USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 780 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 87 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 91 HIS : no HE2:sc= -1.42 K(o=-1.4,f=-0.87) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.0427 X(o=-0.043,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0138 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 165:sc=-0.00566 (180deg=-0.172) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 83:sc= 0.828 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0.069) USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.259 X(o=-0.26,f=-0.004) USER MOD Single : A 44 MET CE :methyl -160:sc= -0.352 (180deg=-2.13) USER MOD Single : A 46 HIS : no HD1:sc= -0.0483 X(o=-0.048,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.0668 K(o=-0.067,f=-1.5!) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 165:sc= -2.14 (180deg=-2.79) USER MOD Single : A 77 SER OG : rot -140:sc= 0.795 USER MOD Single : A 78 GLN : amide:sc= -0.316 X(o=-0.32,f=-0.063) USER MOD Single : A 81 SER OG : rot -150:sc= -0.0802 USER MOD Single : A 82 GLN : amide:sc= -0.26 X(o=-0.26,f=-0.26) USER MOD Single : A 83 THR OG1 : rot 110:sc= 1.28 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 38:sc= 0.717 USER MOD Single : A 100 SER OG : rot 9:sc= 0.651 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.758 30.302 28.159 1.00 0.00 N ATOM 2 CA GLY A 1 -22.179 29.968 27.869 1.00 0.00 C ATOM 3 C GLY A 1 -22.328 29.068 26.657 1.00 0.00 C ATOM 4 O GLY A 1 -22.979 28.025 26.726 1.00 0.00 O ATOM 0 H1 GLY A 1 -20.710 30.918 28.995 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.226 29.427 28.343 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.343 30.794 27.342 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -22.618 29.478 28.738 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.739 30.889 27.705 1.00 0.00 H new ATOM 10 N SER A 2 -21.724 29.472 25.545 1.00 0.00 N ATOM 11 CA SER A 2 -21.793 28.696 24.312 1.00 0.00 C ATOM 12 C SER A 2 -20.837 27.508 24.364 1.00 0.00 C ATOM 13 O SER A 2 -19.697 27.635 24.808 1.00 0.00 O ATOM 14 CB SER A 2 -21.460 29.580 23.109 1.00 0.00 C ATOM 15 OG SER A 2 -22.075 30.851 23.224 1.00 0.00 O ATOM 0 H SER A 2 -21.181 30.332 25.472 1.00 0.00 H new ATOM 0 HA SER A 2 -22.810 28.318 24.206 1.00 0.00 H new ATOM 0 HB2 SER A 2 -20.380 29.701 23.031 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.793 29.093 22.193 1.00 0.00 H new ATOM 0 HG SER A 2 -21.845 31.397 22.444 1.00 0.00 H new ATOM 21 N SER A 3 -21.313 26.354 23.907 1.00 0.00 N ATOM 22 CA SER A 3 -20.500 25.143 23.901 1.00 0.00 C ATOM 23 C SER A 3 -20.261 24.654 22.476 1.00 0.00 C ATOM 24 O SER A 3 -21.134 24.768 21.615 1.00 0.00 O ATOM 25 CB SER A 3 -21.181 24.044 24.721 1.00 0.00 C ATOM 26 OG SER A 3 -21.555 24.521 26.001 1.00 0.00 O ATOM 0 H SER A 3 -22.256 26.232 23.537 1.00 0.00 H new ATOM 0 HA SER A 3 -19.536 25.380 24.351 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.063 23.684 24.191 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.506 23.195 24.829 1.00 0.00 H new ATOM 0 HG SER A 3 -21.989 23.801 26.504 1.00 0.00 H new ATOM 32 N GLY A 4 -19.072 24.112 22.233 1.00 0.00 N ATOM 33 CA GLY A 4 -18.739 23.615 20.911 1.00 0.00 C ATOM 34 C GLY A 4 -18.596 22.107 20.877 1.00 0.00 C ATOM 35 O GLY A 4 -18.698 21.443 21.908 1.00 0.00 O ATOM 0 H