 0.00 H new ATOM 329 N LYS A 23 -2.302 15.420 9.550 1.00 0.00 N ATOM 330 CA LYS A 23 -1.040 15.192 10.270 1.00 0.00 C ATOM 331 C LYS A 23 -0.740 13.704 10.576 1.00 0.00 C ATOM 332 O LYS A 23 0.368 13.269 10.295 1.00 0.00 O ATOM 333 CB LYS A 23 -1.337 15.887 11.633 1.00 0.00 C ATOM 334 CG LYS A 23 -0.968 17.393 11.666 1.00 0.00 C ATOM 335 CD LYS A 23 -1.239 18.136 12.993 1.00 0.00 C ATOM 336 CE LYS A 23 -0.443 17.627 14.211 1.00 0.00 C ATOM 337 NZ LYS A 23 -0.703 18.448 15.406 1.00 0.00 N ATOM 0 H LYS A 23 -2.888 16.123 10.001 1.00 0.00 H new ATOM 0 HA LYS A 23 -0.189 15.550 9.690 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -2.397 15.778 11.861 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.787 15.371 12.420 1.00 0.00 H new ATOM 0 HG2 LYS A 23 0.092 17.491 11.430 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -1.519 17.898 10.873 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -1.015 19.193 12.850 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -2.303 18.063 13.220 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.711 16.590 14.415 1.00 0.00 H new ATOM 0 HE3 LYS A 23 0.623 17.642 13.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -0.152 18.079 16.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -0.424 19.432 15.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -1.716 18.413 15.637 1.00 0.00 H new ATOM 350 N ALA A 24 -1.716 12.979 11.151 1.00 0.00 N ATOM 351 CA ALA A 24 -1.631 11.544 11.482 1.00 0.00 C ATOM 352 C ALA A 24 -1.515 10.597 10.263 1.00 0.00 C ATOM 353 O ALA A 24 -0.764 9.630 10.327 1.00 0.00 O ATOM 354 CB ALA A 24 -2.820 11.269 12.379 1.00 0.00 C ATOM 0 H ALA A 24 -2.615 13.388 11.407 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.694 11.325 11.994 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.823 10.218 12.667 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.753 11.890 13.273 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.741 11.502 11.844 1.00 0.00 H new ATOM 360 N VAL A 25 -2.208 10.881 9.146 1.00 0.00 N ATOM 361 CA VAL A 25 -1.926 10.297 7.804 1.00 0.00 C ATOM 362 C VAL A 25 -0.422 10.569 7.439 1.00 0.00 C ATOM 363 O VAL A 25 0.323 9.611 7.240 1.00 0.00 O ATOM 364 CB VAL A 25 -2.968 11.041 6.878 1.00 0.00 C ATOM 365 CG1 VAL A 25 -2.505 11.219 5.413 1.00 0.00 C ATOM 366 CG2 VAL A 25 -4.361 10.385 6.912 1.00 0.00 C ATOM 0 H VAL A 25 -2.994 11.532 9.140 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.039 9.216 7.718 1.00 0.00 H new ATOM 0 HB VAL A 25 -3.037 12.039 7.311 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -3.279 11.738 4.847 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -1.585 11.803 5.391 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.324 10.241 4.967 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.038 10.935 6.259 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.286 9.353 6.570 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.746 10.402 7.931 1.00 0.00 H new ATOM 376 N ASP A 26 0.018 11.851 7.415 1.00 0.00 N ATOM 377 CA ASP A 26 1.464 12.220 7.234 1.00 0.00 C ATOM 378 C ASP A 26 2.371 12.053 8.519 1.00 0.00 C ATOM 379 O ASP A 26 3.286 12.821 8.826 1.00 0.00 O ATOM 380 CB ASP A 26 1.452 13.668 6.701 1.00 0.00 C ATOM 381 CG ASP A 26 2.756 14.129 6.031 1.00 0.00 C ATOM 382 OD1 ASP A 26 3.132 13.723 4.933 1.00 0.00 O ATOM 383 OD2 ASP A 26 3.442 15.035 6.798 1.00 0.00 O ATOM 0 H ASP A 26 -0.601 12.655 7.518 1.00 0.00 H new ATOM 0 HA ASP A 26 1.933 11.524 6.538 1.00 0.00 H new ATOM 0 HB2 ASP A 26 0.638 13.767 5.983 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.230 14.341 7.529 1.00 0.00 H new ATOM 389 N ALA A 27 2.005 11.027 9.272 1.00 0.00 N ATOM 390 CA ALA A 27 2.676 10.478 10.468 1.00 0.00 C ATOM 391 C ALA A 27 2.995 8.973 10.209 1.00 0.00 C ATOM 392 O ALA A 27 4.132 8.534 10.395 1.00 0.00 O ATOM 393 CB ALA A 27 1.847 10.757 11.720 1.00 0.00 C ATOM 0 H ALA A 27 1.158 10.503 9.053 1.00 0.00 H new ATOM 0 HA ALA A 27 3.630 10.972 10.656 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.355 10.346 12.592 1.00 0.00 H new ATOM 0 HB2 ALA A 27 1.726 11.833 11.844 1.00 0.00 H new ATOM 0 HB3 ALA A 27 0.867 10.291 11.619 1.00 0.00 H new ATOM 399 N VAL A 28 1.974 8.208 9.750 1.00 0.00 N ATOM 400 CA VAL A 28 2.105 6.826 9.203 1.00 0.00 C ATOM 401 C VAL A 28 3.000 6.861 7.929 1.00 0.00 C ATOM 402 O VAL A 28 4.076 6.268 7.895 1.00 0.00 O ATOM 403 CB VAL A 28 0.681 6.260 8.814 1.00 0.00 C ATOM 404 CG1 VAL A 28 0.654 4.799 8.350 1.00 0.00 C ATOM 405 CG2 VAL A 28 -0.359 6.317 9.910 1.00 0.00 C ATOM 0 H VAL A 28 1.010 8.540 9.748 1.00 0.00 H new ATOM 0 HA VAL A 28 2.555 6.184 9.961 1.00 0.00 H new ATOM 0 HB VAL A 28 0.442 6.941 7.997 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.370 4.513 8.108 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.281 4.687 7.465 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.032 4.157 9.146 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.299 5.905 9.542 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.018 5.734 10.766 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.511 7.353 10.214 1.00 0.00 H new ATOM 415 N PHE A 29 2.502 7.596 6.923 1.00 0.00 N ATOM 416 CA PHE A 29 3.135 7.777 5.586 1.00 0.00 C ATOM 417 C PHE A 29 4.452 8.586 5.608 1.00 0.00 C ATOM 418 O PHE A 29 5.280 8.351 4.734 1.00 0.00 O ATOM 419 CB PHE A 29 2.085 8.262 4.537 1.00 0.00 C ATOM 420 CG PHE A 29 0.823 7.378 4.463 1.00 0.00 C ATOM 421 CD1 PHE A 29 0.928 5.990 4.300 1.00 0.00 C ATOM 422 CD2 PHE A 29 -0.411 7.931 4.803 1.00 0.00 C ATOM 423 CE1 PHE A 29 -0.162 5.168 4.539 1.00 0.00 C ATOM 424 CE2 PHE A 29 -1.495 7.108 5.078 1.00 0.00 C ATOM 425 CZ PHE A 29 -1.360 5.727 4.962 1.00 0.00 C ATOM 0 H PHE A 29 1.620 8.101 7.010 1.00 0.00 H new ATOM 0 HA PHE A 29 3.473 6.795 5.256 1.00 0.00 H new ATOM 0 HB2 PHE A 29 1.788 9.283 4.779 1.00 0.00 H new ATOM 0 HB3 PHE A 29 2.555 8.291 3.554 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.866 5.557 3.985 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -0.524 9.004 4.853 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -0.080 4.101 4.397 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -2.439 7.537 5.381 1.00 0.00 H new ATOM 0 HZ PHE A 29 -2.195 5.085 5.203 1.00 0.00 H new ATOM 435 N ASP A 30 4.693 9.481 6.591 1.00 0.00 N ATOM 436 CA ASP A 30 6.045 10.077 6.805 1.00 0.00 C ATOM 437 C ASP A 30 7.099 9.023 7.269 1.00 0.00 C ATOM 438 O ASP A 30 8.239 9.051 6.805 1.00 0.00 O ATOM 439 CB ASP A 30 5.954 11.225 7.831 1.00 0.00 C ATOM 440 CG ASP A 30 7.116 12.225 7.769 1.00 0.00 C ATOM 441 OD1 ASP A 30 8.151 12.103 8.424 1.00 0.00 O ATOM 442 OD2 ASP A 30 6.864 13.258 6.903 1.00 0.00 O ATOM 0 H ASP A 30 3.983 9.808 7.246 1.00 0.00 H new ATOM 0 HA ASP A 30 6.384 10.464 5.844 1.00 0.00 H new ATOM 0 HB2 ASP A 30 5.019 11.763 7.674 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.911 10.798 8.833 1.00 0.00 H new ATOM 448 N SER A 31 6.697 8.126 8.190 1.00 0.00 N ATOM 449 CA SER A 31 7.531 6.984 8.636 1.00 0.00 C ATOM 450 C SER A 31 7.662 5.840 7.587 1.00 0.00 C ATOM 451 O SER A 31 8.701 5.178 7.622 1.00 0.00 O ATOM 452 CB SER A 31 7.022 6.429 9.964 1.00 0.00 C ATOM 453 OG SER A 31 7.060 7.411 10.993 1.00 0.00 O ATOM 0 H SER A 31 5.786 8.169 8.648 1.00 0.00 H new ATOM 0 HA SER A 31 8.535 7.389 8.765 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.000 6.070 9.841 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.628 5.572 10.256 1.00 0.00 H new ATOM 0 HG SER A 31 6.217 7.911 10.999 1.00 0.00 H new ATOM 459 N ILE A 32 6.674 5.556 6.684 1.00 0.00 N ATOM 460 CA ILE A 32 6.894 4.693 5.508 1.00 0.00 C ATOM 461 C ILE A 32 7.975 5.411 4.617 1.00 0.00 C ATOM 462 O ILE A 32 8.912 4.738 4.202 1.00 0.00 O ATOM 463 CB ILE A 32 5.641 4.432 4.581 1.00 0.00 C ATOM 464 CG1 ILE A 32 4.366 3.613 4.930 1.00 0.00 C ATOM 465 CG2 ILE A 32 6.210 3.635 3.361 1.00 0.00 C ATOM 466 CD1 ILE A 32 3.381 3.819 6.085 1.00 0.00 C ATOM 0 H ILE A 32 5.723 5.918 6.759 1.00 0.00 H new ATOM 0 HA ILE A 32 7.178 3.718 5.904 1.00 0.00 H new ATOM 0 HB ILE A 32 5.248 5.448 4.545 1.00 0.00 H new ATOM 0 HG12 ILE A 32 3.754 3.650 4.029 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.713 2.585 5.037 1.00 0.00 H new ATOM 0 HG21 ILE A 32 5.402 3.411 2.664 1.00 0.00 H new ATOM 0 HG22 ILE A 32 6.969 4.234 2.857 1.00 0.00 H new ATOM 0 HG23 ILE A 32 6.656 2.704 3.711 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.597 3.064 6.034 1.00 0.00 H new ATOM 0 HD12 ILE A 32 3.909 3.730 7.034 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.935 4.811 6.010 1.00 0.00 H new ATOM 478 N THR A 33 7.778 6.677 4.203 1.00 0.00 N ATOM 479 CA THR A 33 8.756 7.385 3.328 1.00 0.00 C ATOM 480 C THR A 33 10.194 7.439 3.906 1.00 0.00 C ATOM 481 O THR A 33 11.142 7.290 3.147 1.00 0.00 O ATOM 482 CB THR A 33 8.279 8.778 2.874 1.00 0.00 C ATOM 483 OG1 THR A 33 8.224 9.694 3.964 1.00 0.00 O ATOM 484 CG2 THR A 33 6.916 8.767 2.171 1.00 0.00 C ATOM 0 H THR A 33 6.961 7.234 4.453 1.00 0.00 H new ATOM 0 HA THR A 33 8.807 6.762 2.435 1.00 0.00 H new ATOM 0 HB THR A 33 9.025 9.102 2.148 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.243 9.198 4.809 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.648 9.783 1.881 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.970 8.138 1.282 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.160 8.372 2.849 1.00 0.00 H new ATOM 492 N GLU A 34 10.321 7.596 5.234 1.00 0.00 N ATOM 493 CA GLU A 34 11.597 7.422 5.958 1.00 0.00 C ATOM 494 C GLU A 34 12.041 5.930 5.992 1.00 0.00 C ATOM 495 O GLU A 34 13.252 5.709 5.970 1.00 0.00 O ATOM 496 CB GLU A 34 11.489 8.074 7.364 1.00 0.00 C ATOM 497 CG GLU A 34 12.775 8.126 8.223 1.00 0.00 C ATOM 498 CD GLU A 34 13.834 9.130 7.754 1.00 0.00 C ATOM 499 OE1 GLU A 34 14.070 10.185 8.341 1.00 0.00 O ATOM 500 OE2 GLU A 34 14.484 8.715 6.621 1.00 0.00 O ATOM 0 H GLU A 34 9.540 7.848 5.840 1.00 0.00 H new ATOM 0 HA GLU A 34 12.393 7.939 5.422 1.00 0.00 H new ATOM 0 HB2 GLU A 34 11.128 9.094 7.236 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.728 7.535 7.928 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.498 8.368 9.249 1.00 0.00 H new ATOM 0 HG3 GLU A 34 13.222 7.132 8.239 1.00 0.00 H new ATOM 508 N ALA A 35 11.134 4.914 6.016 1.00 0.00 N ATOM 509 CA ALA A 35 11.532 3.507 5.818 1.00 0.00 C ATOM 510 C ALA A 35 12.083 3.281 4.398 1.00 0.00 C ATOM 511 O ALA A 35 13.283 3.040 4.265 1.00 0.00 O ATOM 512 CB ALA A 35 10.373 2.513 6.100 1.00 0.00 C ATOM 0 H ALA A 35 10.135 5.049 6.169 1.00 0.00 H new ATOM 0 HA ALA A 35 12.320 3.308 6.544 1.00 0.00 H new ATOM 0 HB1 ALA A 35 10.721 1.493 5.939 1.00 0.00 H new ATOM 0 HB2 ALA A 35 10.041 2.624 7.132 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.542 2.723 5.427 1.00 0.00 H new ATOM 518 N LEU A 36 11.271 3.423 3.339 1.00 0.00 N ATOM 519 CA LEU A 36 11.722 3.134 1.967 1.00 0.00 C ATOM 520 C LEU A 36 12.829 4.044 1.449 1.00 0.00 C ATOM 521 O LEU A 36 13.748 3.524 0.809 1.00 0.00 O ATOM 522 CB LEU A 36 10.493 3.131 1.065 1.00 0.00 C ATOM 523 CG LEU A 36 9.516 1.894 1.289 1.00 0.00 C ATOM 524 CD1 LEU A 36 9.929 0.773 2.292 1.00 0.00 C ATOM 525 CD2 LEU A 36 7.994 1.790 1.298 1.00 0.00 C ATOM 0 H LEU A 36 10.302 3.735 3.405 1.00 0.00 H new ATOM 0 HA LEU A 36 12.200 2.154 1.967 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.935 4.053 1.228 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.820 3.136 0.025 1.00 0.00 H new ATOM 0 HG LEU A 36 9.765 1.915 0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 36 9.152 0.009 2.324 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.868 0.323 1.969 1.00 0.00 H new ATOM 0 HD13 LEU A 36 10.056 1.203 3.286 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.701 0.758 1.488 1.00 0.00 H new ATOM 0 HD22 LEU A 36 7.590 2.432 2.081 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.602 2.106 0.331 1.00 0.00 H new ATOM 537 N ARG A 37 12.793 5.366 1.732 1.00 0.00 N ATOM 538 CA ARG A 37 13.904 6.229 1.308 1.00 0.00 C ATOM 539 C ARG A 37 15.257 5.898 2.022 1.00 0.00 C ATOM 540 O ARG A 37 16.298 6.072 1.382 1.00 0.00 O ATOM 541 CB ARG A 37 13.596 7.749 1.344 1.00 0.00 C ATOM 542 CG ARG A 37 13.858 8.487 2.686 1.00 0.00 C ATOM 543 CD ARG A 37 13.108 9.815 2.766 1.00 0.00 C ATOM 544 NE ARG A 37 13.269 10.484 4.081 1.00 0.00 N ATOM 545 CZ ARG A 37 12.345 11.282 4.655 1.00 0.00 C ATOM 546 NH1 ARG A 37 11.159 11.560 4.118 1.00 0.00 N ATOM 547 NH2 ARG A 37 12.633 11.827 5.822 1.00 0.00 N ATOM 0 H ARG A 37 12.039 5.837 2.231 1.00 0.00 H new ATOM 0 HA ARG A 37 14.028 5.981 0.254 1.00 0.00 H new ATOM 0 HB2 ARG A 37 14.189 8.234 0.569 1.00 0.00 H new ATOM 0 HB3 ARG A 37 12.548 7.889 1.078 1.00 0.00 H new ATOM 0 HG2 ARG A 37 13.554 7.849 3.516 1.00 0.00 H new ATOM 0 HG3 ARG A 37 14.927 8.667 2.798 1.00 0.00 H new ATOM 0 HD2 ARG A 37 13.467 10.478 1.979 1.00 0.00 H new ATOM 0 HD3 ARG A 37 12.048 9.641 2.578 1.00 0.00 H new ATOM 0 HE ARG A 37 14.141 10.329 4.587 1.00 0.00 H new ATOM 0 HH11 ARG A 37 10.901 11.160 3.216 1.00 0.00 H new ATOM 0 HH12 ARG A 37 10.508 12.173 4.609 1.00 0.00 H new ATOM 0 HH21 ARG A 37 13.533 11.640 6.264 1.00 0.00 H new ATOM 0 HH22 ARG A 37 11.956 12.435 6.282 1.00 0.00 H new ATOM 560 N LYS A 38 15.247 5.465 3.320 1.00 0.00 N ATOM 561 CA LYS A 38 16.518 5.261 4.068 1.00 0.00 C ATOM 562 C LYS A 38 17.111 3.803 4.008 1.00 0.00 C ATOM 563 O LYS A 38 18.039 3.494 4.762 1.00 0.00 O ATOM 564 CB LYS A 38 16.272 5.744 5.529 1.00 0.00 C ATOM 565 CG LYS A 38 17.526 6.074 6.375 1.00 0.00 C ATOM 566 CD LYS A 38 17.239 6.789 7.716 1.00 0.00 C ATOM 567 CE LYS A 38 16.388 6.026 8.754 1.00 0.00 C ATOM 568 NZ LYS A 38 17.079 4.855 9.326 1.00 0.00 N ATOM 0 H LYS A 38 14.401 5.258 3.851 1.00 0.00 H new ATOM 0 HA LYS A 38 17.297 5.848 3.581 1.00 0.00 H new ATOM 0 HB2 LYS A 38 15.644 6.634 5.491 1.00 0.00 H new ATOM 0 HB3 LYS A 38 15.703 4.974 6.050 1.00 0.00 H new ATOM 0 HG2 LYS A 38 18.061 5.147 6.582 1.00 0.00 H new ATOM 0 HG3 LYS A 38 18.192 6.700 5.782 1.00 0.00 H new ATOM 0 HD2 LYS A 38 18.195 7.036 8.178 1.00 0.00 H new ATOM 0 HD3 LYS A 38 16.738 7.732 7.496 1.00 0.00 H new ATOM 0 HE2 LYS A 38 16.113 6.707 9.560 1.00 0.00 H new ATOM 0 HE3 LYS A 38 15.461 5.698 8.