GLY A 4 -18.333 24.008 22.928 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.513 23.919 20.206 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.807 24.073 20.578 1.00 0.00 H new ATOM 39 N SER A 5 -18.358 21.564 19.688 1.00 0.00 N ATOM 40 CA SER A 5 -18.199 20.123 19.523 1.00 0.00 C ATOM 41 C SER A 5 -17.031 19.806 18.595 1.00 0.00 C ATOM 42 O SER A 5 -17.219 19.577 17.401 1.00 0.00 O ATOM 43 CB SER A 5 -19.487 19.508 18.970 1.00 0.00 C ATOM 44 OG SER A 5 -20.119 20.386 18.054 1.00 0.00 O ATOM 0 H SER A 5 -18.271 22.099 18.824 1.00 0.00 H new ATOM 0 HA SER A 5 -17.988 19.691 20.501 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.260 18.564 18.476 1.00 0.00 H new ATOM 0 HB3 SER A 5 -20.168 19.282 19.791 1.00 0.00 H new ATOM 0 HG SER A 5 -20.938 19.969 17.714 1.00 0.00 H new ATOM 50 N SER A 6 -15.825 19.795 19.154 1.00 0.00 N ATOM 51 CA SER A 6 -14.625 19.505 18.378 1.00 0.00 C ATOM 52 C SER A 6 -14.020 18.168 18.791 1.00 0.00 C ATOM 53 O SER A 6 -14.154 17.741 19.938 1.00 0.00 O ATOM 54 CB SER A 6 -13.596 20.621 18.558 1.00 0.00 C ATOM 55 OG SER A 6 -14.222 21.841 18.919 1.00 0.00 O ATOM 0 H SER A 6 -15.653 19.984 20.142 1.00 0.00 H new ATOM 0 HA SER A 6 -14.907 19.446 17.327 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.877 20.336 19.327 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.036 20.756 17.633 1.00 0.00 H new ATOM 0 HG SER A 6 -13.542 22.538 19.030 1.00 0.00 H new ATOM 61 N GLY A 7 -13.352 17.510 17.848 1.00 0.00 N ATOM 62 CA GLY A 7 -12.735 16.227 18.133 1.00 0.00 C ATOM 63 C GLY A 7 -12.999 15.202 17.048 1.00 0.00 C ATOM 64 O GLY A 7 -13.678 15.493 16.063 1.00 0.00 O ATOM 0 H GLY A 7 -13.227 17.842 16.892 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.659 16.362 18.247 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -13.111 15.850 19.084 1.00 0.00 H new ATOM 68 N SER A 8 -12.461 14.000 17.228 1.00 0.00 N ATOM 69 CA SER A 8 -12.643 12.929 16.256 1.00 0.00 C ATOM 70 C SER A 8 -12.070 13.324 14.899 1.00 0.00 C ATOM 71 O SER A 8 -12.613 14.189 14.213 1.00 0.00 O ATOM 72 CB SER A 8 -14.126 12.584 16.117 1.00 0.00 C ATOM 73 OG SER A 8 -14.301 11.316 15.510 1.00 0.00 O ATOM 0 H SER A 8 -11.896 13.744 18.038 1.00 0.00 H new ATOM 0 HA SER A 8 -12.106 12.051 16.615 1.00 0.00 H new ATOM 0 HB2 SER A 8 -14.597 12.588 17.100 1.00 0.00 H new ATOM 0 HB3 SER A 8 -14.626 13.348 15.521 1.00 0.00 H new ATOM 0 HG SER A 8 -15.258 11.119 15.434 1.00 0.00 H new ATOM 79 N SER A 9 -10.970 12.683 14.517 1.00 0.00 N ATOM 80 CA SER A 9 -10.324 12.966 13.241 1.00 0.00 C ATOM 81 C SER A 9 -10.534 11.819 12.258 1.00 0.00 C ATOM 82 O SER A 9 -10.051 10.708 12.472 1.00 0.00 O ATOM 83 CB SER A 9 -8.827 13.209 13.447 1.00 0.00 C ATOM 84 OG SER A 9 -8.256 13.853 12.322 1.00 0.00 O ATOM 0 H SER A 9 -10.508 11.964 15.073 1.00 0.00 H new ATOM 0 HA SER A 9 -10.778 13.865 12.824 1.00 0.00 H new ATOM 0 HB2 SER A 9 -8.674 13.820 14.337 1.00 0.00 H new ATOM 0 HB3 SER A 9 -8.322 12.259 13.622 1.00 0.00 H new ATOM 0 HG SER A 9 -7.300 13.999 12.479 1.00 0.00 H new ATOM 90 N ALA A 10 -11.258 12.097 11.178 1.00 0.00 N ATOM 91 CA ALA A 10 -11.532 11.089 10.162 1.00 0.00 C ATOM 92 C ALA A 10 -10.975 11.511 8.807 1.00 0.00 C ATOM 93 O ALA A 10 -10.025 10.912 8.301 1.00 0.00 O ATOM 94 CB ALA A 10 -13.028 10.831 10.066 1.00 0.00 C ATOM 0 H ALA A 10 -11.665 13.012 10.985 1.00 0.00 H new ATOM 0 HA ALA A 10 -11.035 10.165 10.457 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -13.219 10.076 9.303 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -13.399 10.477 11.028 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -13.540 11.755 9.798 1.00 0.00 H new ATOM 100 N LEU A 11 -11.568 12.547 8.221 1.00 0.00 N ATOM 101 CA LEU A 11 -11.127 13.048 6.925 1.00 0.00 C ATOM 102 C LEU A 11 -10.904 14.556 6.974 1.00 0.00 C ATOM 103 O LEU A 11 -11.840 15.338 6.803 1.00 0.00 O ATOM 104 CB LEU A 11 -12.156 12.709 5.843 1.00 0.00 C ATOM 105 CG LEU A 11 -12.648 11.258 5.841 1.00 0.00 C ATOM 106 CD1 LEU A 11 -11.476 10.290 5.919 1.00 0.00 C ATOM 107 CD2 LEU A 11 -13.621 11.021 6.989 1.00 0.00 C ATOM 0 H LEU A 11 -12.355 13.055 8.624 1.00 0.00 H new ATOM 0 HA LEU A 11 -10.181 12.564 6.680 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.016 13.367 5.964 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.720 12.929 4.868 1.00 0.00 H new ATOM 0 HG LEU A 11 -13.174 11.077 4.904 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.849 9.266 5.916 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.822 10.440 5.060 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -10.916 10.470 6.837 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.959 9.985 6.971 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.122 11.223 7.937 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -14.479 11.685 6.882 1.00 0.00 H new ATOM 119 N SER A 12 -9.659 14.958 7.207 1.00 0.00 N ATOM 120 CA SER A 12 -9.313 16.373 7.278 1.00 0.00 C ATOM 121 C SER A 12 -8.387 16.765 6.132 1.00 0.00 C ATOM 122 O SER A 12 -7.164 16.676 6.250 1.00 0.00 O ATOM 123 CB SER A 12 -8.648 16.691 8.619 1.00 0.00 C ATOM 124 OG SER A 12 -9.609 16.785 9.655 1.00 0.00 O ATOM 0 H SER A 12 -8.873 14.324 7.350 1.00 0.00 H new ATOM 0 HA SER A 12 -10.233 16.951 7.191 1.00 0.00 H new ATOM 0 HB2 SER A 12 -7.922 15.915 8.862 1.00 0.00 H new ATOM 0 HB3 SER A 12 -8.098 17.629 8.542 1.00 0.00 H new ATOM 0 HG SER A 12 -9.159 16.987 10.502 1.00 0.00 H new ATOM 130 N ARG A 13 -8.977 17.199 5.023 1.00 0.00 N ATOM 131 CA ARG A 13 -8.204 17.604 3.855 1.00 0.00 C ATOM 132 C ARG A 13 -7.360 16.447 3.332 1.00 0.00 C ATOM 133 O ARG A 13 -7.248 15.406 3.978 1.00 0.00 O ATOM 134 CB ARG A 13 -7.303 18.792 4.201 1.00 0.00 C ATOM 135 CG ARG A 13 -7.152 19.793 3.066 1.00 0.00 C ATOM 136 CD ARG A 13 -7.652 21.173 3.464 1.00 0.00 C ATOM 137 NE ARG A 13 -6.742 22.232 3.032 1.00 0.00 N ATOM 138 CZ ARG A 13 -6.673 22.686 1.783 1.00 0.00 C ATOM 139 NH1 ARG A 13 -7.457 22.179 0.840 1.00 0.00 N ATOM 140 NH2 ARG A 13 -5.816 23.651 1.477 1.00 0.00 N ATOM 0 H ARG A 13 -9.987 17.279 4.909 1.00 0.00 H new ATOM 0 HA ARG A 13 -8.903 17.902 3.074 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -7.709 19.303 5.074 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -6.317 18.420 4.480 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -6.104 19.856 2.773 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -7.706 19.442 2.195 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -8.637 21.341 3.028 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -7.771 21.217 4.547 1.00 0.00 H new ATOM 0 HE ARG A 13 -6.124 22.647 3.729 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -8.118 21.437 1.071 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -7.399 22.532 -0.115 