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 16.707 4.664 10.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 16.918 4.026 8.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 18.099 5.048 9.385 1.00 0.00 H new ATOM 581 N GLY A 39 16.620 2.904 3.124 1.00 0.00 N ATOM 582 CA GLY A 39 16.996 1.462 3.143 1.00 0.00 C ATOM 583 C GLY A 39 16.422 0.686 4.365 1.00 0.00 C ATOM 584 O GLY A 39 17.151 -0.044 5.040 1.00 0.00 O ATOM 0 H GLY A 39 15.961 3.148 2.385 1.00 0.00 H new ATOM 0 HA2 GLY A 39 16.644 0.991 2.225 1.00 0.00 H new ATOM 0 HA3 GLY A 39 18.083 1.378 3.147 1.00 0.00 H new ATOM 588 N ASP A 40 15.115 0.872 4.621 1.00 0.00 N ATOM 589 CA ASP A 40 14.390 0.333 5.802 1.00 0.00 C ATOM 590 C ASP A 40 13.025 -0.265 5.376 1.00 0.00 C ATOM 591 O ASP A 40 12.350 0.212 4.457 1.00 0.00 O ATOM 592 CB ASP A 40 14.340 1.388 6.943 1.00 0.00 C ATOM 593 CG ASP A 40 15.618 1.468 7.792 1.00 0.00 C ATOM 594 OD1 ASP A 40 16.574 2.188 7.507 1.00 0.00 O ATOM 595 OD2 ASP A 40 15.568 0.642 8.886 1.00 0.00 O ATOM 0 H ASP A 40 14.512 1.414 4.002 1.00 0.00 H new ATOM 0 HA ASP A 40 14.935 -0.507 6.232 1.00 0.00 H new ATOM 0 HB2 ASP A 40 14.147 2.368 6.507 1.00 0.00 H new ATOM 0 HB3 ASP A 40 13.498 1.158 7.597 1.00 0.00 H new ATOM 601 N LYS A 41 12.650 -1.358 6.064 1.00 0.00 N ATOM 602 CA LYS A 41 11.405 -2.109 5.789 1.00 0.00 C ATOM 603 C LYS A 41 10.332 -1.712 6.831 1.00 0.00 C ATOM 604 O LYS A 41 10.574 -1.633 8.042 1.00 0.00 O ATOM 605 CB LYS A 41 11.589 -3.648 5.879 1.00 0.00 C ATOM 606 CG LYS A 41 12.744 -4.275 5.060 1.00 0.00 C ATOM 607 CD LYS A 41 12.931 -5.792 5.279 1.00 0.00 C ATOM 608 CE LYS A 41 11.799 -6.679 4.721 1.00 0.00 C ATOM 609 NZ LYS A 41 12.066 -8.108 4.957 1.00 0.00 N ATOM 0 H LYS A 41 13.201 -1.749 6.829 1.00 0.00 H new ATOM 0 HA LYS A 41 11.109 -1.857 4.771 1.00 0.00 H new ATOM 0 HB2 LYS A 41 11.738 -3.909 6.927 1.00 0.00 H new ATOM 0 HB3 LYS A 41 10.658 -4.118 5.563 1.00 0.00 H new ATOM 0 HG2 LYS A 41 12.563 -4.093 4.001 1.00 0.00 H new ATOM 0 HG3 LYS A 41 13.673 -3.766 5.316 1.00 0.00 H new ATOM 0 HD2 LYS A 41 13.871 -6.097 4.818 1.00 0.00 H new ATOM 0 HD3 LYS A 41 13.025 -5.980 6.349 1.00 0.00 H new ATOM 0 HE2 LYS A 41 10.854 -6.402 5.189 1.00 0.00 H new ATOM 0 HE3 LYS A 41 11.689 -6.500 3.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 11.285 -8.676 4.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 12.955 -8.377 4.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 12.146 -8.282 5.979 1.00 0.00 H new ATOM 622 N VAL A 42 9.112 -1.562 6.324 1.00 0.00 N ATOM 623 CA VAL A 42 7.907 -1.252 7.083 1.00 0.00 C ATOM 624 C VAL A 42 7.292 -2.615 7.469 1.00 0.00 C ATOM 625 O VAL A 42 7.420 -3.647 6.794 1.00 0.00 O ATOM 626 CB VAL A 42 7.003 -0.415 6.153 1.00 0.00 C ATOM 627 CG1 VAL A 42 5.866 0.265 6.868 1.00 0.00 C ATOM 628 CG2 VAL A 42 7.688 0.779 5.498 1.00 0.00 C ATOM 0 H VAL A 42 8.929 -1.658 5.325 1.00 0.00 H new ATOM 0 HA VAL A 42 8.071 -0.675 7.993 1.00 0.00 H new ATOM 0 HB VAL A 42 6.695 -1.179 5.439 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.274 0.834 6.151 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.235 -0.485 7.345 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.264 0.939 7.626 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.974 1.305 4.864 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.056 1.456 6.269 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.524 0.431 4.892 1.00 0.00 H new ATOM 638 N GLN A 43 6.612 -2.555 8.601 1.00 0.00 N ATOM 639 CA GLN A 43 6.218 -3.791 9.339 1.00 0.00 C ATOM 640 C GLN A 43 4.760 -4.154 9.669 1.00 0.00 C ATOM 641 O GLN A 43 4.577 -5.227 10.257 1.00 0.00 O ATOM 642 CB GLN A 43 7.240 -4.045 10.496 1.00 0.00 C ATOM 643 CG GLN A 43 8.721 -4.305 10.125 1.00 0.00 C ATOM 644 CD GLN A 43 8.990 -5.637 9.401 1.00 0.00 C ATOM 645 OE1 GLN A 43 8.682 -6.716 9.908 1.00 0.00 O ATOM 646 NE2 GLN A 43 9.580 -5.598 8.217 1.00 0.00 N ATOM 0 H GLN A 43 6.314 -1.685 9.043 1.00 0.00 H new ATOM 0 HA GLN A 43 6.271 -4.535 8.544 1.00 0.00 H new ATOM 0 HB2 GLN A 43 7.211 -3.182 11.161 1.00 0.00 H new ATOM 0 HB3 GLN A 43 6.886 -4.901 11.070 1.00 0.00 H new ATOM 0 HG2 GLN A 43 9.069 -3.489 9.492 1.00 0.00 H new ATOM 0 HG3 GLN A 43 9.318 -4.278 11.037 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.833 -4.701 7.802 1.00 0.00 H new ATOM 0 HE22 GLN A 43 9.782 -6.465 7.719 1.00 0.00 H new ATOM 655 N LEU A 44 3.729 -3.411 9.231 1.00 0.00 N ATOM 656 CA LEU A 44 2.328 -3.628 9.693 1.00 0.00 C ATOM 657 C LEU A 44 1.764 -5.052 9.430 1.00 0.00 C ATOM 658 O LEU A 44 1.546 -5.448 8.281 1.00 0.00 O ATOM 659 CB LEU A 44 1.291 -2.574 9.195 1.00 0.00 C ATOM 660 CG LEU A 44 1.538 -1.078 9.545 1.00 0.00 C ATOM 661 CD1 LEU A 44 2.473 -0.365 8.548 1.00 0.00 C ATOM 662 CD2 LEU A 44 0.207 -0.308 9.624 1.00 0.00 C ATOM 0 H LEU A 44 3.830 -2.652 8.557 1.00 0.00 H new ATOM 0 HA LEU A 44 2.447 -3.500 10.769 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.228 -2.656 8.110 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.315 -2.853 9.593 1.00 0.00 H new ATOM 0 HG LEU A 44 2.032 -1.079 10.517 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.603 0.674 8.850 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.442 -0.864 8.538 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.036 -0.401 7.550 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.404 0.735 9.870 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.303 -0.364 8.662 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.424 -0.750 10.396 1.00 0.00 H new ATOM 674 N ILE A 45 1.552 -5.811 10.524 1.00 0.00 N ATOM 675 CA ILE A 45 0.876 -7.133 10.472 1.00 0.00 C ATOM 676 C ILE A 45 -0.651 -6.840 10.553 1.00 0.00 C ATOM 677 O ILE A 45 -1.118 -5.973 11.304 1.00 0.00 O ATOM 678 CB ILE A 45 1.451 -8.155 11.503 1.00 0.00 C ATOM 679 CG1 ILE A 45 1.080 -9.640 11.214 1.00 0.00 C ATOM 680 CG2 ILE A 45 1.072 -7.803 12.953 1.00 0.00 C ATOM 681 CD1 ILE A 45 1.651 -10.232 9.915 1.00 0.00 C ATOM 0 H ILE A 45 1.840 -5.533 11.462 1.00 0.00 H new ATOM 0 HA ILE A 45 1.073 -7.662 9.539 1.00 0.00 H new ATOM 0 HB ILE A 45 2.531 -8.066 11.381 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.423 -10.250 12.050 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.006 -9.724 11.182 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.496 -8.544 13.630 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.464 -6.817 13.203 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.013 -7.798 13.054 1.00 0.00 H new ATOM 0 HD11 ILE A 45 1.330 -11.269 9.816 1.00 0.00 H new ATOM 0 HD12 ILE A 45 1.289 -9.657 9.063 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.740 -10.191 9.944 1.00 0.00 H new ATOM 693 N GLY A 46 -1.401 -7.585 9.747 1.00 0.00 N ATOM 694 CA GLY A 46 -2.834 -7.287 9.516 1.00 0.00 C ATOM 695 C GLY A 46 -3.134 -6.524 8.190 1.00 0.00 C ATOM 696 O GLY A 46 -4.217 -6.709 7.629 1.00 0.00 O ATOM 0 H GLY A 46 -1.054 -8.399 9.239 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -3.390 -8.224 9.514 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.208 -6.696 10.352 1.00 0.00 H new ATOM 700 N PHE A 47 -2.205 -5.662 7.706 1.00 0.00 N ATOM 701 CA PHE A 47 -2.423 -4.787 6.542 1.00 0.00 C ATOM 702 C PHE A 47 -1.184 -4.432 5.660 1.00 0.00 C ATOM 703 O PHE A 47 -1.359 -4.506 4.444 1.00 0.00 O ATOM 704 CB PHE A 47 -3.052 -3.466 7.078 1.00 0.00 C ATOM 705 CG PHE A 47 -3.834 -2.717 5.984 1.00 0.00 C ATOM 706 CD1 PHE A 47 -3.155 -1.948 5.031 1.00 0.00 C ATOM 707 CD2 PHE A 47 -5.208 -2.933 5.836 1.00 0.00 C ATOM 708 CE1 PHE A 47 -3.820 -1.485 3.902 1.00 0.00 C ATOM 709 CE2 PHE A 47 -5.874 -2.418 4.730 1.00 0.00 C ATOM 710 CZ PHE A 47 -5.174 -1.745 3.741 1.00 0.00 C ATOM 0 H PHE A 47 -1.279 -5.559 8.121 1.00 0.00 H new ATOM 0 HA PHE A 47 -3.061 -5.357 5.866 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -3.719 -3.693 7.910 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -2.264 -2.821 7.467 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -2.110 -1.714 5.174 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.750 -3.499 6.579 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -3.284 -0.924 3.151 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -6.943 -2.543 4.641 1.00 0.00 H new ATOM 0 HZ PHE A 47 -5.682 -1.423 2.844 1.00 0.00 H new ATOM 720 N GLY A 48 -0.018 -3.969 6.173 1.00 0.00 N ATOM 721 CA GLY A 48 1.027 -3.381 5.305 1.00 0.00 C ATOM 722 C GLY A 48 2.487 -3.585 5.698 1.00 0.00 C ATOM 723 O GLY A 48 3.078 -2.689 6.306 1.00 0.00 O ATOM 0 H GLY A 48 0.218 -3.991 7.165 1.00 0.00 H new ATOM 0 HA2 GLY A 48 0.892 -3.784 4.301 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.845 -2.308 5.244 1.00 0.00 H new ATOM 727 N ASN A 49 3.085 -4.720 5.292 1.00 0.00 N ATOM 728 CA ASN A 49 4.541 -4.951 5.479 1.00 0.00 C ATOM 729 C ASN A 49 5.205 -4.490 4.144 1.00 0.00 C ATOM 730 O ASN A 49 5.295 -5.239 3.169 1.00 0.00 O ATOM 731 CB ASN A 49 4.802 -6.421 5.911 1.00 0.00 C ATOM 732 CG ASN A 49 6.250 -6.737 6.339 1.00 0.00 C ATOM 733 OD1 ASN A 49 7.217 -6.449 5.633 1.00 0.00 O ATOM 734 ND2 ASN A 49 6.429 -7.365 7.491 1.00 0.00 N ATOM 0 H ASN A 49 2.594 -5.489 4.836 1.00 0.00 H new ATOM 0 HA ASN A 49 4.988 -4.379 6.292 1.00 0.00 H new ATOM 0 HB2 ASN A 49 4.135 -6.662 6.739 1.00 0.00 H new ATOM 0 HB3 ASN A 49 4.534 -7.078 5.084 1.00 0.00 H new ATOM 0 HD21 ASN A 49 7.370 -7.612 7.796 1.00 0.00 H new ATOM 0 HD22 ASN A 49 5.625 -7.602 8.073 1.00 0.00 H new ATOM 741 N PHE A 50 5.629 -3.216 4.106 1.00 0.00 N ATOM 742 CA PHE A 50 6.240 -2.605 2.883 1.00 0.00 C ATOM 743 C PHE A 50 7.761 -2.852 2.868 1.00 0.00 C ATOM 744 O PHE A 50 8.388 -3.031 3.918 1.00 0.00 O ATOM 745 CB PHE A 50 6.089 -1.054 2.717 1.00 0.00 C ATOM 746 CG PHE A 50 4.741 -0.363 2.766 1.00 0.00 C ATOM 747 CD1 PHE A 50 3.993 -0.428 3.941 1.00 0.00 C ATOM 748 CD2 PHE A 50 4.400 0.573 1.779 1.00 0.00 C ATOM 749 CE1 PHE A 50 2.856 0.349 4.096 1.00 0.00 C ATOM 750 CE2 PHE A 50 3.262 1.360 1.938 1.00 0.00 C ATOM 751 CZ PHE A 50 2.489 1.225 3.088 1.00 0.00 C ATOM 0 H PHE A 50 5.566 -2.579 4.900 1.00 0.00 H new ATOM 0 HA PHE A 50 5.686 -3.089 2.078 1.00 0.00 H new ATOM 0 HB2 PHE A 50 6.704 -0.595 3.491 1.00 0.00 H new ATOM 0 HB3 PHE A 50 6.538 -0.797 1.758 1.00 0.00 H new ATOM 0 HD1 PHE A 50 4.302 -1.089 4.737 1.00 0.00 H new ATOM 0 HD2 PHE A 50 5.017 0.683 0.900 1.00 0.00 H new ATOM 0 HE1 PHE A 50 2.262 0.272 4.994 1.00 0.00 H new ATOM 0 HE2 PHE A 50 2.981 2.070 1.174 1.00 0.00 H new ATOM 0 HZ PHE A 50 1.589 1.812 3.196 1.00 0.00 H new ATOM 761 N GLU A 51 8.360 -2.815 1.664 1.00 0.00 N ATOM 762 CA GLU A 51 9.833 -2.872 1.550 1.00 0.00 C ATOM 763 C GLU A 51 10.375 -2.464 0.170 1.00 0.00 C ATOM 764 O GLU A 51 9.735 -2.626 -0.868 1.00 0.00 O ATOM 765 CB GLU A 51 10.453 -4.240 2.010 1.00 0.00 C ATOM 766 CG GLU A 51 10.047 -5.520 1.234 1.00 0.00 C ATOM 767 CD GLU A 51 8.634 -6.050 1.515 1.00 0.00 C ATOM 768 OE1 GLU A 51 7.705 -5.960 0.713 1.00 0.00 O ATOM 769 OE2 GLU A 51 8.530 -6.623 2.758 1.00 0.00 O ATOM 0 H GLU A 51 7.864 -2.748 0.775 1.00 0.00 H new ATOM 0 HA GLU A 51 10.167 -2.112 2.257 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.538 -4.149 1.960 1.00 0.00 H new ATOM 0 HB3 GLU A 51 10.194 -4.389 3.058 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.133 -5.318 0.166 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.764 -6.307 1.468 1.00 0.00 H new ATOM 777 N VAL A 52 11.622 -1.971 0.177 1.00 0.00 N ATOM 778 CA VAL A 52 12.328 -1.491 -1.010 1.00 0.00 C ATOM 779 C VAL A 52 12.888 -2.709 -1.834 1.00 0.00 C ATOM 780 O VAL A 52 13.023 -3.823 -1.309 1.00 0.00 O ATOM 781 CB VAL A 52 13.325 -0.463 -0.347 1.00 0.00 C ATOM 782 CG1 VAL A 52 14.771 -0.960 -0.357 1.00 0.00 C ATOM 783 CG2 VAL A 52 13.122 0.939 -0.929 1.00 0.00 C ATOM 0 H VAL A 52 12.176 -1.895 1.030 1.00 0.00 H new ATOM 0 HA VAL A 52 11.766 -0.989 -1.798 1.00 0.00 H new ATOM 0 HB VAL A 52 13.087 -0.383 0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 52 15.415 -0.215 0.111 1.00 0.00 H new ATOM 0 HG12 VAL A 52 14.838 -1.896 0.197 1.00 0.00 H new ATOM 0 HG13 VAL A 52 15.093 -1.123 -1.386 1.00 0.00 H new ATOM 0 HG21 VAL A 52 13.819 1.633 -0.459 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.302 0.916 -2.004 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.100 1.267 -0.739 1.00 0.00 H new ATOM 793 N ARG A 53 13.265 -2.478 -3.106 1.00 0.00 N ATOM 794 CA ARG A 53 13.752 -3.565 -3.985 1.00 0.00 C ATOM 795 C ARG A 53 14.999 -3.084 -4.769 1.00 0.00 C ATOM 796 O ARG A 53 14.842 -2.375 -5.764 1.00 0.00 O ATOM 797 CB ARG A 53 12.577 -3.902 -4.948 1.00 0.00 C ATOM 798 CG ARG A 53 12.551 -5.340 -5.506 1.00 0.00 C ATOM 799 CD ARG A 53 11.737 -6.350 -4.665 1.00 0.00 C ATOM 800 NE ARG A 53 12.323 -6.614 -3.324 1.00 0.00 N ATOM 801 CZ ARG A 53 11.621 -6.932 -2.219 1.00 0.00 C ATOM 802 NH1 ARG A 53 10.297 -7.078 -2.189 1.00 0.00 N ATOM 803 NH2 ARG A 53 12.288 -7.110 -1.093 1.00 0.00 N ATOM 0 H ARG A 53 13.243 -1.559 -3.547 1.00 0.00 H new ATOM 0 HA ARG A 53 14.050 -4.448 -3.419 1.00 0.00 H new ATOM 0 HB2 ARG A 53 11.639 -3.720 -4.423 1.00 0.00 H new ATOM 0 HB3 ARG A 53 12.611 -3.208 -5.788 1.00 0.00 H new ATOM 0 HG2 ARG A 53 12.140 -5.315 -6.515 1.00 0.00 H new ATOM 0 HG3 ARG A 53 13.576 -5.701 -5.588 1.00 0.00 H new ATOM 0 HD2 ARG A 53 10.722 -5.973 -4.541 1.00 0.00 H new ATOM 0 HD3 ARG A 53 11.663 -7.290 -5.212 1.00 0.00 H new ATOM 0 HE ARG A 53 13.337 -6.549 -3.234 1.00 0.00 H new ATOM 0 HH11 ARG A 53 9.750 -6.948 -3.040 1.00 0.00 H new ATOM 0 HH12 ARG A 53 9.830 -7.320 -1.315 1.00 0.00 H new ATOM 0 HH21 ARG A 53 13.303 -7.006 -1.079 1.00 0.00 H new ATOM 0 HH22 ARG A 53 11.789 -7.352 -0.237 1.00 0.00 H new ATOM 1134 N LYS A 75 15.867 1.529 -5.679 1.00 0.00 N ATOM 1135 CA LYS A 75 15.286 0.776 -4.533 1.00 0.00 C ATOM 1136 C LYS A 75 13.753 0.980 -4.671 1.00 0.00 C ATOM 1137 O LYS A 75 13.238 2.085 -4.491 1.00 0.00 O ATOM 1138 CB LYS A 75 15.798 1.149 -3.133 1.00 0.00 C ATOM 1139 CG LYS A 75 17.292 1.506 -2.972 1.00 0.00 C ATOM 1140 CD LYS A 75 17.674 1.755 -1.499 1.00 0.00 C ATOM 1141 CE LYS A 75 19.149 2.154 -1.322 1.00 0.00 C ATOM 1142 NZ LYS A 75 19.475 2.381 0.097 1.00 0.00 N ATOM 0 HA LYS A 75 15.599 -0.266 -4.595 1.00 0.00 H new ATOM 0 HB2 LYS A 75 15.213 1.998 -2.780 1.00 0.00 H new ATOM 0 HB3 LYS A 75 15.582 0.314 -2.466 1.00 0.00 H new ATOM 0 HG2 LYS A 75 17.903 0.697 -3.373 1.00 0.00 H new ATOM 0 HG3 LYS A 75 17.517 2.396 -3.560 1.00 0.00 H new ATOM 0 HD2 LYS A 75 17.039 2.542 -1.092 1.00 0.00 H new ATOM 0 HD3 LYS A 75 17.475 0.853 -0.920 1.00 0.00 H new ATOM 0 HE2 LYS A 75 19.791 1.370 -1.724 1.00 0.00 H new ATOM 0 HE3 LYS A 75 19.354 3.059 -1.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 20.476 2.649 0.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 18.878 3.146 0.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 19.301 1.509 0.637 1.00 0.00 H new ATOM 1155 N VAL A 76 13.055 -0.107 -5.015 1.00 0.00 N ATOM 1156 CA VAL A 76 11.664 -0.078 -5.515 1.00 0.00 C ATOM 1157 C VAL A 76 10.617 -0.389 -4.416 1.00 0.00 C ATOM 1158 O VAL A 76 10.584 -1.522 -3.933 1.00 0.00 O ATOM 1159 CB VAL A 76 11.455 -0.741 -6.913 1.00 0.00 C ATOM 1160 CG1 VAL A 76 12.678 -0.542 -7.806 1.00 0.00 C ATOM 1161 CG2 VAL A 76 10.962 -2.173 -7.140 1.00 0.00 C ATOM 0 H VAL A 76 13.441 -1.049 -4.955 1.00 0.00 H new ATOM 0 HA VAL A 76 11.452 0.963 -5.760 1.00 0.00 H new ATOM 0 HB VAL A 76 10.551 -0.180 -7.153 1.00 0.00 H new ATOM 0 HG11 VAL A 76 12.503 -1.014 -8.773 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.854 0.524 -7.950 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.551 -0.994 -7.334 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.908 -2.374 -8.210 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.654 -2.874 -6.673 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.973 -2.291 -6.698 1.00 0.00 H new ATOM 1171 N PRO A 77 9.728 0.551 -4.002 1.00 0.00 N ATOM 1172 CA PRO A 77 8.834 0.338 -2.853 1.00 0.00 C ATOM 1173 C PRO A 77 7.579 -0.497 -3.181 1.00 0.00 C ATOM 1174 O PRO A 77 6.775 -0.220 -4.077 1.00 0.00 O ATOM 1175 CB PRO A 77 8.511 1.780 -2.434 1.00 0.00 C ATOM 1176 CG PRO A 77 8.542 2.574 -3.742 1.00 0.00 C ATOM 1177 CD PRO A 77 9.648 1.908 -4.561 1.00 0.00 C ATOM 0 HA PRO A 77 9.291 -0.257 -2.062 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.535 1.845 -1.953 1.00 0.00 H new ATOM 0 HB3 PRO A 77 9.243 2.160 -1.721 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.583 2.529 -4.258 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.758 3.627 -3.563 1.00 0.00 H new ATOM 0 HD2 PRO A 77 9.404 1.890 -5.623 1.00 0.00 H new ATOM 0 HD3 PRO A 77 10.595 2.439 -4.461 1.00 0.00 H new ATOM 1185 N ALA A 78 7.493 -1.533 -2.362 1.00 0.00 N ATOM 1186 CA ALA A 78 6.455 -2.564 -2.406 1.00 0.00 C ATOM 1187 C ALA A 78 5.571 -2.475 -1.132 1.00 0.00 C ATOM 1188 O ALA A 78 5.838 -1.725 -0.191 1.00 0.00 O ATOM 1189 CB ALA A 78 7.280 -3.858 -2.531 1.00 0.00 C ATOM 0 H ALA A 78 8.170 -1.690 -1.616 1.00 0.00 H new ATOM 0 HA ALA A 78 5.738 -2.480 -3.222 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.608 -4.715 -2.574 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.879 -3.821 -3.441 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.937 -3.955 -1.667 1.00 0.00 H new ATOM 1195 N PHE A 79 4.484 -3.244 -1.141 1.00 0.00 N ATOM 1196 CA PHE A 79 3.470 -3.278 -0.049 1.00 0.00 C ATOM 1197 C PHE A 79 2.926 -4.738 -0.076 1.00 0.00 C ATOM 1198 O PHE A 79 2.376 -5.238 -1.064 1.00 0.00 O ATOM 1199 CB PHE A 79 2.390 -2.192 -0.264 1.00 0.00 C ATOM 1200 CG PHE A 79 1.004 -2.415 0.382 1.00 0.00 C ATOM 1201 CD1 PHE A 79 0.747 -2.015 1.694 1.00 0.00 C ATOM 1202 CD2 PHE A 79 0.013 -3.110 -0.330 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -0.470 -2.326 2.293 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -1.193 -3.441 0.280 1.00 0.00 C ATOM 1205 CZ PHE A 79 -1.427 -3.062 1.596 1.00 0.00 C ATOM 0 H PHE A 79 4.265 -3.876 -1.911 1.00 0.00 H new ATOM 0 HA PHE A 79 3.876 -3.043 0.935 1.00 0.00 H new ATOM 0 HB2 PHE A 79 2.786 -1.248 0.110 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.244 -2.073 -1.338 1.00 0.00 H new ATOM 0 HD1 PHE A 79 1.494 -1.463 2.245 1.00 0.00 H new ATOM 0 HD2 PHE A 79 0.188 -3.390 -1.358 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.674 -1.996 3.301 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.944 -3.991 -0.268 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.352 -3.338 2.080 1.00 0.00 H new ATOM 1215 N LYS A 80 3.064 -5.356 1.084 1.00 0.00 N ATOM 1216 CA LYS A 80 2.441 -6.677 1.404 1.00 0.00 C ATOM 1217 C LYS A 80 1.044 -6.408 2.016 1.00 0.00 C ATOM 1218 O LYS A 80 0.944 -5.505 2.850 1.00 0.00 O ATOM 1219 CB LYS A 80 3.271 -7.510 2.412 1.00 0.00 C ATOM 1220 CG LYS A 80 4.598 -8.101 1.877 1.00 0.00 C ATOM 1221 CD LYS A 80 4.481 -9.202 0.794 1.00 0.00 C ATOM 1222 CE LYS A 80 3.726 -10.493 1.182 1.00 0.00 C ATOM 1223 NZ LYS A 80 4.404 -11.275 2.234 1.00 0.00 N ATOM 0 H LYS A 80 3.612 -4.971 1.853 1.00 0.00 H new ATOM 0 HA LYS A 80 2.385 -7.253 0.481 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.498 -6.881 3.272 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.650 -8.331 2.772 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.195 -7.285 1.470 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.153 -8.511 2.721 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.987 -8.770 -0.076 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.488 -9.479 0.483 1.00 0.00 H new ATOM 0 HE2 LYS A 80 2.725 -10.231 1.523 1.00 0.00 H new ATOM 0 HE3 LYS A 80 3.608 -11.116 0.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.847 -12.127 2.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 5.350 -11.554 1.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 4.494 -10.696 3.093 1.00 0.00 H new ATOM 1236 N PRO A 81 -0.050 -7.157 1.701 1.00 0.00 N ATOM 1237 CA PRO A 81 -1.349 -6.981 2.407 1.00 0.00 C ATOM 1238 C PRO A 81 -1.382 -7.624 3.840 1.00 0.00 C ATOM 1239 O PRO A 81 -2.407 -8.166 4.251 1.00 0.00 O ATOM 1240 CB PRO A 81 -2.284 -7.642 1.376 1.00 0.00 C ATOM 1241 CG PRO A 81 -1.479 -8.767 0.731 1.00 0.00 C ATOM 1242 CD PRO A 81 -0.075 -8.183 0.637 1.00 0.00 C ATOM 0 HA PRO A 81 -1.612 -5.953 2.655 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -3.181 -8.032 1.857 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.612 -6.920 0.628 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.498 -9.673 1.336 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -1.872 -9.031 -0.251 1.00 0.00 H new ATOM 0 HD2 PRO A 81 0.687 -8.945 0.798 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.112 -7.747 -0.344 1.00 0.00 H new ATOM 1250 N GLY A 82 -0.265 -7.574 4.604 1.00 0.00 N ATOM 1251 CA GLY A 82 -0.084 -8.296 5.889 1.00 0.00 C ATOM 1252 C GLY A 82 -0.566 -9.770 5.994 1.00 0.00 C ATOM 1253 O GLY A 82 -0.742 -10.229 7.125 1.00 0.00 O ATOM 0 H GLY A 82 0.551 -7.021 4.341 1.00 0.00 H new ATOM 0 HA2 GLY A 82 0.979 -8.278 6.131 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -0.597 -7.725 6.663 1.00 0.00 H new ATOM 1257 N LYS A 83 -0.784 -10.469 4.842 1.00 0.00 N ATOM 1258 CA LYS A 83 -1.478 -11.803 4.754 1.00 0.00 C ATOM 1259 C LYS A 83 -3.024 -11.768 5.003 1.00 0.00 C ATOM 1260 O LYS A 83 -3.841 -12.302 4.252 1.00 0.00 O ATOM 1261 CB LYS A 83 -0.810 -12.926 5.601 1.00 0.00 C ATOM 1262 CG LYS A 83 0.115 -13.851 4.784 1.00 0.00 C ATOM 1263 CD LYS A 83 0.788 -14.941 5.638 1.00 0.00 C ATOM 1264 CE LYS A 83 1.711 -15.851 4.807 1.00 0.00 C ATOM 1265 NZ LYS A 83 2.343 -16.887 5.642 1.00 0.00 N ATOM 0 H LYS A 83 -0.481 -10.122 3.932 1.00 0.00 H new ATOM 0 HA LYS A 83 -1.344 -12.061 3.703 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -0.234 -12.468 6.405 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -1.589 -13.528 6.070 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.464 -14.325 3.991 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.885 -13.250 4.301 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.366 -14.470 6.433 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.021 -15.548 6.118 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.136 -16.325 4.011 1.00 0.00 H new ATOM 0 HE3 LYS A 83 2.482 -15.248 4.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.958 -17.482 5.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.911 -16.434 6.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.607 -17.477 6.079 1.00 0.00 H new ATOM 1278 N ALA A 84 -3.350 -11.170 6.139 1.00 0.00 N ATOM 1279 CA ALA A 84 -4.690 -10.886 6.672 1.00 0.00 C ATOM 1280 C ALA A 84 -5.622 -10.052 5.770 1.00 0.00 C ATOM 1281 O ALA A 84 -6.779 -10.453 5.611 1.00 0.00 O ATOM 1282 CB ALA A 84 -4.333 -10.092 7.920 1.00 0.00 C ATOM 0 H ALA A 84 -2.624 -10.838 6.774 1.00 0.00 H new ATOM 0 HA ALA A 84 -5.262 -11.804 6.807 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -5.246 -9.801 8.439 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.721 -10.707 8.580 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.776 -9.199 7.636 1.00 0.00 H new ATOM 1288 N LEU A 85 -5.157 -8.912 5.187 1.00 0.00 N ATOM 1289 CA LEU A 85 -5.923 -8.216 4.135 1.00 0.00 C ATOM 1290 C LEU A 85 -6.160 -9.157 2.904 1.00 0.00 C ATOM 1291 O LEU A 85 -7.268 -9.133 2.373 1.00 0.00 O ATOM 1292 CB LEU A 85 -5.251 -6.863 3.778 1.00 0.00 C ATOM 1293 CG LEU A 85 -5.989 -6.096 2.673 1.00 0.00 C ATOM 1294 CD1 LEU A 85 -7.292 -5.445 3.145 1.00 0.00 C ATOM 1295 CD2 LEU A 85 -5.071 -5.092 1.956 1.00 0.00 C ATOM 0 H LEU A 85 -4.271 -8.468 5.428 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.916 -7.968 4.510 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -5.202 -6.242 4.672 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.225 -7.047 3.461 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.284 -6.848 1.941 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.759 -4.920 2.312 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.970 -6.214 3.516 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -7.076 -4.736 3.944 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.635 -4.572 1.182 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -4.691 -4.368 2.677 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.236 -5.624 1.501 1.00 0.00 H new ATOM 1307 N LYS A 86 -5.172 -9.969 2.470 1.00 0.00 N ATOM 1308 CA LYS A 86 -5.380 -11.006 1.412 1.00 0.00 C ATOM 1309 C LYS A 86 -6.588 -11.978 1.664 1.00 0.00 C ATOM 1310 O LYS A 86 -7.199 -12.438 0.699 1.00 0.00 O ATOM 1311 CB LYS A 86 -4.062 -11.767 1.107 1.00 0.00 C ATOM 1312 CG LYS A 86 -3.935 -12.267 -0.349 1.00 0.00 C ATOM 1313 CD LYS A 86 -2.690 -13.136 -0.629 1.00 0.00 C ATOM 1314 CE LYS A 86 -1.346 -12.385 -0.547 1.00 0.00 C ATOM 1315 NZ LYS A 86 -0.213 -13.263 -0.888 1.00 0.00 N ATOM 0 H LYS A 86 -4.219 -9.934 2.831 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.672 -10.453 0.519 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.219 -11.112 1.328 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.986 -12.622 1.779 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.826 -12.842 -0.600 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.915 -11.404 -1.014 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -2.673 -13.962 0.083 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.786 -13.574 -1.623 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.363 -11.532 -1.225 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.210 -11.989 0.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 0.675 -12.725 -0.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -0.183 -14.064 -0.