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.211 24.044 2.198 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -5.762 24.000 0.520 1.00 0.00 H new ATOM 154 N ASN A 14 -6.769 16.636 2.157 1.00 0.00 N ATOM 155 CA ASN A 14 -5.935 15.607 1.547 1.00 0.00 C ATOM 156 C ASN A 14 -4.744 15.271 2.439 1.00 0.00 C ATOM 157 O ASN A 14 -3.691 15.900 2.349 1.00 0.00 O ATOM 158 CB ASN A 14 -5.443 16.067 0.172 1.00 0.00 C ATOM 159 CG ASN A 14 -6.360 15.619 -0.949 1.00 0.00 C ATOM 160 OD1 ASN A 14 -6.933 16.442 -1.663 1.00 0.00 O ATOM 161 ND2 ASN A 14 -6.501 14.309 -1.111 1.00 0.00 N ATOM 0 H ASN A 14 -6.852 17.492 1.608 1.00 0.00 H new ATOM 0 HA ASN A 14 -6.541 14.709 1.427 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -5.365 17.154 0.162 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -4.441 15.674 -0.003 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -7.104 13.949 -1.851 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -6.007 13.663 -0.496 1.00 0.00 H new ATOM 168 N GLY A 15 -4.921 14.276 3.302 1.00 0.00 N ATOM 169 CA GLY A 15 -3.854 13.874 4.199 1.00 0.00 C ATOM 170 C GLY A 15 -3.953 12.416 4.603 1.00 0.00 C ATOM 171 O GLY A 15 -2.954 11.697 4.609 1.00 0.00 O ATOM 0 H GLY A 15 -5.784 13.741 3.396 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -2.893 14.049 3.716 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -3.881 14.498 5.092 1.00 0.00 H new ATOM 175 N SER A 16 -5.162 11.978 4.943 1.00 0.00 N ATOM 176 CA SER A 16 -5.389 10.598 5.351 1.00 0.00 C ATOM 177 C SER A 16 -6.243 9.859 4.324 1.00 0.00 C ATOM 178 O SER A 16 -7.470 9.950 4.343 1.00 0.00 O ATOM 179 CB SER A 16 -6.069 10.553 6.721 1.00 0.00 C ATOM 180 OG SER A 16 -5.591 9.465 7.493 1.00 0.00 O ATOM 0 H SER A 16 -5.999 12.561 4.944 1.00 0.00 H new ATOM 0 HA SER A 16 -4.420 10.103 5.417 1.00 0.00 H new ATOM 0 HB2 SER A 16 -5.886 11.487 7.252 1.00 0.00 H new ATOM 0 HB3 SER A 16 -7.148 10.465 6.592 1.00 0.00 H new ATOM 0 HG SER A 16 -6.040 9.460 8.364 1.00 0.00 H new ATOM 186 N PHE A 17 -5.584 9.130 3.429 1.00 0.00 N ATOM 187 CA PHE A 17 -6.283 8.376 2.395 1.00 0.00 C ATOM 188 C PHE A 17 -6.761 7.031 2.931 1.00 0.00 C ATOM 189 O PHE A 17 -7.789 6.510 2.498 1.00 0.00 O ATOM 190 CB PHE A 17 -5.370 8.161 1.187 1.00 0.00 C ATOM 191 CG PHE A 17 -4.842 9.438 0.597 1.00 0.00 C ATOM 192 CD1 PHE A 17 -3.664 9.998 1.064 1.00 0.00 C ATOM 193 CD2 PHE A 17 -5.525 10.078 -0.425 1.00 0.00 C ATOM 194 CE1 PHE A 17 -3.176 11.173 0.523 1.00 0.00 C ATOM 195 CE2 PHE A 17 -5.042 11.253 -0.969 1.00 0.00 C ATOM 196 CZ PHE A 17 -3.866 11.801 -0.495 1.00 0.00 C ATOM 0 H PHE A 17 -4.568 9.046 3.399 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.154 8.953 2.086 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.530 7.533 1.484 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.919 7.616 0.419 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -3.120 9.511 1.860 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.445 9.654 -0.800 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -2.256 11.599 0.896 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.584 11.743 -1.765 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.487 12.719 -0.920 1.00 0.00 H new ATOM 206 N ILE A 18 -6.009 6.473 3.875 1.00 0.00 N ATOM 207 CA ILE A 18 -6.357 5.188 4.469 1.00 0.00 C ATOM 208 C ILE A 18 -6.366 5.273 5.992 1.00 0.00 C ATOM 209 O ILE A 18 -5.420 5.771 6.601 1.00 0.00 