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -0.330 -13.621 -1.858 1.00 0.00 H new ATOM 1328 N ASP A 87 -6.950 -12.246 2.935 1.00 0.00 N ATOM 1329 CA ASP A 87 -8.183 -12.971 3.315 1.00 0.00 C ATOM 1330 C ASP A 87 -9.474 -12.091 3.234 1.00 0.00 C ATOM 1331 O ASP A 87 -10.480 -12.573 2.707 1.00 0.00 O ATOM 1332 CB ASP A 87 -7.919 -13.530 4.738 1.00 0.00 C ATOM 1333 CG ASP A 87 -8.231 -15.023 4.872 1.00 0.00 C ATOM 1334 OD1 ASP A 87 -7.391 -15.908 4.718 1.00 0.00 O ATOM 1335 OD2 ASP A 87 -9.549 -15.249 5.176 1.00 0.00 O ATOM 0 H ASP A 87 -6.388 -11.962 3.738 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.390 -13.775 2.608 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.875 -13.360 4.999 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -8.522 -12.974 5.456 1.00 0.00 H new ATOM 1341 N ALA A 88 -9.453 -10.830 3.742 1.00 0.00 N ATOM 1342 CA ALA A 88 -10.563 -9.841 3.564 1.00 0.00 C ATOM 1343 C ALA A 88 -11.069 -9.634 2.105 1.00 0.00 C ATOM 1344 O ALA A 88 -12.269 -9.537 1.844 1.00 0.00 O ATOM 1345 CB ALA A 88 -10.069 -8.427 3.994 1.00 0.00 C ATOM 0 H ALA A 88 -8.671 -10.466 4.286 1.00 0.00 H new ATOM 0 HA ALA A 88 -11.373 -10.260 4.162 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -10.875 -7.705 3.865 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -9.766 -8.450 5.041 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -9.219 -8.135 3.377 1.00 0.00 H new ATOM 1351 N VAL A 89 -10.097 -9.558 1.189 1.00 0.00 N ATOM 1352 CA VAL A 89 -10.255 -9.151 -0.207 1.00 0.00 C ATOM 1353 C VAL A 89 -10.488 -10.300 -1.250 1.00 0.00 C ATOM 1354 O VAL A 89 -10.879 -10.012 -2.383 1.00 0.00 O ATOM 1355 CB VAL A 89 -8.917 -8.331 -0.300 1.00 0.00 C ATOM 1356 CG1 VAL A 89 -7.700 -9.185 -0.660 1.00 0.00 C ATOM 1357 CG2 VAL A 89 -9.029 -7.168 -1.240 1.00 0.00 C ATOM 0 H VAL A 89 -9.130 -9.791 1.416 1.00 0.00 H new ATOM 0 HA VAL A 89 -11.162 -8.604 -0.465 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.754 -7.949 0.708 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.813 -8.553 -0.706 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.558 -9.954 0.099 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.861 -9.657 -1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -8.080 -6.632 -1.271 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -9.274 -7.530 -2.239 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -9.814 -6.496 -0.895 1.00 0.00 H new ATOM 1367 N LYS A 90 -10.250 -11.573 -0.862 1.00 0.00 N ATOM 1368 CA LYS A 90 -10.385 -12.769 -1.721 1.00 0.00 C ATOM 1369 C LYS A 90 -11.846 -13.025 -2.134 1.00 0.00 C ATOM 1370 O LYS A 90 -12.228 -12.773 -3.277 1.00 0.00 O ATOM 1371 CB LYS A 90 -9.798 -13.975 -0.927 1.00 0.00 C ATOM 1372 CG LYS A 90 -8.420 -14.451 -1.434 1.00 0.00 C ATOM 1373 CD LYS A 90 -7.790 -15.520 -0.518 1.00 0.00 C ATOM 1374 CE LYS A 90 -6.369 -15.914 -0.955 1.00 0.00 C ATOM 1375 NZ LYS A 90 -5.788 -16.924 -0.053 1.00 0.00 N ATOM 0 H LYS A 90 -9.950 -11.802 0.086 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.840 -12.620 -2.653 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.711 -13.697 0.123 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.500 -14.807 -0.979 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.527 -14.857 -2.440 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.748 -13.596 -1.505 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.760 -15.144 0.505 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -8.423 -16.407 -0.513 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -6.395 -16.305 -1.972 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.733 -15.029 -0.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -4.830 -17.168 -0.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.741 -16.541 0.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.382 -17.777 -0.058 1.00 0.00 H new ATOM 1389 N MET B 1 7.797 -0.755 12.715 1.00 0.00 N ATOM 1390 CA MET B 1 6.537 -0.311 12.075 1.00 0.00 C ATOM 1391 C MET B 1 5.344 -1.352 12.094 1.00 0.00 C ATOM 1392 O MET B 1 4.385 -1.162 11.349 1.00 0.00 O ATOM 1393 CB MET B 1 6.921 0.155 10.642 1.00 0.00 C ATOM 1394 CG MET B 1 7.825 1.400 10.498 1.00 0.00 C ATOM 1395 SD MET B 1 6.903 2.927 10.764 1.00 0.00 S ATOM 1396 CE MET B 1 6.138 3.138 9.142 1.00 0.00 C ATOM 0 H1 MET B 1 8.026 -0.122 13.507 1.00 0.00 H new ATOM 0 H2 MET B 1 7.683 -1.726 13.070 1.00 0.00 H new ATOM 0 H3 MET B 1 8.568 -0.730 12.018 1.00 0.00 H new ATOM 0 HA MET B 1 6.112 0.501 12.665 1.00 0.00 H new ATOM 0 HB2 MET B 1 7.418 -0.677 10.143 1.00 0.00 H new ATOM 0 HB3 MET B 1 5.998 0.349 10.096 1.00 0.00 H new ATOM 0 HG2 MET B 1 8.644 1.340 11.214 1.00 0.00 H new ATOM 0 HG3 MET B 1 8.271 1.413 9.504 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.633 4.103 9.101 1.00 0.00 H new ATOM 0 HE2 MET B 1 6.906 3.097 8.369 1.00 0.00 H new ATOM 0 HE3 MET B 1 5.413 2.342 8.975 1.00 0.00 H new ATOM 1407 N ASN B 2 5.419 -2.428 12.917 1.00 0.00 N ATOM 1408 CA ASN B 2 4.434 -3.554 13.089 1.00 0.00 C ATOM 1409 C ASN B 2 3.002 -3.361 13.614 1.00 0.00 C ATOM 1410 O ASN B 2 2.390 -4.182 14.306 1.00 0.00 O ATOM 1411 CB ASN B 2 5.147 -4.702 13.837 1.00 0.00 C ATOM 1412 CG ASN B 2 5.744 -4.391 15.230 1.00 0.00 C ATOM 1413 OD1 ASN B 2 6.939 -4.133 15.369 1.00 0.00 O ATOM 1414 ND2 ASN B 2 4.924 -4.372 16.266 1.00 0.00 N ATOM 0 H ASN B 2 6.226 -2.552 13.529 1.00 0.00 H new ATOM 0 HA ASN B 2 4.165 -3.744 12.050 1.00 0.00 H new ATOM 0 HB2 ASN B 2 4.436 -5.520 13.952 1.00 0.00 H new ATOM 0 HB3 ASN B 2 5.953 -5.067 13.201 1.00 0.00 H new ATOM 0 HD21 ASN B 2 5.280 -4.142 17.194 1.00 0.00 H new ATOM 0 HD22 ASN B 2 3.935 -4.588 16.138 1.00 0.00 H new ATOM 1421 N LYS B 3 2.513 -2.233 13.161 1.00 0.00 N ATOM 1422 CA LYS B 3 1.180 -1.665 13.523 1.00 0.00 C ATOM 1423 C LYS B 3 1.146 -0.991 14.935 1.00 0.00 C ATOM 1424 O LYS B 3 0.345 -0.081 15.153 1.00 0.00 O ATOM 1425 CB LYS B 3 0.009 -2.646 13.207 1.00 0.00 C ATOM 1426 CG LYS B 3 -1.402 -2.016 13.191 1.00 0.00 C ATOM 1427 CD LYS B 3 -2.536 -2.944 12.700 1.00 0.00 C ATOM 1428 CE LYS B 3 -2.667 -3.109 11.170 1.00 0.00 C ATOM 1429 NZ LYS B 3 -3.194 -1.904 10.499 1.00 0.00 N ATOM 0 H LYS B 3 3.027 -1.644 12.506 1.00 0.00 H new ATOM 0 HA LYS B 3 1.005 -0.821 12.856 1.00 0.00 H new ATOM 0 HB2 LYS B 3 0.194 -3.104 12.235 1.00 0.00 H new ATOM 0 HB3 LYS B 3 0.021 -3.448 13.945 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -1.642 -1.679 14.199 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -1.379 -1.131 12.556 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -2.386 -3.930 13.139 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -3.482 -2.563 13.086 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -1.690 -3.352 10.752 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -3.324 -3.952 10.957 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -3.259 -2.077 9.476 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -4.139 -1.683 10.873 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -2.556 -1.102 10.675 1.00 0.00 H new ATOM 1442 N THR B 4 2.023 -1.428 15.857 1.00 0.00 N ATOM 1443 CA THR B 4 2.213 -0.926 17.205 1.00 0.00 C ATOM 1444 C THR B 4 3.483 -0.027 17.307 1.00 0.00 C ATOM 1445 O THR B 4 3.425 1.030 17.954 1.00 0.00 O ATOM 1446 CB THR B 4 2.224 -2.223 18.038 1.00 0.00 C ATOM 1447 OG1 THR B 4 0.923 -2.809 18.099 1.00 0.00 O ATOM 1448 CG2 THR B 4 2.672 -1.922 19.437 1.00 0.00 C ATOM 0 H THR B 4 2.658 -2.199 15.651 1.00 0.00 H new ATOM 0 HA THR B 4 1.443 -0.245 17.566 1.00 0.00 H new ATOM 0 HB THR B 4 2.909 -2.921 17.557 1.00 0.00 H new ATOM 0 HG1 THR B 4 0.959 -3.631 18.632 1.00 0.00 H new ATOM 0 HG21 THR B 4 2.678 -2.841 20.023 1.00 0.00 H new ATOM 0 HG22 THR B 4 3.676 -1.499 19.414 1.00 0.00 H new ATOM 0 HG23 THR B 4 1.987 -1.207 19.892 1.00 0.00 H new ATOM 1456 N GLU B 5 4.629 -0.437 16.704 1.00 0.00 N ATOM 1457 CA GLU B 5 5.746 0.520 16.469 1.00 0.00 C ATOM 1458 C GLU B 5 5.279 1.717 15.552 1.00 0.00 C ATOM 1459 O GLU B 5 5.909 2.778 15.583 1.00 0.00 O ATOM 1460 CB GLU B 5 6.987 -0.229 15.930 1.00 0.00 C ATOM 1461 CG GLU B 5 7.699 -1.198 16.901 1.00 0.00 C ATOM 1462 CD GLU B 5 8.360 -0.521 18.108 1.00 0.00 C ATOM 1463 OE1 GLU B 5 9.489 -0.034 18.077 1.00 0.00 O ATOM 1464 OE2 GLU B 5 7.546 -0.520 19.213 1.00 0.00 O ATOM 0 H GLU B 5 4.803 -1.389 16.381 1.00 0.00 H new ATOM 0 HA GLU B 5 6.044 0.972 17.415 1.00 0.00 H new ATOM 0 HB2 GLU B 5 6.685 -0.794 15.048 1.00 0.00 H new ATOM 0 HB3 GLU B 5 7.713 0.513 15.599 1.00 0.00 H new ATOM 0 HG2 GLU B 5 6.974 -1.927 17.262 1.00 0.00 H new ATOM 0 HG3 GLU B 5 8.460 -1.751 16.349 1.00 0.00 H new ATOM 1472 N LEU B 6 4.155 1.559 14.793 1.00 0.00 N ATOM 1473 CA LEU B 6 3.413 2.659 14.200 1.00 0.00 C ATOM 1474 C LEU B 6 2.732 3.605 15.204 1.00 0.00 C ATOM 1475 O LEU B 6 2.775 4.802 14.980 1.00 0.00 O ATOM 1476 CB LEU B 6 2.299 2.040 13.320 1.00 0.00 C ATOM 1477 CG LEU B 6 2.302 2.679 11.921 1.00 0.00 C ATOM 1478 CD1 LEU B 6 2.077 4.195 11.928 1.00 0.00 C ATOM 1479 CD2 LEU B 6 3.487 2.288 11.031 1.00 0.00 C ATOM 0 H LEU B 6 3.753 0.644 14.587 1.00 0.00 H new ATOM 0 HA LEU B 6 4.138 3.261 13.652 1.00 0.00 H new ATOM 0 HB2 LEU B 6 2.450 0.964 13.235 1.00 0.00 H new ATOM 0 HB3 LEU B 6 1.328 2.190 13.793 1.00 0.00 H new ATOM 0 HG LEU B 6 1.425 2.232 11.453 1.00 0.00 H new ATOM 0 HD11 LEU B 6 2.093 4.570 10.905 1.00 0.00 H new ATOM 0 HD12 LEU B 6 1.111 4.417 12.381 1.00 0.00 H new ATOM 0 HD13 LEU B 6 2.867 4.677 12.503 1.00 0.00 H new ATOM 0 HD21 LEU B 6 3.399 2.789 10.067 1.00 0.00 H new ATOM 0 HD22 LEU B 6 4.418 2.588 11.512 1.00 0.00 H new ATOM 0 HD23 LEU B 6 3.488 1.209 10.880 1.00 0.00 H new ATOM 1491 N ILE B 7 2.086 3.106 16.270 1.00 0.00 N ATOM 1492 CA ILE B 7 1.457 3.944 17.339 1.00 0.00 C ATOM 1493 C ILE B 7 2.485 4.946 17.938 1.00 0.00 C ATOM 1494 O ILE B 7 2.175 6.135 18.058 1.00 0.00 O ATOM 1495 CB ILE B 7 0.767 3.059 18.429 1.00 0.00 C ATOM 1496 CG1 ILE B 7 -0.224 2.054 17.784 1.00 0.00 C ATOM 1497 CG2 ILE B 7 0.028 3.909 19.489 1.00 0.00 C ATOM 1498 CD1 ILE B 7 -0.577 0.822 18.599 1.00 0.00 C ATOM 0 H ILE B 7 1.977 2.104 16.428 1.00 0.00 H new ATOM 0 HA ILE B 7 0.665 4.539 16.884 1.00 0.00 H new ATOM 0 HB ILE B 7 1.562 2.508 18.932 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -1.147 2.586 17.556 1.00 0.00 H new ATOM 0 HG13 ILE B 7 0.197 1.724 16.834 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -0.435 3.251 20.224 1.00 0.00 H new ATOM 0 HG22 ILE B 7 0.739 4.567 19.988 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -0.742 4.508 19.003 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -1.276 0.202 18.037 1.00 0.00 H new ATOM 0 HD12 ILE B 7 0.328 0.251 18.806 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -1.037 1.127 19.539 1.00 0.00 H new ATOM 1510 N ASN B 8 3.702 4.455 18.251 1.00 0.00 N ATOM 1511 CA ASN B 8 4.828 5.363 18.618 1.00 0.00 C ATOM 1512 C ASN B 8 5.388 6.258 17.454 1.00 0.00 C ATOM 1513 O ASN B 8 6.084 7.228 17.754 1.00 0.00 O ATOM 1514 CB ASN B 8 5.983 4.565 19.291 1.00 0.00 C ATOM 1515 CG ASN B 8 5.650 3.822 20.602 1.00 0.00 C ATOM 1516 OD1 ASN B 8 5.683 4.396 21.690 1.00 0.00 O ATOM 1517 ND2 ASN B 8 5.342 2.535 20.530 1.00 0.00 N ATOM 0 H ASN B 8 3.935 3.462 18.260 1.00 0.00 H new ATOM 0 HA ASN B 8 4.389 6.067 19.325 1.00 0.00 H new ATOM 0 HB2 ASN B 8 6.354 3.834 18.572 1.00 0.00 H new ATOM 0 HB3 ASN B 8 6.801 5.257 19.492 1.00 0.00 H new ATOM 0 HD21 ASN B 8 5.130 2.013 21.380 1.00 0.00 H new ATOM 0 HD22 ASN B 8 5.317 2.067 19.624 1.00 0.00 H new ATOM 1524 N ALA B 9 5.101 5.970 16.163 1.00 0.00 N ATOM 1525 CA ALA B 9 5.413 6.879 15.023 1.00 0.00 C ATOM 1526 C ALA B 9 4.519 8.129 14.972 1.00 0.00 C ATOM 1527 O ALA B 9 5.016 9.240 14.807 1.00 0.00 O ATOM 1528 CB ALA B 9 5.149 6.181 13.655 1.00 0.00 C ATOM 0 H ALA B 9 4.647 5.103 15.877 1.00 0.00 H new ATOM 0 HA ALA B 9 6.458 7.145 15.182 1.00 0.00 H new ATOM 0 HB1 ALA B 9 5.386 6.869 12.844 1.00 0.00 H new ATOM 0 HB2 ALA B 9 5.776 5.293 13.572 1.00 0.00 H new ATOM 0 HB3 ALA B 9 4.100 5.891 13.591 1.00 0.00 H new ATOM 1534 N VAL B 10 3.200 7.908 15.073 1.00 0.00 N ATOM 1535 CA VAL B 10 2.143 8.917 14.947 1.00 0.00 C ATOM 1536 C VAL B 10 2.173 9.879 16.100 1.00 0.00 C ATOM 1537 O VAL B 10 2.254 11.090 15.906 1.00 0.00 O ATOM 1538 CB VAL B 10 0.717 8.309 14.766 1.00 0.00 C ATOM 1539 CG1 VAL B 10 -0.244 9.218 14.015 1.00 0.00 C ATOM 1540 CG2 VAL B 10 0.765 6.967 14.064 1.00 0.00 C ATOM 0 H VAL B 10 2.826 6.976 15.253 1.00 0.00 H new ATOM 0 HA VAL B 10 2.359 9.462 14.028 1.00 0.00 H new ATOM 0 HB VAL B 10 0.339 8.187 15.781 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -1.214 8.729 13.928 1.00 0.00 H new ATOM 0 HG12 VAL B 10 -0.358 10.156 14.559 1.00 0.00 H new ATOM 0 HG13 VAL B 10 0.151 9.422 13.019 1.00 0.00 H new ATOM 0 HG21 VAL B 10 -0.247 6.576 13.957 1.00 0.00 H new ATOM 0 HG22 VAL B 10 1.214 7.088 13.078 1.00 0.00 H new ATOM 0 HG23 VAL B 10 1.363 6.270 14.652 1.00 0.00 H new ATOM 1550 N ALA B 11 2.138 9.285 17.297 1.00 0.00 N ATOM 1551 CA ALA B 11 2.254 10.054 18.517 1.00 0.00 C ATOM 1552 C ALA B 11 3.612 10.772 18.738 1.00 0.00 C ATOM 1553 O ALA B 11 3.618 11.792 19.433 1.00 0.00 O ATOM 1554 CB ALA B 11 1.856 9.130 19.667 1.00 0.00 C ATOM 0 H ALA B 11 2.031 8.280 17.436 1.00 0.00 H new ATOM 0 HA ALA B 11 1.578 10.906 18.451 1.00 0.00 H new ATOM 0 HB1 ALA B 11 1.929 9.671 20.610 1.00 0.00 H new ATOM 0 HB2 ALA B 11 0.831 8.790 19.522 1.00 0.00 H new ATOM 0 HB3 ALA B 11 2.524 8.269 19.690 1.00 0.00 H new ATOM 1560 N GLU B 12 4.733 10.286 18.143 1.00 0.00 N ATOM 1561 CA GLU B 12 6.001 11.050 18.133 1.00 0.00 C ATOM 1562 C GLU B 12 5.955 12.199 17.088 1.00 0.00 C ATOM 1563 O GLU B 12 6.243 13.337 17.474 1.00 0.00 O ATOM 1564 CB GLU B 12 7.206 10.091 17.956 1.00 0.00 C ATOM 1565 CG GLU B 12 8.599 10.754 17.972 1.00 0.00 C ATOM 1566 CD GLU B 12 9.735 9.734 17.869 1.00 0.00 C ATOM 1567 OE1 GLU B 12 10.341 9.294 18.845 1.00 0.00 O ATOM 1568 OE2 GLU B 12 9.990 9.371 16.571 1.00 0.00 O ATOM 0 H GLU B 12 4.782 9.383 17.672 1.00 0.00 H new ATOM 0 HA GLU B 12 6.136 11.539 19.098 1.00 0.00 H new ATOM 0 HB2 GLU B 12 7.171 9.344 18.749 1.00 0.00 H new ATOM 0 HB3 GLU B 12 7.088 9.560 17.012 1.00 0.00 H new ATOM 0 HG2 GLU B 12 8.672 11.459 17.144 1.00 0.00 H new ATOM 0 HG3 GLU B 12 8.714 11.329 18.891 1.00 0.00 H new ATOM 1576 N THR B 13 5.594 11.936 15.809 1.00 0.00 N ATOM 1577 CA THR B 13 5.573 13.010 14.758 1.00 0.00 C ATOM 1578 C THR B 13 4.292 13.879 14.565 1.00 0.00 C ATOM 1579 O THR B 13 4.180 14.651 13.607 1.00 0.00 O ATOM 1580 CB THR B 13 6.203 12.422 13.476 1.00 0.00 C ATOM 1581 OG1 THR B 13 6.892 13.435 12.749 1.00 0.00 O ATOM 1582 CG2 THR B 13 5.268 11.693 12.520 1.00 0.00 C ATOM 0 H THR B 13 5.317 11.013 15.474 1.00 0.00 H new ATOM 0 HA THR B 13 6.180 13.828 15.145 1.00 0.00 H new ATOM 0 HB THR B 13 6.876 11.656 13.861 1.00 0.00 H new ATOM 0 HG1 THR B 13 6.338 14.242 12.707 1.00 0.00 H new ATOM 0 HG21 THR B 13 5.835 11.330 11.663 1.00 0.00 H new ATOM 0 HG22 THR B 13 4.807 10.849 13.034 1.00 0.00 H new ATOM 0 HG23 THR B 13 4.492 12.377 12.178 1.00 0.00 H new ATOM 1590 N SER B 14 3.378 13.765 15.524 1.00 0.00 N ATOM 1591 CA SER B 14 2.112 14.554 15.585 1.00 0.00 C ATOM 1592 C SER B 14 1.740 15.047 17.015 1.00 0.00 C ATOM 1593 O SER B 14 1.140 16.123 17.114 1.00 0.00 O ATOM 1594 CB SER B 14 0.902 13.817 14.959 1.00 0.00 C ATOM 1595 OG SER B 14 1.130 13.504 13.591 1.00 0.00 O ATOM 0 H SER B 14 3.481 13.115 16.303 1.00 0.00 H new ATOM 0 HA SER B 14 2.332 15.434 14.980 1.00 0.00 H new ATOM 0 HB2 SER B 14 0.707 12.900 15.515 1.00 0.00 H new ATOM 0 HB3 SER B 14 0.011 14.439 15.047 1.00 0.00 H new ATOM 0 HG SER B 14 0.348 13.038 13.227 1.00 0.00 H new ATOM 1601 N GLY B 15 2.035 14.299 18.105 1.00 0.00 N ATOM 1602 CA GLY B 15 1.633 14.698 19.480 1.00 0.00 C ATOM 1603 C GLY B 15 0.124 14.658 19.790 1.00 0.00 C ATOM 1604 O GLY B 15 -0.502 15.671 20.111 1.00 0.00 O ATOM 0 H GLY B 15 2.548 13.419 18.062 1.00 0.00 H new ATOM 0 HA2 GLY B 15 2.145 14.047 20.188 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.993 15.711 19.661 1.00 0.00 H new ATOM 1608 N LEU B 16 -0.403 13.439 19.711 1.00 0.00 N ATOM 1609 CA LEU B 16 -1.814 13.094 19.991 1.00 0.00 C ATOM 1610 C LEU B 16 -1.802 12.312 21.344 1.00 0.00 C ATOM 1611 O LEU B 16 -1.328 12.796 22.378 1.00 0.00 O ATOM 1612 CB LEU B 16 -2.557 12.668 18.670 1.00 0.00 C ATOM 1613 CG LEU B 16 -1.800 11.651 17.805 1.00 0.00 C ATOM 1614 CD1 LEU B 16 -1.154 10.504 18.501 1.00 0.00 C ATOM 1615 CD2 LEU B 16 -2.146 11.277 16.359 1.00 0.00 C ATOM 0 H LEU B 16 0.152 12.627 19.441 1.00 0.00 H new ATOM 0 HA LEU B 16 -2.530 13.881 20.229 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -3.527 12.248 18.935 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -2.748 13.560 18.074 1.00 0.00 H new ATOM 0 HG LEU B 16 -1.126 12.482 17.597 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -0.657 9.868 17.769 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -0.420 10.878 19.215 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -1.912 9.925 19.029 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -1.439 10.530 15.997 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -3.156 10.869 16.320 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -2.089 12.165 15.730 1.00 0.00 H new ATOM 1627 N SER B 17 -2.359 11.120 21.293 1.00 0.00 N ATOM 1628 CA SER B 17 -2.341 10.106 22.377 1.00 0.00 C ATOM 1629 C SER B 17 -1.906 8.732 21.800 1.00 0.00 C ATOM 1630 O SER B 17 -2.072 8.445 20.618 1.00 0.00 O ATOM 1631 CB SER B 17 -3.710 9.994 23.075 1.00 0.00 C ATOM 1632 OG SER B 17 -4.150 11.244 23.596 1.00 0.00 O ATOM 0 H SER B 17 -2.864 10.798 20.467 1.00 0.00 H new ATOM 0 HA SER B 17 -1.621 10.425 23.130 1.00 0.00 H new ATOM 0 HB2 SER B 17 -4.448 9.617 22.367 1.00 0.00 H new ATOM 0 HB3 SER B 17 -3.645 9.267 23.885 1.00 0.00 H new ATOM 0 HG SER B 17 -5.022 11.129 24.029 1.00 0.00 H new ATOM 1638 N LYS B 18 -1.375 7.832 22.641 1.00 0.00 N ATOM 1639 CA LYS B 18 -1.106 6.412 22.233 1.00 0.00 C ATOM 1640 C LYS B 18 -2.434 5.689 21.839 1.00 0.00 C ATOM 1641 O LYS B 18 -2.483 5.075 20.777 1.00 0.00 O ATOM 1642 CB LYS B 18 -0.259 5.634 23.274 1.00 0.00 C ATOM 1643 CG LYS B 18 1.161 6.185 23.557 1.00 0.00 C ATOM 1644 CD LYS B 18 2.131 6.172 22.350 1.00 0.00 C ATOM 1645 CE LYS B 18 3.532 6.750 22.630 1.00 0.00 C ATOM 1646 NZ LYS B 18 3.532 8.206 22.876 1.00 0.00 N ATOM 0 H LYS B 18 -1.119 8.043 23.605 1.00 0.00 H new ATOM 0 HA LYS B 18 -0.481 6.436 21.340 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -0.810 5.611 24.214 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -0.164 4.603 22.935 1.00 0.00 H new ATOM 0 HG2 LYS B 18 1.070 7.210 23.917 1.00 0.00 H new ATOM 0 HG3 LYS B 18 1.604 5.602 24.364 1.00 0.00 H new ATOM 0 HD2 LYS B 18 2.242 5.144 22.004 1.00 0.00 H new ATOM 0 HD3 LYS B 18 1.679 6.736 21.534 1.00 0.00 H new ATOM 0 HE2 LYS B 18 3.958 6.244 23.496 1.00 0.00 H new ATOM 0 HE3 LYS B 18 4.182 6.533 21.782 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 4.461 8.601 22.624 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 2.796 8.656 22.296 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 3.340 8.388 23.882 1.00 0.00 H new ATOM 1659 N LYS B 19 -3.521 5.845 22.622 1.00 0.00 N ATOM 1660 CA LYS B 19 -4.891 5.421 22.215 1.00 0.00 C ATOM 1661 C LYS B 19 -5.405 6.146 20.923 1.00 0.00 C ATOM 1662 O LYS B 19 -6.041 5.471 20.109 1.00 0.00 O ATOM 1663 CB LYS B 19 -5.912 5.599 23.375 1.00 0.00 C ATOM 1664 CG LYS B 19 -5.666 4.754 24.649 1.00 0.00 C ATOM 1665 CD LYS B 19 -5.849 3.233 24.463 1.00 0.00 C ATOM 1666 CE LYS B 19 -5.670 2.451 25.777 1.00 0.00 C ATOM 1667 NZ LYS B 19 -5.844 1.002 25.569 1.00 0.00 N ATOM 0 H LYS B 19 -3.482 6.265 23.551 1.00 0.00 H new ATOM 0 HA LYS B 19 -4.811 4.361 21.975 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -5.924 6.651 23.661 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -6.905 5.361 22.994 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -4.653 4.943 25.003 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -6.345 5.094 25.430 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -6.843 3.037 24.060 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -5.130 2.871 23.728 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -4.678 2.645 26.185 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -6.392 2.804 26.513 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -5.717 0.504 26.473 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -6.799 0.816 25.202 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -5.138 0.662 24.885 1.00 0.00 H new ATOM 1680 N ASP B 20 -5.135 7.464 20.703 1.00 0.00 N ATOM 1681 CA ASP B 20 -5.502 8.145 19.415 1.00 0.00 C ATOM 1682 C ASP B 20 -4.681 7.676 18.174 1.00 0.00 C ATOM 1683 O ASP B 20 -5.244 7.612 17.082 1.00 0.00 O ATOM 1684 CB ASP B 20 -5.427 9.693 19.552 1.00 0.00 C ATOM 1685 CG ASP B 20 -6.645 10.317 20.247 1.00 0.00 C ATOM 1686 OD1 ASP B 20 -6.651 10.661 21.428 1.00 0.00 O ATOM 1687 OD2 ASP B 20 -7.715 10.449 19.399 1.00 0.00 O ATOM 0 H ASP B 20 -4.674 8.070 21.382 1.00 0.00 H new ATOM 0 HA ASP B 20 -6.532 7.842 19.226 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -4.529 9.955 20.111 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -5.324 10.131 18.559 1.00 0.00 H new ATOM 1693 N ALA B 21 -3.385 7.359 18.334 1.00 0.00 N ATOM 1694 CA ALA B 21 -2.519 6.794 17.270 1.00 0.00 C ATOM 1695 C ALA B 21 -2.874 5.333 16.860 1.00 0.00 C ATOM 1696 O ALA B 21 -2.809 5.017 15.670 1.00 0.00 O ATOM 1697 CB ALA B 21 -1.069 6.955 17.752 1.00 0.00 C ATOM 0 H ALA B 21 -2.896 7.488 19.220 1.00 0.00 H new ATOM 0 HA ALA B 21 -2.679 7.341 16.341 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -0.389 6.553 17.001 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -0.853 8.012 17.908 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -0.935 6.415 18.689 1.00 0.00 H new ATOM 1703 N THR B 22 -3.276 4.465 17.816 1.00 0.00 N ATOM 1704 CA THR B 22 -3.806 3.097 17.558 1.00 0.00 C ATOM 1705 C THR B 22 -5.086 3.100 16.675 1.00 0.00 C ATOM 1706 O THR B 22 -5.168 2.376 15.679 1.00 0.00 O ATOM 1707 CB THR B 22 -4.051 2.391 18.930 1.00 0.00 C ATOM 1708 OG1 THR B 22 -3.007 2.610 19.869 1.00 0.00 O ATOM 1709 CG2 THR B 22 -4.160 0.881 18.766 1.00 0.00 C ATOM 0 H THR B 22 -3.242 4.696 18.809 1.00 0.00 H new ATOM 0 HA THR B 22 -3.065 2.541 16.984 1.00 0.00 H new ATOM 0 HB THR B 22 -4.979 2.828 19.298 1.00 0.00 H new ATOM 0 HG1 THR B 22 -3.133 3.481 20.301 1.00 0.00 H new ATOM 0 HG21 THR B 22 -4.330 0.421 19.739 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.993 0.646 18.103 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.235 0.494 18.338 1.00 0.00 H new ATOM 1717 N LYS B 23 -6.055 3.940 17.067 1.00 0.00 N ATOM 1718 CA LYS B 23 -7.285 4.212 16.293 1.00 0.00 C ATOM 1719 C LYS B 23 -7.040 4.774 14.878 1.00 0.00 C ATOM 1720 O LYS B 23 -7.578 4.234 13.922 1.00 0.00 O ATOM 1721 CB LYS B 23 -8.081 5.294 17.078 1.00 0.00 C ATOM 1722 CG LYS B 23 -8.786 4.783 18.356 1.00 0.00 C ATOM 1723 CD LYS B 23 -9.398 5.915 19.206 1.00 0.00 C ATOM 1724 CE LYS B 23 -10.034 5.463 20.534 1.00 0.00 C ATOM 1725 NZ LYS B 23 -11.284 4.699 20.350 1.00 0.00 N ATOM 0 H LYS B 23 -6.010 4.460 17.943 1.00 0.00 H new ATOM 0 HA LYS B 23 -7.805 3.262 16.173 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -7.399 6.098 17.354 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -8.831 5.726 16.415 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -9.573 4.083 18.074 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -8.069 4.229 18.962 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -8.620 6.646 19.424 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -10.157 6.425 18.612 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -9.318 4.850 21.082 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -10.239 6.340 21.148 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -11.663 4.424 21.279 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -11.981 5.289 19.853 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -11.090 3.845 19.789 1.00 0.00 H new ATOM 1738 N ALA B 24 -6.253 5.848 14.789 1.00 0.00 N ATOM 1739 CA ALA B 24 -5.904 6.555 13.543 1.00 0.00 C ATOM 1740 C ALA B 24 -5.158 5.764 12.435 1.00 0.00 C ATOM 1741 O ALA B 24 -5.309 6.048 11.248 1.00 0.00 O ATOM 1742 CB ALA B 24 -5.163 7.798 13.991 1.00 0.00 C ATOM 0 H ALA B 24 -5.822 6.270 15.611 1.00 0.00 H new ATOM 0 HA ALA B 24 -6.828 6.767 13.005 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -4.868 8.380 13.118 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -5.813 8.400 14.626 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -4.274 7.509 14.552 1.00 0.00 H new ATOM 1748 N VAL B 25 -4.366 4.771 12.840 1.00 0.00 N ATOM 1749 CA VAL B 25 -3.815 3.711 11.956 1.00 0.00 C ATOM 1750 C VAL B 25 -4.988 2.772 11.505 1.00 0.00 C ATOM 1751 O VAL B 25 -5.175 2.572 10.306 1.00 0.00 O ATOM 1752 CB VAL B 25 -2.772 2.998 12.898 1.00 0.00 C ATOM 1753 CG1 VAL B 25 -2.533 1.508 12.571 1.00 0.00 C ATOM 1754 CG2 VAL B 25 -1.436 3.749 12.933 1.00 0.00 C ATOM 0 H VAL B 25 -4.075 4.667 13.812 1.00 0.00 H new ATOM 0 HA VAL B 25 -3.349 4.056 11.033 1.00 0.00 H new ATOM 0 HB VAL B 25 -3.230 3.026 13.887 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -1.802 1.096 13.267 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -3.471 0.960 12.663 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -2.157 1.415 11.552 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -0.743 3.227 13.593 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -1.017 3.793 11.928 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -1.597 4.761 13.303 1.00 0.00 H new ATOM 1764 N ASP B 26 -5.769 2.183 12.439 1.00 0.00 N ATOM 1765 CA ASP B 26 -7.011 1.418 12.065 1.00 0.00 C ATOM 1766 C ASP B 26 -8.280 2.309 11.742 1.00 0.00 C ATOM 1767 O ASP B 26 -9.443 1.970 11.975 1.00 0.00 O ATOM 1768 CB ASP B 26 -7.309 0.408 13.193 1.00 0.00 C ATOM 1769 CG ASP B 26 -6.288 -0.733 13.354 1.00 0.00 C ATOM 1770 OD1 ASP B 26 -6.272 -1.733 12.638 1.00 0.00 O ATOM 1771 OD2 ASP B 26 -5.401 -0.496 14.373 1.00 0.00 O ATOM 0 H ASP B 26 -5.579 2.213 13.441 1.00 0.00 H new ATOM 0 HA ASP B 26 -6.805 0.912 11.122 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -7.370 0.952 14.136 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -8.291 -0.030 13.013 1.00 0.00 H new ATOM 1777 N ALA B 27 -7.962 3.472 11.190 1.00 0.00 N ATOM 1778 CA ALA B 27 -8.849 4.518 10.659 1.00 0.00 C ATOM 1779 C ALA B 27 -8.547 4.720 9.158 1.00 0.00 C ATOM 1780 O ALA B 27 -9.478 4.721 8.347 1.00 0.00 O ATOM 1781 CB ALA B 27 -8.663 5.798 11.441 1.00 0.00 C ATOM 0 H ALA B 27 -6.983 3.740 11.089 1.00 0.00 H new ATOM 0 HA ALA B 27 -9.891 4.217 10.765 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -9.323 6.568 11.042 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -8.903 5.622 12.489 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -7.628 6.129 11.357 1.00 0.00 H new ATOM 1787 N VAL B 28 -7.244 4.868 8.797 1.00 0.00 N ATOM 1788 CA VAL B 28 -6.763 4.747 7.395 1.00 0.00 C ATOM 1789 C VAL B 28 -7.170 3.336 6.885 1.00 0.00 C ATOM 1790 O VAL B 28 -8.141 3.191 6.148 1.00 0.00 O ATOM 1791 CB VAL B 28 -5.194 4.897 7.161 1.00 0.00 C ATOM 1792 CG1 VAL B 28 -4.947 6.034 6.242 1.00 0.00 C ATOM 1793 CG2 VAL B 28 -4.240 5.080 8.344 1.00 0.00 C ATOM 0 H VAL B 28 -6.502 5.073 9.466 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.218 5.582 6.862 1.00 0.00 H new ATOM 0 HB VAL B 28 -4.950 3.904 6.785 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.875 6.143 6.077 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -5.443 5.847 5.290 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.341 6.950 6.682 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -3.217 5.163 7.977 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -4.505 5.987 8.888 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -4.318 4.221 9.010 1.00 0.00 H new ATOM 1803 N PHE B 29 -6.443 2.360 7.445 1.00 0.00 N ATOM 1804 CA PHE B 29 -6.443 0.914 7.132 1.00 0.00 C ATOM 1805 C PHE B 29 -7.770 0.155 7.355 1.00 0.00 C ATOM 1806 O PHE B 29 -7.856 -0.997 6.926 1.00 0.00 O ATOM 1807 CB PHE B 29 -5.171 0.289 7.792 1.00 0.00 C ATOM 1808 CG PHE B 29 -3.819 0.939 7.396 1.00 0.00 C ATOM 1809 CD1 PHE B 29 -3.530 1.211 6.052 1.00 0.00 C ATOM 1810 CD2 PHE B 29 -2.931 1.374 8.381 1.00 0.00 C ATOM 1811 CE1 PHE B 29 -2.402 1.939 5.701 1.00 0.00 C ATOM 1812 CE2 PHE B 29 -1.802 2.108 8.032 1.00 0.00 C ATOM 1813 CZ PHE B 29 -1.544 2.390 6.692 1.00 0.00 C ATOM 0 H PHE B 29 -5.782 2.574 8.192 1.00 0.00 H new ATOM 0 HA PHE B 29 -6.380 0.794 6.050 1.00 0.00 H new ATOM 0 HB2 PHE B 29 -5.279 0.350 8.875 1.00 0.00 H new ATOM 0 HB3 PHE B 29 -5.133 -0.769 7.534 1.00 0.00 H new ATOM 0 HD1 PHE B 29 -4.193 0.850 5.280 1.00 0.00 H new ATOM 0 HD2 PHE B 29 -3.121 1.140 9.418 1.00 0.00 H new ATOM 0 HE1 PHE B 29 -2.194 2.153 4.663 1.00 0.00 H new ATOM 0 HE2 PHE B 29 -1.127 2.459 8.798 1.00 0.00 H new ATOM 0 HZ PHE B 29 -0.669 2.964 6.424 1.00 0.00 H new ATOM 1823 N ASP B 30 -8.786 0.793 7.978 1.00 0.00 N ATOM 1824 CA ASP B 30 -10.180 0.273 7.994 1.00 0.00 C ATOM 1825 C ASP B 30 -11.028 0.768 6.782 1.00 0.00 C ATOM 1826 O ASP B 30 -11.801 0.002 6.201 1.00 0.00 O ATOM 1827 CB ASP B 30 -10.852 0.657 9.330 1.00 0.00 C ATOM 1828 CG ASP B 30 -12.049 -0.225 9.708 1.00 0.00 C ATOM 1829 OD1 ASP B 30 -11.941 -1.277 10.337 1.00 0.00 O ATOM 1830 OD2 ASP B 30 -13.238 0.294 9.263 1.00 0.00 O ATOM 0 H ASP B 30 -8.670 1.673 8.480 1.00 0.00 H new ATOM 0 HA ASP B 30 -10.130 -0.812 7.902 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -10.109 0.603 10.126 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -11.183 1.694 9.273 1.00 0.00 H new ATOM 1836 N SER B 31 -10.891 2.057 6.443 1.00 0.00 N ATOM 1837 CA SER B 31 -11.518 2.670 5.237 1.00 0.00 C ATOM 1838 C SER B 31 -10.917 2.168 3.877 1.00 0.00 C ATOM 1839 O SER B 31 -11.660 2.075 2.897 1.00 0.00 O ATOM 1840 CB SER B 31 -11.491 4.209 5.358 1.00 0.00 C ATOM 1841 OG SER B 31 -12.210 4.643 6.508 1.00 0.00 O ATOM 0 H SER B 31 -10.342 2.717 6.993 1.00 0.00 H new ATOM 0 HA SER B 31 -12.555 2.334 5.211 1.00 0.00 H new ATOM 0 HB2 SER B 31 -10.459 4.555 5.418 1.00 0.00 H new ATOM 0 HB3 SER B 31 -11.925 4.655 4.463 1.00 0.00 H new ATOM 0 HG SER B 31 -11.590 4.752 7.259 1.00 0.00 H new ATOM 1847 N ILE B 32 -9.613 1.805 3.816 1.00 0.00 N ATOM 1848 CA ILE B 32 -8.929 1.196 2.646 1.00 0.00 C ATOM 1849 C ILE B 32 -9.458 -0.219 2.423 1.00 0.00 C ATOM 1850 O ILE B 32 -9.939 -0.469 1.329 1.00 0.00 O ATOM 1851 CB ILE B 32 -7.383 1.160 2.790 1.00 0.00 C ATOM 1852 CG1 ILE B 32 -6.873 2.393 3.548 1.00 0.00 C ATOM 1853 CG2 ILE B 32 -6.753 0.937 1.406 1.00 0.00 C ATOM 1854 CD1 ILE B 32 -5.478 2.900 3.415 1.00 0.00 C ATOM 0 H ILE B 32 -8.984 1.932 4.609 1.00 0.00 H new ATOM 0 HA ILE B 32 -9.150 1.828 1.786 1.00 0.00 H new ATOM 0 HB ILE B 32 -7.070 0.318 3.407 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -7.531 3.219 3.277 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -7.032 2.194 4.608 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -5.667 0.911 1.500 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -7.104 -0.009 0.994 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -7.040 1.751 0.740 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -5.349 3.780 4.045 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -4.778 2.125 3.727 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -5.285 3.166 2.376 1.00 0.00 H new ATOM 1866 N THR B 33 -9.391 -1.123 3.417 1.00 0.00 N ATOM 1867 CA THR B 33 -10.018 -2.476 3.267 1.00 0.00 C ATOM 1868 C THR B 33 -11.528 -2.451 2.875 1.00 0.00 C ATOM 1869 O THR B 33 -11.957 -3.380 2.203 1.00 0.00 O ATOM 1870 CB THR B 33 -9.788 -3.369 4.516 1.00 0.00 C ATOM 1871 OG1 THR B 33 -10.349 -4.668 4.347 1.00 0.00 O ATOM 1872 CG2 THR B 33 -10.298 -2.763 5.829 1.00 0.00 C ATOM 0 H THR B 33 -8.927 -0.963 4.311 1.00 0.00 H new ATOM 0 HA THR B 33 -9.497 -2.922 2.419 1.00 0.00 H new ATOM 0 HB THR B 33 -8.704 -3.442 4.599 1.00 0.00 H new ATOM 0 HG1 THR B 33 -10.184 -5.203 5.151 1.00 0.00 H new ATOM 0 HG21 THR B 33 -10.097 -3.452 6.650 1.00 0.00 H new ATOM 0 HG22 THR B 33 -9.788 -1.818 6.016 1.00 0.00 H new ATOM 0 HG23 THR B 33 -11.371 -2.588 5.756 1.00 0.00 H new ATOM 1880 N GLU B 34 -12.314 -1.427 3.265 1.00 0.00 N ATOM 1881 CA GLU B 34 -13.679 -1.217 2.716 1.00 0.00 C ATOM 1882 C GLU B 34 -13.657 -0.790 1.215 1.00 0.00 C ATOM 1883 O GLU B 34 -14.540 -1.237 0.483 1.00 0.00 O ATOM 1884 CB GLU B 34 -14.479 -0.236 3.614 1.00 0.00 C ATOM 1885 CG GLU B 34 -14.940 -0.794 4.981 1.00 0.00 C ATOM 1886 CD GLU B 34 -15.995 -1.904 4.888 1.00 0.00 C ATOM 1887 OE1 GLU B 34 -17.202 -1.685 4.795 1.00 0.00 O ATOM 1888 OE2 GLU B 34 -15.435 -3.157 4.916 1.00 0.00 O ATOM 0 H GLU B 34 -12.032 -0.732 3.956 1.00 0.00 H new ATOM 0 HA GLU B 34 -14.201 -2.174 2.733 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -13.864 0.646 3.792 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -15.359 0.095 3.063 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -14.071 -1.179 5.515 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -15.343 0.025 5.577 1.00 0.00 H new ATOM 1896 N ALA B 35 -12.676 0.016 0.734 1.00 0.00 N ATOM 1897 CA ALA B 35 -12.446 0.225 -0.718 1.00 0.00 C ATOM 1898 C ALA B 35 -12.071 -1.094 -1.456 1.00 0.00 C ATOM 1899 O ALA B 35 -12.778 -1.514 -2.366 1.00 0.00 O ATOM 1900 CB ALA B 35 -11.325 1.284 -0.948 1.00 0.00 C ATOM 0 H ALA B 35 -12.031 0.532 1.332 1.00 0.00 H new ATOM 0 HA ALA B 35 -13.387 0.586 -1.135 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -11.171 1.424 -2.018 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -11.621 2.231 -0.497 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -10.398 0.938 -0.490 1.00 0.00 H new ATOM 1906 N LEU B 36 -11.009 -1.778 -1.008 1.00 0.00 N ATOM 1907 CA LEU B 36 -10.455 -3.017 -1.605 1.00 0.00 C ATOM 1908 C LEU B 36 -11.451 -4.179 -1.597 1.00 0.00 C ATOM 1909 O LEU B 36 -11.738 -4.740 -2.659 1.00 0.00 O ATOM 1910 CB LEU B 36 -9.101 -3.325 -0.941 1.00 0.00 C ATOM 1911 CG LEU B 36 -8.133 -2.085 -0.895 1.00 0.00 C ATOM 1912 CD1 LEU B 36 -6.730 -2.405 -0.443 1.00 0.00 C ATOM 1913 CD2 LEU B 36 -8.004 -1.324 -2.225 1.00 0.00 C ATOM 0 H LEU B 36 -10.486 -1.477 -0.186 1.00 0.00 H new ATOM 0 HA LEU B 36 -10.272 -2.860 -2.668 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -9.275 -3.679 0.075 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -8.615 -4.137 -1.483 1.00 0.00 H new ATOM 0 HG LEU B 36 -8.629 -1.457 -0.156 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -6.132 -1.494 -0.441 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -6.758 -2.823 0.563 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -6.285 -3.130 -1.124 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -7.318 -0.486 -2.100 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -7.620 -1.996 -2.993 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -8.982 -0.950 -2.526 1.00 0.00 H new ATOM 1925 N ARG B 37 -12.043 -4.483 -0.425 1.00 0.00 N ATOM 1926 CA ARG B 37 -13.110 -5.490 -0.338 1.00 0.00 C ATOM 1927 C ARG B 37 -14.366 -5.166 -1.220 1.00 0.00 C ATOM 1928 O ARG B 37 -14.989 -6.115 -1.704 1.00 0.00 O ATOM 1929 CB ARG B 37 -13.507 -5.668 1.148 1.00 0.00 C ATOM 1930 CG ARG B 37 -14.488 -6.806 1.494 1.00 0.00 C ATOM 1931 CD ARG B 37 -14.975 -6.670 2.947 1.00 0.00 C ATOM 1932 NE ARG B 37 -15.847 -7.800 3.354 1.00 0.00 N ATOM 1933 CZ ARG B 37 -15.451 -8.871 4.071 1.00 0.00 C ATOM 1934 NH1 ARG B 37 -14.208 -9.056 4.513 1.00 0.00 N ATOM 1935 NH2 ARG B 37 -16.350 -9.796 4.352 1.00 0.00 N ATOM 0 H ARG B 37 -11.801 -4.048 0.465 1.00 0.00 H new ATOM 0 HA ARG B 37 -12.713 -6.421 -0.743 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -12.594 -5.825 1.723 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -13.944 -4.731 1.493 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -15.340 -6.780 0.814 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -13.999 -7.771 1.356 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -14.114 -6.619 3.614 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -15.521 -5.733 3.059 1.00 0.00 H new ATOM 0 HE ARG B 37 -16.825 -7.763 3.068 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -13.487 -8.362 4.313 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -13.977 -9.891 5.051 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -17.311 -9.688 4.028 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -16.083 -10.619 4.893 1.00 0.00 H new ATOM 1948 N LYS B 38 -14.732 -3.870 -1.428 1.00 0.00 N ATOM 1949 CA LYS B 38 -15.930 -3.510 -2.242 1.00 0.00 C ATOM 1950 C LYS B 38 -15.660 -3.225 -3.764 1.00 0.00 C ATOM 1951 O LYS B 38 -16.583 -2.800 -4.465 1.00 0.00 O ATOM 1952 CB LYS B 38 -16.614 -2.315 -1.512 1.00 0.00 C ATOM 1953 CG LYS B 38 -18.083 -2.003 -1.887 1.00 0.00 C ATOM 1954 CD LYS B 38 -18.768 -0.955 -0.984 1.00 0.00 C ATOM 1955 CE LYS B 38 -18.213 0.478 -1.122 1.00 0.00 C ATOM 1956 NZ LYS B 38 -18.936 1.422 -0.252 1.00 0.00 N ATOM 0 H LYS B 38 -14.225 -3.069 -1.051 1.00 0.00 H new ATOM 0 HA LYS B 38 -16.587 -4.378 -2.298 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -16.573 -2.506 -0.440 1.00 0.00 H new ATOM 0 HB3 LYS B 38 -16.020 -1.420 -1.700 1.00 0.00 H new ATOM 0 HG2 LYS B 38 -18.114 -1.651 -2.918 1.00 0.00 H new ATOM 0 HG3 LYS B 38 -18.658 -2.928 -1.849 1.00 0.00 H new ATOM 0 HD2 LYS B 38 -19.834 -0.940 -1.212 1.00 0.00 H new ATOM 0 HD3 LYS B 38 -18.668 -1.270 0.055 1.00 0.00 H new ATOM 0 HE2 LYS B 38 -17.153 0.485 -0.867 1.00 0.00 H new ATOM 0 HE3 LYS B 38 -18.294 0.802 -2.159 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 -18.538 2.376 -0.369 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 -19.943 1.432 -0.512 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 -18.838 1.125 0.740 1.00 0.00 H new ATOM 1969 N GLY B 39 -14.445 -3.472 -4.305 1.00 0.00 N ATOM 1970 CA GLY B 39 -14.091 -3.082 -5.699 1.00 0.00 C ATOM 1971 C GLY B 39 -14.013 -1.546 -5.937 1.00 0.00 C ATOM 1972 O GLY B 39 -14.591 -1.036 -6.900 1.00 0.00 O ATOM 0 H GLY B 39 -13.690 -3.939 -3.802 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -13.129 -3.526 -5.954 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -14.829 -3.506 -6.380 1.00 0.00 H new ATOM 1976 N ASP B 40 -13.296 -0.843 -5.043 1.00 0.00 N ATOM 1977 CA ASP B 40 -13.204 0.642 -5.011 1.00 0.00 C ATOM 1978 C ASP B 40 -11.747 1.137 -4.835 1.00 0.00 C ATOM 1979 O ASP B 40 -10.894 0.487 -4.218 1.00 0.00 O ATOM 1980 CB ASP B 40 -14.196 1.234 -3.970 1.00 0.00 C ATOM 1981 CG ASP B 40 -15.668 1.234 -4.410 1.00 0.00 C ATOM 1982 OD1 ASP B 40 -16.451 0.321 -4.152 1.00 0.00 O ATOM 1983 OD2 ASP B 40 -15.995 2.357 -5.125 1.00 0.00 O ATOM 0 H ASP B 40 -12.752 -1.291 -4.306 1.00 0.00 H new ATOM 0 HA ASP B 40 -13.512 1.023 -5.985 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -14.109 0.668 -3.043 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -13.898 2.259 -3.747 1.00 0.00 H new ATOM 1989 N LYS B 41 -11.496 2.325 -5.420 1.00 0.00 N ATOM 1990 CA LYS B 41 -10.184 3.009 -5.362 1.00 0.00 C ATOM 1991 C LYS B 41 -10.182 4.002 -4.169 1.00 0.00 C ATOM 1992 O LYS B 41 -11.167 4.682 -3.858 1.00 0.00 O ATOM 1993 CB LYS B 41 -9.840 3.792 -6.659 1.00 0.00 C ATOM 1994 CG LYS B 41 -9.873 2.979 -7.973 1.00 0.00 C ATOM 1995 CD LYS B 41 -9.226 3.728 -9.154 1.00 0.00 C ATOM 1996 CE LYS B 41 -9.217 2.897 -10.449 1.00 0.00 C ATOM 1997 NZ LYS B 41 -8.580 3.631 -11.556 1.00 0.00 N ATOM 0 H LYS B 41 -12.199 2.841 -5.949 1.00 0.00 H new ATOM 0 HA LYS B 41 -9.429 2.233 -5.242 1.00 0.00 H new ATOM 0 HB2 LYS B 41 -10.538 4.624 -6.753 1.00 0.00 H new ATOM 0 HB3 LYS B 41 -8.845 4.222 -6.546 1.00 0.00 H new ATOM 0 HG2 LYS B 41 -9.356 2.032 -7.822 1.00 0.00 H new ATOM 0 HG3 LYS B 41 -10.907 2.741 -8.222 1.00 0.00 H new ATOM 0 HD2 LYS B 41 -9.765 4.659 -9.328 1.00 0.00 H new ATOM 0 HD3 LYS B 41 -8.203 3.997 -8.892 1.00 0.00 H new ATOM 0 HE2 LYS B 41 -8.686 1.961 -10.278 1.00 0.00 H new ATOM 0 HE3 LYS B 41 -10.240 2.638 -10.724 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 -8.590 3.043 -12.414 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 -9.102 4.512 -11.734 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 -7.597 3.856 -11.303 1.00 0.00 H new ATOM 2010 N VAL B 42 -8.999 4.124 -3.567 1.00 0.00 N ATOM 2011 CA VAL B 42 -8.727 4.957 -2.391 1.00 0.00 C ATOM 2012 C VAL B 42 -8.183 6.298 -2.989 1.00 0.00 C ATOM 2013 O VAL B 42 -8.720 6.815 -3.976 1.00 0.00 O ATOM 2014 CB VAL B 42 -7.778 3.991 -1.584 1.00 0.00 C ATOM 2015 CG1 VAL B 42 -7.431 4.483 -0.191 1.00 0.00 C ATOM 2016 CG2 VAL B 42 -8.369 2.594 -1.251 1.00 0.00 C ATOM 0 H VAL B 42 -8.171 3.627 -3.896 1.00 0.00 H new ATOM 0 HA VAL B 42 -9.507 5.288 -1.705 1.00 0.00 H new ATOM 0 HB VAL B 42 -6.937 3.949 -2.276 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -6.775 3.762 0.297 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -6.924 5.445 -0.261 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -8.344 4.596 0.393 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -7.634 2.011 -0.695 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -9.269 2.714 -0.648 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -8.619 2.075 -2.176 1.00 0.00 H new ATOM 2026 N GLN B 43 -7.235 6.918 -2.289 1.00 0.00 N ATOM 2027 CA GLN B 43 -6.339 7.988 -2.798 1.00 0.00 C ATOM 2028 C GLN B 43 -5.513 8.736 -1.712 1.00 0.00 C ATOM 2029 O GLN B 43 -6.009 9.028 -0.622 1.00 0.00 O ATOM 2030 CB GLN B 43 -6.564 8.692 -4.177 1.00 0.00 C ATOM 2031 CG GLN B 43 -6.189 7.793 -5.376 1.00 0.00 C ATOM 2032 CD GLN B 43 -6.438 8.428 -6.752 1.00 0.00 C ATOM 2033 OE1 GLN B 43 -5.822 9.429 -7.116 1.00 0.00 O ATOM 2034 NE2 GLN B 43 -7.323 7.849 -7.550 1.00 0.00 N ATOM 0 H GLN B 43 -7.052 6.689 -1.312 1.00 0.00 H new ATOM 0 HA GLN B 43 -5.648 7.316 -3.307 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -7.610 8.987 -4.263 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -5.971 9.606 -4.214 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -5.135 7.527 -5.298 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -6.758 6.865 -5.310 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -7.827 7.020 -7.236 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -7.500 8.233 -8.478 1.00 0.00 H new ATOM 2043 N LEU B 44 -4.232 9.012 -2.043 1.00 0.00 N ATOM 2044 CA LEU B 44 -3.242 9.687 -1.172 1.00 0.00 C ATOM 2045 C LEU B 44 -2.356 10.525 -2.141 1.00 0.00 C ATOM 2046 O LEU B 44 -1.588 9.956 -2.927 1.00 0.00 O ATOM 2047 CB LEU B 44 -2.340 8.704 -0.354 1.00 0.00 C ATOM 2048 CG LEU B 44 -3.070 7.585 0.445 1.00 0.00 C ATOM 2049 CD1 LEU B 44 -3.231 6.266 -0.340 1.00 0.00 C ATOM 2050 CD2 LEU B 44 -2.373 7.284 1.782 1.00 0.00 C ATOM 0 H LEU B 44 -3.845 8.763 -2.953 1.00 0.00 H new ATOM 0 HA LEU B 44 -3.762 10.283 -0.422 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.642 8.229 -1.044 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -1.746 9.291 0.347 1.00 0.00 H new ATOM 0 HG LEU B 44 -4.065 7.989 0.630 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -3.748 5.534 0.281 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -3.811 6.449 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.248 5.882 -0.611 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -2.916 6.498 2.306 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.351 6.956 1.594 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -2.358 8.185 2.395 1.00 0.00 H new ATOM 2062 N ILE B 45 -2.442 11.870 -2.108 1.00 0.00 N ATOM 2063 CA ILE B 45 -1.634 12.750 -3.005 1.00 0.00 C ATOM 2064 C ILE B 45 -0.156 12.825 -2.498 1.00 0.00 C ATOM 2065 O ILE B 45 0.122 12.873 -1.294 1.00 0.00 O ATOM 2066 CB ILE B 45 -2.349 14.115 -3.279 1.00 0.00 C ATOM 2067 CG1 ILE B 45 -1.809 14.823 -4.557 1.00 0.00 C ATOM 2068 CG2 ILE B 45 -2.312 15.047 -2.055 1.00 0.00 C ATOM 2069 CD1 ILE B 45 -2.682 15.965 -5.103 1.00 0.00 C ATOM 0 H ILE B 45 -3.059 12.379 -1.475 1.00 0.00 H new ATOM 0 HA ILE B 45 -1.564 12.310 -4.000 1.00 0.00 H new ATOM 0 HB ILE B 45 -3.396 13.877 -3.469 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -0.817 15.220 -4.339 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -1.688 14.076 -5.341 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -2.820 15.981 -2.294 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -2.813 14.565 -1.216 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -1.276 15.256 -1.788 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -2.214 16.387 -5.992 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -3.668 15.578 -5.361 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -2.784 16.740 -4.344 1.00 0.00 H new ATOM 2081 N GLY B 46 0.773 12.804 -3.461 1.00 0.00 N ATOM 2082 CA GLY B 46 2.231 12.751 -3.177 1.00 0.00 C ATOM 2083 C GLY B 46 2.808 11.458 -2.520 1.00 0.00 C ATOM 2084 O GLY B 46 3.905 11.520 -1.959 1.00 0.00 O ATOM 0 H GLY B 46 0.548 12.823 -4.456 1.00 0.00 H new ATOM 0 HA2 GLY B 46 2.759 12.911 -4.117 1.00 0.00 H new ATOM 0 HA3 GLY B 46 2.474 13.592 -2.527 1.00 0.00 H new ATOM 2088 N PHE B 47 2.106 10.306 -2.610 1.00 0.00 N ATOM 2089 CA PHE B 47 2.475 9.054 -1.921 1.00 0.00 C ATOM 2090 C PHE B 47 1.860 7.750 -2.511 1.00 0.00 C ATOM 2091 O PHE B 47 2.587 6.752 -2.533 1.00 0.00 O ATOM 2092 CB PHE B 47 2.030 9.182 -0.433 1.00 0.00 C ATOM 2093 CG PHE B 47 2.585 8.048 0.453 1.00 0.00 C ATOM 2094 CD1 PHE B 47 3.967 7.892 0.608 1.00 0.00 C ATOM 2095 CD2 PHE B 47 1.732 7.006 0.836 1.00 0.00 C ATOM 2096 CE1 PHE B 47 4.484 6.694 1.091 1.00 0.00 C ATOM 2097 CE2 PHE B 47 2.259 5.819 1.336 1.00 0.00 C ATOM 2098 CZ PHE B 47 3.634 5.667 1.461 1.00 0.00 C ATOM 0 H PHE B 47 1.258 10.221 -3.170 1.00 0.00 H new ATOM 0 HA PHE B 47 3.552 8.946 -2.048 1.00 0.00 H new ATOM 0 HB2 PHE B 47 2.364 10.142 -0.039 1.00 0.00 H new ATOM 0 HB3 PHE B 47 0.941 9.178 -0.382 1.00 0.00 H new ATOM 0 HD1 PHE B 47 4.633 8.703 0.352 1.00 0.00 H new ATOM 0 HD2 PHE B 47 0.662 7.124 0.743 1.00 0.00 H new ATOM 0 HE1 PHE B 47 5.553 6.565 1.177 1.00 0.00 H new ATOM 0 HE2 PHE B 47 1.599 5.016 1.627 1.00 0.00 H new ATOM 0 HZ PHE B 47 4.041 4.744 1.848 1.00 0.00 H new ATOM 2108 N GLY B 48 0.555 7.692 -2.859 1.00 0.00 N ATOM 2109 CA GLY B 48 -0.049 6.430 -3.315 1.00 0.00 C ATOM 2110 C GLY B 48 -1.508 6.412 -3.764 1.00 0.00 C ATOM 2111 O GLY B 48 -2.309 7.296 -3.466 1.00 0.00 O ATOM 0 H GLY B 48 -0.084 8.487 -2.833 1.00 0.00 H new ATOM 0 HA2 GLY B 48 0.553 6.062 -4.146 1.00 0.00 H new ATOM 0 HA3 GLY B 48 0.052 5.708 -2.504 1.00 0.00 H new ATOM 2115 N ASN B 49 -1.820 5.336 -4.499 1.00 0.00 N ATOM 2116 CA ASN B 49 -3.176 5.074 -5.036 1.00 0.00 C ATOM 2117 C ASN B 49 -3.413 3.555 -4.825 1.00 0.00 C ATOM 2118 O ASN B 49 -2.869 2.735 -5.576 1.00 0.00 O ATOM 2119 CB ASN B 49 -3.325 5.435 -6.550 1.00 0.00 C ATOM 2120 CG ASN B 49 -3.073 6.883 -7.031 1.00 0.00 C ATOM 2121 OD1 ASN B 49 -2.746 7.803 -6.281 1.00 0.00 O ATOM 2122 ND2 ASN B 49 -3.237 7.115 -8.324 1.00 0.00 N ATOM 0 H ASN B 49 -1.141 4.615 -4.743 1.00 0.00 H new ATOM 0 HA ASN B 49 -3.906 5.699 -4.522 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -2.647 4.787 -7.105 1.00 0.00 H new ATOM 0 HB3 ASN B 49 -4.338 5.167 -6.848 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -3.092 8.054 -8.696 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -3.508 6.355 -8.948 1.00 0.00 H new ATOM 2129 N PHE B 50 -4.203 3.165 -3.803 1.00 0.00 N ATOM 2130 CA PHE B 50 -4.552 1.731 -3.598 1.00 0.00 C ATOM 2131 C PHE B 50 -5.787 1.381 -4.459 1.00 0.00 C ATOM 2132 O PHE B 50 -6.752 2.150 -4.554 1.00 0.00 O ATOM 2133 CB PHE B 50 -4.955 1.295 -2.168 1.00 0.00 C ATOM 2134 CG PHE B 50 -3.968 1.374 -1.030 1.00 0.00 C ATOM 2135 CD1 PHE B 50 -3.780 2.595 -0.375 1.00 0.00 C ATOM 2136 CD2 PHE B 50 -3.467 0.197 -0.466 1.00 0.00 C ATOM 2137 CE1 PHE B 50 -3.013 2.652 0.783 1.00 0.00 C ATOM 2138 CE2 PHE B 50 -2.695 0.263 0.686 1.00 0.00 C ATOM 2139 CZ PHE B 50 -2.437 1.492 1.278 1.00 0.00 C ATOM 0 H PHE B 50 -4.607 3.802 -3.117 1.00 0.00 H new ATOM 0 HA PHE B 50 -3.624 1.220 -3.855 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -5.821 1.892 -1.883 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -5.289 0.259 -2.231 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -4.231 3.494 -0.769 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -3.679 -0.758 -0.924 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -2.867 3.593 1.293 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -2.295 -0.641 1.121 1.00 0.00 H new ATOM 0 HZ PHE B 50 -1.780 1.545 2.134 1.00 0.00 H new ATOM 2149 N GLU B 51 -5.753 0.172 -5.030 1.00 0.00 N ATOM 2150 CA GLU B 51 -6.891 -0.369 -5.806 1.00 0.00 C ATOM 2151 C GLU B 51 -6.763 -1.896 -5.967 1.00 0.00 C ATOM 2152 O GLU B 51 -5.669 -2.467 -5.929 1.00 0.00 O ATOM 2153 CB GLU B 51 -7.121 0.369 -7.166 1.00 0.00 C ATOM 2154 CG GLU B 51 -6.026 0.280 -8.261 1.00 0.00 C ATOM 2155 CD GLU B 51 -4.762 1.109 -7.988 1.00 0.00 C ATOM 2156 OE1 GLU B 51 -4.710 2.331 -8.123 1.00 0.00 O ATOM 2157 OE2 GLU B 51 -3.711 0.333 -7.567 1.00 0.00 O ATOM 0 H GLU B 51 -4.952 -0.457 -4.973 1.00 0.00 H new ATOM 0 HA GLU B 51 -7.795 -0.172 -5.230 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -8.048 -0.012 -7.595 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.282 1.424 -6.945 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -5.738 -0.764 -8.381 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -6.455 0.603 -9.209 1.00 0.00 H new ATOM 2165 N VAL B 52 -7.907 -2.564 -6.176 1.00 0.00 N ATOM 2166 CA VAL B 52 -7.986 -4.027 -6.235 1.00 0.00 C ATOM 2167 C VAL B 52 -7.974 -4.539 -7.716 1.00 0.00 C ATOM 2168 O VAL B 52 -8.323 -3.805 -8.650 1.00 0.00 O ATOM 2169 CB VAL B 52 -9.224 -4.316 -5.307 1.00 0.00 C ATOM 2170 CG1 VAL B 52 -10.478 -4.696 -6.087 1.00 0.00 C ATOM 2171 CG2 VAL B 52 -8.856 -5.298 -4.191 1.00 0.00 C ATOM 0 H VAL B 52 -8.806 -2.101 -6.309 1.00 0.00 H new ATOM 0 HA VAL B 52 -7.135 -4.599 -5.865 1.00 0.00 H new ATOM 0 HB VAL B 52 -9.494 -3.382 -4.815 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -11.296 -4.883 -5.392 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -10.750 -3.881 -6.757 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -10.285 -5.596 -6.670 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -9.729 -5.480 -3.564 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -8.521 -6.238 -4.629 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -8.056 -4.875 -3.584 1.00 0.00 H new ATOM 2181 N ARG B 53 -7.606 -5.820 -7.906 1.00 0.00 N ATOM 2182 CA ARG B 53 -7.562 -6.454 -9.251 1.00 0.00 C ATOM 2183 C ARG B 53 -8.498 -7.684 -9.222 1.00 0.00 C ATOM 2184 O ARG B 53 -8.102 -8.764 -8.774 1.00 0.00 O ATOM 2185 CB ARG B 53 -6.091 -6.794 -9.630 1.00 0.00 C ATOM 2186 CG ARG B 53 -5.824 -7.263 -11.083 1.00 0.00 C ATOM 2187 CD ARG B 53 -6.045 -8.772 -11.327 1.00 0.00 C ATOM 2188 NE ARG B 53 -5.662 -9.172 -12.702 1.00 0.00 N ATOM 2189 CZ ARG B 53 -5.483 -10.445 -13.108 1.00 0.00 C ATOM 2190 NH1 ARG B 53 -5.612 -11.506 -12.313 1.00 0.00 N ATOM 2191 NH2 ARG B 53 -5.158 -10.656 -14.370 1.00 0.00 N ATOM 0 H ARG B 53 -7.333 -6.444 -7.147 1.00 0.00 H new ATOM 0 HA ARG B 53 -7.917 -5.780 -10.030 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -5.481 -5.910 -9.443 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -5.739 -7.573 -8.954 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -6.472 -6.702 -11.756 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -4.797 -7.013 -11.348 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -5.462 -9.345 -10.606 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -7.093 -9.018 -11.156 1.00 0.00 H new ATOM 0 HE ARG B 53 -5.524 -8.432 -13.390 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -5.861 -11.381 -11.332 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -5.462 -12.444 -12.686 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -5.049 -9.867 -15.007 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -5.016 -11.608 -14.708 1.00 0.00 H new ATOM 2522 N LYS B 75 -10.365 -10.723 -5.894 1.00 0.00 N ATOM 2523 CA LYS B 75 -9.882 -9.309 -5.877 1.00 0.00 C ATOM 2524 C LYS B 75 -8.509 -9.284 -5.147 1.00 0.00 C ATOM 2525 O LYS B 75 -8.394 -9.793 -4.027 1.00 0.00 O ATOM 2526 CB LYS B 75 -10.853 -8.250 -5.293 1.00 0.00 C ATOM 2527 CG LYS B 75 -12.372 -8.522 -5.406 1.00 0.00 C ATOM 2528 CD LYS B 75 -13.237 -7.337 -4.924 1.00 0.00 C ATOM 2529 CE LYS B 75 -14.757 -7.587 -4.939 1.00 0.00 C ATOM 2530 NZ LYS B 75 -15.202 -8.551 -3.913 1.00 0.00 N ATOM 0 HA LYS B 75 -9.799 -9.000 -6.919 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -10.613 -8.122 -4.237 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -10.646 -7.299 -5.784 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -12.619 -8.746 -6.444 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -12.621 -9.407 -4.821 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -12.937 -7.078 -3.908 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -13.021 -6.471 -5.550 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -15.275 -6.640 -4.787 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -15.048 -7.955 -5.923 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -16.186 -8.830 -4.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -14.592 -9.393 -3.940 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -15.142 -8.110 -2.973 1.00 0.00 H new ATOM 2543 N VAL B 76 -7.481 -8.678 -5.763 1.00 0.00 N ATOM 2544 CA VAL B 76 -6.095 -8.748 -5.317 1.00 0.00 C ATOM 2545 C VAL B 76 -5.684 -7.289 -4.920 1.00 0.00 C ATOM 2546 O VAL B 76 -5.755 -6.392 -5.762 1.00 0.00 O ATOM 2547 CB VAL B 76 -5.419 -9.386 -6.574 1.00 0.00 C ATOM 2548 CG1 VAL B 76 -4.130 -8.737 -7.005 1.00 0.00 C ATOM 2549 CG2 VAL B 76 -5.281 -10.906 -6.451 1.00 0.00 C ATOM 0 H VAL B 76 -7.602 -8.114 -6.604 1.00 0.00 H new ATOM 0 HA VAL B 76 -5.832 -9.335 -4.437 1.00 0.00 H new ATOM 0 HB VAL B 76 -6.116 -9.177 -7.386 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -3.740 -9.251 -7.884 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -4.313 -7.690 -7.248 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -3.403 -8.800 -6.196 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -4.806 -11.302 -7.349 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -4.670 -11.147 -5.581 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -6.268 -11.353 -6.336 1.00 0.00 H new ATOM 2559 N PRO B 77 -5.195 -7.012 -3.694 1.00 0.00 N ATOM 2560 CA PRO B 77 -4.866 -5.644 -3.248 1.00 0.00 C ATOM 2561 C PRO B 77 -3.466 -5.170 -3.675 1.00 0.00 C ATOM 2562 O PRO B 77 -2.465 -5.895 -3.643 1.00 0.00 O ATOM 2563 CB PRO B 77 -5.004 -5.797 -1.724 1.00 0.00 C ATOM 2564 CG PRO B 77 -4.565 -7.240 -1.444 1.00 0.00 C ATOM 2565 CD PRO B 77 -4.975 -8.042 -2.684 1.00 0.00 C ATOM 0 HA PRO B 77 -5.504 -4.877 -3.687 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -4.376 -5.081 -1.194 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -6.030 -5.623 -1.398 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -3.489 -7.297 -1.278 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -5.047 -7.630 -0.548 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -4.196 -8.741 -2.986 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -5.877 -8.628 -2.504 1.00 0.00 H new ATOM 2573 N ALA B 78 -3.477 -3.898 -4.062 1.00 0.00 N ATOM 2574 CA ALA B 78 -2.305 -3.207 -4.603 1.00 0.00 C ATOM 2575 C ALA B 78 -2.213 -1.774 -4.029 1.00 0.00 C ATOM 2576 O ALA B 78 -3.169 -1.190 -3.509 1.00 0.00 O ATOM 2577 CB ALA B 78 -2.494 -3.241 -6.128 1.00 0.00 C ATOM 0 H ALA B 78 -4.308 -3.309 -4.009 1.00 0.00 H new ATOM 0 HA ALA B 78 -1.362 -3.679 -4.328 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -1.654 -2.741 -6.610 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -2.542 -4.276 -6.466 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -3.420 -2.730 -6.391 1.00 0.00 H new ATOM 2583 N PHE B 79 -0.996 -1.248 -4.142 1.00 0.00 N ATOM 2584 CA PHE B 79 -0.614 0.106 -3.676 1.00 0.00 C ATOM 2585 C PHE B 79 0.424 0.597 -4.731 1.00 0.00 C ATOM 2586 O PHE B 79 1.491 0.016 -4.960 1.00 0.00 O ATOM 2587 CB PHE B 79 -0.094 0.086 -2.221 1.00 0.00 C ATOM 2588 CG PHE B 79 0.781 1.271 -1.765 1.00 0.00 C ATOM 2589 CD1 PHE B 79 0.202 2.458 -1.311 1.00 0.00 C ATOM 2590 CD2 PHE B 79 2.174 1.198 -1.911 1.00 0.00 C ATOM 2591 CE1 PHE B 79 1.002 3.560 -1.023 1.00 0.00 C ATOM 2592 CE2 PHE B 79 2.968 2.309 -1.650 1.00 0.00 C ATOM 2593 CZ PHE B 79 2.380 3.492 -1.215 1.00 0.00 C ATOM 0 H PHE B 79 -0.220 -1.754 -4.569 1.00 0.00 H new ATOM 0 HA PHE B 79 -1.455 0.797 -3.620 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -0.956 0.028 -1.556 1.00 0.00 H new ATOM 0 HB3 PHE B 79 0.480 -0.830 -2.081 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -0.869 2.521 -1.183 1.00 0.00 H new ATOM 0 HD2 PHE B 79 2.633 0.273 -2.228 1.00 0.00 H new ATOM 0 HE1 PHE B 79 0.554 4.469 -0.650 1.00 0.00 H new ATOM 0 HE2 PHE B 79 4.038 2.254 -1.785 1.00 0.00 H new ATOM 0 HZ PHE B 79 2.994 4.360 -1.026 1.00 0.00 H new ATOM 2603 N LYS B 80 0.060 1.732 -5.306 1.00 0.00 N ATOM 2604 CA LYS B 80 0.947 2.553 -6.186 1.00 0.00 C ATOM 2605 C LYS B 80 1.841 3.432 -5.277 1.00 0.00 C ATOM 2606 O LYS B 80 1.333 3.923 -4.265 1.00 0.00 O ATOM 2607 CB LYS B 80 0.114 3.449 -7.143 1.00 0.00 C ATOM 2608 CG LYS B 80 -0.685 2.710 -8.247 1.00 0.00 C ATOM 2609 CD LYS B 80 0.132 1.929 -9.300 1.00 0.00 C ATOM 2610 CE LYS B 80 1.049 2.802 -10.180 1.00 0.00 C ATOM 2611 NZ LYS B 80 1.760 1.993 -11.186 1.00 0.00 N ATOM 0 H LYS B 80 -0.870 2.134 -5.187 1.00 0.00 H new ATOM 0 HA LYS B 80 1.557 1.895 -6.804 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -0.586 4.032 -6.545 1.00 0.00 H new ATOM 0 HB3 LYS B 80 0.789 4.157 -7.624 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -1.367 2.012 -7.762 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -1.298 3.444 -8.770 1.00 0.00 H new ATOM 0 HD2 LYS B 80 0.743 1.185 -8.788 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -0.558 1.385 -9.945 1.00 0.00 H new ATOM 0 HE2 LYS B 80 0.455 3.567 -10.680 1.00 0.00 H new ATOM 0 HE3 LYS B 80 1.772 3.321 -9.551 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 2.368 2.610 -11.761 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 2.345 1.279 -10.707 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 1.069 1.518 -11.801 1.00 0.00 H new ATOM 2624 N PRO B 81 3.151 3.681 -5.563 1.00 0.00 N ATOM 2625 CA PRO B 81 3.926 4.707 -4.817 1.00 0.00 C ATOM 2626 C PRO B 81 3.631 6.176 -5.293 1.00 0.00 C ATOM 2627 O PRO B 81 4.505 7.038 -5.212 1.00 0.00 O ATOM 2628 CB PRO B 81 5.355 4.210 -5.107 1.00 0.00 C ATOM 2629 CG PRO B 81 5.316 3.622 -6.519 1.00 0.00 C ATOM 2630 CD PRO B 81 3.930 2.988 -6.612 1.00 0.00 C ATOM 0 HA PRO B 81 3.692 4.791 -3.756 1.00 0.00 H new ATOM 0 HB2 PRO B 81 6.073 5.028 -5.044 1.00 0.00 H new ATOM 0 HB3 PRO B 81 5.662 3.459 -4.379 1.00 0.00 H new ATOM 0 HG2 PRO B 81 5.455 4.393 -7.277 1.00 0.00 H new ATOM 0 HG3 PRO B 81 6.104 2.884 -6.667 1.00 0.00 H new ATOM 0 HD2 PRO B 81 3.490 3.133 -7.598 1.00 0.00 H new ATOM 0 HD3 PRO B 81 3.970 1.913 -6.436 1.00 0.00 H new ATOM 2638 N GLY B 82 2.392 6.451 -5.769 1.00 0.00 N ATOM 2639 CA GLY B 82 1.943 7.737 -6.346 1.00 0.00 C ATOM 2640 C GLY B 82 2.850 8.463 -7.354 1.00 0.00 C ATOM 2641 O GLY B 82 2.631 9.662 -7.543 1.00 0.00 O ATOM 0 H GLY B 82 1.649 5.752 -5.760 1.00 0.00 H new ATOM 0 HA2 GLY B 82 0.984 7.561 -6.834 1.00 0.00 H new ATOM 0 HA3 GLY B 82 1.758 8.422 -5.518 1.00 0.00 H new ATOM 2645 N LYS B 83 3.846 7.757 -7.958 1.00 0.00 N ATOM 2646 CA LYS B 83 4.986 8.393 -8.722 1.00 0.00 C ATOM 2647 C LYS B 83 6.033 9.164 -7.840 1.00 0.00 C ATOM 2648 O LYS B 83 7.247 9.081 -8.018 1.00 0.00 O ATOM 2649 CB LYS B 83 4.553 9.325 -9.895 1.00 0.00 C ATOM 2650 CG LYS B 83 4.789 8.768 -11.318 1.00 0.00 C ATOM 2651 CD LYS B 83 6.264 8.542 -11.737 1.00 0.00 C ATOM 2652 CE LYS B 83 7.204 9.768 -11.718 1.00 0.00 C ATOM 2653 NZ LYS B 83 6.844 10.797 -12.712 1.00 0.00 N ATOM 0 H LYS B 83 3.892 6.738 -7.937 1.00 0.00 H new ATOM 0 HA LYS B 83 5.469 7.509 -9.138 1.00 0.00 H new ATOM 0 HB2 LYS B 83 3.492 9.549 -9.784 1.00 0.00 H new ATOM 0 HB3 LYS B 83 5.089 10.269 -9.801 1.00 0.00 H new ATOM 0 HG2 LYS B 83 4.261 7.819 -11.405 1.00 0.00 H new ATOM 0 HG3 LYS B 83 4.333 9.453 -12.032 1.00 0.00 H new ATOM 0 HD2 LYS B 83 6.688 7.782 -11.081 1.00 0.00 H new ATOM 0 HD3 LYS B 83 6.268 8.130 -12.746 1.00 0.00 H new ATOM 0 HE2 LYS B 83 7.189 10.213 -10.723 1.00 0.00 H new ATOM 0 HE3 LYS B 83 8.226 9.436 -11.903 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 7.512 11.591 -12.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 6.885 10.387 -13.667 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 5.880 11.140 -12.524 1.00 0.00 H new ATOM 2666 N ALA B 84 5.467 9.984 -6.963 1.00 0.00 N ATOM 2667 CA ALA B 84 6.099 10.835 -5.946 1.00 0.00 C ATOM 2668 C ALA B 84 7.009 10.111 -4.933 1.00 0.00 C ATOM 2669 O ALA B 84 8.143 10.559 -4.742 1.00 0.00 O ATOM 2670 CB ALA B 84 4.871 11.430 -5.256 1.00 0.00 C ATOM 0 H ALA B 84 4.452 10.084 -6.939 1.00 0.00 H new ATOM 0 HA ALA B 84 6.793 11.546 -6.394 1.00 0.00 H new ATOM 0 HB1 ALA B 84 5.191 12.100 -4.458 1.00 0.00 H new ATOM 0 HB2 ALA B 84 4.280 11.988 -5.982 1.00 0.00 H new ATOM 0 HB3 ALA B 84 4.265 10.627 -4.835 1.00 0.00 H new ATOM 2676 N LEU B 85 6.538 9.012 -4.289 1.00 0.00 N ATOM 2677 CA LEU B 85 7.424 8.118 -3.519 1.00 0.00 C ATOM 2678 C LEU B 85 8.490 7.472 -4.472 1.00 0.00 C ATOM 2679 O LEU B 85 9.651 7.415 -4.075 1.00 0.00 O ATOM 2680 CB LEU B 85 6.605 7.091 -2.685 1.00 0.00 C ATOM 2681 CG LEU B 85 7.505 6.113 -1.899 1.00 0.00 C ATOM 2682 CD1 LEU B 85 8.250 6.679 -0.679 1.00 0.00 C ATOM 2683 CD2 LEU B 85 6.762 4.819 -1.518 1.00 0.00 C ATOM 0 H LEU B 85 5.558 8.730 -4.291 1.00 0.00 H new ATOM 0 HA LEU B 85 7.980 8.697 -2.782 1.00 0.00 H new ATOM 0 HB2 LEU B 85 5.960 7.626 -1.988 1.00 0.00 H new ATOM 0 HB3 LEU B 85 5.954 6.525 -3.351 1.00 0.00 H new ATOM 0 HG LEU B 85 8.292 5.894 -2.620 1.00 0.00 H new ATOM 0 HD11 LEU B 85 8.845 5.891 -0.218 1.00 0.00 H new ATOM 0 HD12 LEU B 85 8.906 7.490 -0.997 1.00 0.00 H new ATOM 0 HD13 LEU B 85 7.528 7.059 0.044 1.00 0.00 H new ATOM 0 HD21 LEU B 85 7.435 4.162 -0.967 1.00 0.00 H new ATOM 0 HD22 LEU B 85 5.902 5.063 -0.895 1.00 0.00 H new ATOM 0 HD23 LEU B 85 6.423 4.314 -2.423 1.00 0.00 H new ATOM 2695 N LYS B 86 8.129 6.997 -5.684 1.00 0.00 N ATOM 2696 CA LYS B 86 9.122 6.525 -6.697 1.00 0.00 C ATOM 2697 C LYS B 86 10.278 7.548 -7.023 1.00 0.00 C ATOM 2698 O LYS B 86 11.384 7.123 -7.358 1.00 0.00 O ATOM 2699 CB LYS B 86 8.393 5.982 -7.955 1.00 0.00 C ATOM 2700 CG LYS B 86 9.250 5.038 -8.823 1.00 0.00 C ATOM 2701 CD LYS B 86 8.496 4.477 -10.043 1.00 0.00 C ATOM 2702 CE LYS B 86 9.370 3.535 -10.892 1.00 0.00 C ATOM 2703 NZ LYS B 86 8.631 3.012 -12.054 1.00 0.00 N ATOM 0 H LYS B 86 7.159 6.927 -5.993 1.00 0.00 H new ATOM 0 HA LYS B 86 9.663 5.697 -6.239 1.00 0.00 H new ATOM 0 HB2 LYS B 86 7.494 5.452 -7.640 1.00 0.00 H new ATOM 0 HB3 LYS B 86 8.069 6.825 -8.566 1.00 0.00 H new ATOM 0 HG2 LYS B 86 10.134 5.575 -9.167 1.00 0.00 H new ATOM 0 HG3 LYS B 86 9.600 4.209 -8.208 1.00 0.00 H new ATOM 0 HD2 LYS B 86 7.611 3.939 -9.704 1.00 0.00 H new ATOM 0 HD3 LYS B 86 8.149 5.303 -10.663 1.00 0.00 H new ATOM 0 HE2 LYS B 86 10.256 4.069 -11.234 1.00 0.00 H new ATOM 0 HE3 LYS B 86 9.716 2.705 -10.276 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 9.249 2.382 -12.603 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 7.799 2.481 -11.726 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 8.322 3.803 -12.654 1.00 0.00 H new ATOM 2716 N ASP B 87 10.031 8.867 -6.877 1.00 0.00 N ATOM 2717 CA ASP B 87 11.052 9.936 -6.942 1.00 0.00 C ATOM 2718 C ASP B 87 11.907 10.042 -5.634 1.00 0.00 C ATOM 2719 O ASP B 87 13.132 10.144 -5.734 1.00 0.00 O ATOM 2720 CB ASP B 87 10.269 11.237 -7.271 1.00 0.00 C ATOM 2721 CG ASP B 87 10.848 12.009 -8.460 1.00 0.00 C ATOM 2722 OD1 ASP B 87 10.476 11.842 -9.622 1.00 0.00 O ATOM 2723 OD2 ASP B 87 11.825 12.891 -8.078 1.00 0.00 O ATOM 0 H ASP B 87 9.092 9.228 -6.706 1.00 0.00 H new ATOM 0 HA ASP B 87 11.797 9.726 -7.709 1.00 0.00 H new ATOM 0 HB2 ASP B 87 9.230 10.984 -7.482 1.00 0.00 H new ATOM 0 HB3 ASP B 87 10.267 11.883 -6.393 1.00 0.00 H new ATOM 2729 N ALA B 88 11.274 10.013 -4.432 1.00 0.00 N ATOM 2730 CA ALA B 88 11.974 9.917 -3.112 1.00 0.00 C ATOM 2731 C ALA B 88 13.035 8.781 -2.970 1.00 0.00 C ATOM 2732 O ALA B 88 14.095 8.959 -2.365 1.00 0.00 O ATOM 2733 CB ALA B 88 10.909 9.606 -2.019 1.00 0.00 C ATOM 0 H ALA B 88 10.259 10.055 -4.345 1.00 0.00 H new ATOM 0 HA ALA B 88 12.494 10.870 -3.014 1.00 0.00 H new ATOM 0 HB1 ALA B 88 11.396 9.531 -1.047 1.00 0.00 H new ATOM 0 HB2 ALA B 88 10.169 10.406 -1.994 1.00 0.00 H new ATOM 0 HB3 ALA B 88 10.415 8.662 -2.251 1.00 0.00 H new ATOM 2739 N VAL B 89 12.686 7.622 -3.540 1.00 0.00 N ATOM 2740 CA VAL B 89 13.386 6.341 -3.407 1.00 0.00 C ATOM 2741 C VAL B 89 14.328 5.916 -4.595 1.00 0.00 C ATOM 2742 O VAL B 89 14.973 4.867 -4.506 1.00 0.00 O ATOM 2743 CB VAL B 89 12.099 5.460 -3.182 1.00 0.00 C ATOM 2744 CG1 VAL B 89 11.468 4.949 -4.481 1.00 0.00 C ATOM 2745 CG2 VAL B 89 12.365 4.338 -2.219 1.00 0.00 C ATOM 0 H VAL B 89 11.863 7.550 -4.138 1.00 0.00 H new ATOM 0 HA VAL B 89 14.152 6.292 -2.634 1.00 0.00 H new ATOM 0 HB VAL B 89 11.358 6.124 -2.737 1.00 0.00 H new ATOM 0 HG11 VAL B 89 10.587 4.351 -4.247 1.00 0.00 H new ATOM 0 HG12 VAL B 89 11.177 5.796 -5.102 1.00 0.00 H new ATOM 0 HG13 VAL B 89 12.190 4.336 -5.020 1.00 0.00 H new ATOM 0 HG21 VAL B 89 11.457 3.750 -2.086 1.00 0.00 H new ATOM 0 HG22 VAL B 89 13.156 3.700 -2.613 1.00 0.00 H new ATOM 0 HG23 VAL B 89 12.675 4.749 -1.258 1.00 0.00 H new ATOM 2755 N LYS B 90 14.386 6.712 -5.686 1.00 0.00 N ATOM 2756 CA LYS B 90 15.143 6.413 -6.922 1.00 0.00 C ATOM 2757 C LYS B 90 16.662 6.534 -6.711 1.00 0.00 C ATOM 2758 O LYS B 90 17.376 5.530 -6.713 1.00 0.00 O ATOM 2759 CB LYS B 90 14.631 7.394 -8.024 1.00 0.00 C ATOM 2760 CG LYS B 90 13.982 6.700 -9.241 1.00 0.00 C ATOM 2761 CD LYS B 90 13.266 7.687 -10.185 1.00 0.00 C ATOM 2762 CE LYS B 90 12.506 6.977 -11.318 1.00 0.00 C ATOM 2763 NZ LYS B 90 11.802 7.940 -12.183 1.00 0.00 N ATOM 0 H LYS B 90 13.894 7.604 -5.732 1.00 0.00 H new ATOM 0 HA LYS B 90 14.975 5.380 -7.225 1.00 0.00 H new ATOM 0 HB2 LYS B 90 13.905 8.075 -7.579 1.00 0.00 H new ATOM 0 HB3 LYS B 90 15.467 8.001 -8.370 1.00 0.00 H new ATOM 0 HG2 LYS B 90 14.750 6.164 -9.799 1.00 0.00 H new ATOM 0 HG3 LYS B 90 13.266 5.957 -8.890 1.00 0.00 H new ATOM 0 HD2 LYS B 90 12.567 8.293 -9.608 1.00 0.00 H new ATOM 0 HD3 LYS B 90 13.999 8.369 -10.616 1.00 0.00 H new ATOM 0 HE2 LYS B 90 13.205 6.393 -11.916 1.00 0.00 H new ATOM 0 HE3 LYS B 90 11.788 6.276 -10.892 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 11.300 7.428 -12.936 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 11.117 8.480 -11.616 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 12.491 8.593 -12.608 1.00 0.00 H new