O ATOM 210 CB ILE A 18 -5.376 4.083 4.033 1.00 0.00 C ATOM 211 CG1 ILE A 18 -5.201 4.096 2.513 1.00 0.00 C ATOM 212 CG2 ILE A 18 -5.866 2.723 4.503 1.00 0.00 C ATOM 213 CD1 ILE A 18 -4.240 3.044 2.006 1.00 0.00 C ATOM 0 H ILE A 18 -5.155 6.891 4.244 1.00 0.00 H new ATOM 0 HA ILE A 18 -7.356 4.935 4.115 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.407 4.277 4.493 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -6.173 3.946 2.042 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.846 5.079 2.205 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.162 1.953 4.187 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.943 2.720 5.590 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.845 2.519 4.069 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -4.165 3.112 0.921 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.257 3.206 2.448 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.604 2.055 2.283 1.00 0.00 H new ATOM 225 N THR A 19 -7.441 4.782 6.601 1.00 0.00 N ATOM 226 CA THR A 19 -7.573 4.803 8.052 1.00 0.00 C ATOM 227 C THR A 19 -6.814 3.639 8.684 1.00 0.00 C ATOM 228 O THR A 19 -6.546 2.633 8.030 1.00 0.00 O ATOM 229 CB THR A 19 -9.048 4.742 8.453 1.00 0.00 C ATOM 230 OG1 THR A 19 -9.870 5.253 7.418 1.00 0.00 O ATOM 231 CG2 THR A 19 -9.359 5.520 9.713 1.00 0.00 C ATOM 0 H THR A 19 -8.233 4.365 6.111 1.00 0.00 H new ATOM 0 HA THR A 19 -7.143 5.736 8.417 1.00 0.00 H new ATOM 0 HB THR A 19 -9.254 3.688 8.637 1.00 0.00 H new ATOM 0 HG1 THR A 19 -10.810 5.204 7.692 1.00 0.00 H new ATOM 0 HG21 THR A 19 -10.422 5.435 9.940 1.00 0.00 H new ATOM 0 HG22 THR A 19 -8.777 5.117 10.542 1.00 0.00 H new ATOM 0 HG23 THR A 19 -9.103 6.569 9.565 1.00 0.00 H new ATOM 239 N LYS A 20 -6.473 3.787 9.960 1.00 0.00 N ATOM 240 CA LYS A 20 -5.745 2.749 10.681 1.00 0.00 C ATOM 241 C LYS A 20 -6.592 1.488 10.820 1.00 0.00 C ATOM 242 O LYS A 20 -6.098 0.374 10.645 1.00 0.00 O ATOM 243 CB LYS A 20 -5.330 3.255 12.063 1.00 0.00 C ATOM 244 CG LYS A 20 -4.006 2.683 12.548 1.00 0.00 C ATOM 245 CD LYS A 20 -3.063 3.779 13.021 1.00 0.00 C ATOM 246 CE LYS A 20 -2.008 4.097 11.974 1.00 0.00 C ATOM 247 NZ LYS A 20 -1.711 5.554 11.907 1.00 0.00 N ATOM 0 H LYS A 20 -6.689 4.615 10.516 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.850 2.502 10.109 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.259 4.342 12.036 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.110 3.004 12.782 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.188 1.982 13.363 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -3.535 2.120 11.742 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -3.634 4.679 13.248 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -2.577 3.468 13.946 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -1.093 3.551 12.203 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -2.350 3.751 10.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.987 5.728 11.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -2.578 6.074 11.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.360 5.880 12.830 1.00 0.00 H new ATOM 261 N GLU A 21 -7.869 1.671 11.137 1.00 0.00 N ATOM 262 CA GLU A 21 -8.786 0.549 11.301 1.00 0.00 C ATOM 263 C GLU A 21 -8.909 -0.245 10.003 1.00 0.00 C ATOM 264 O GLU A 21 -9.124 -1.457 10.024 1.00 0.00 O ATOM 265 CB GLU A 21 -10.162 1.050 11.742 1.00 0.00 C ATOM 266 CG GLU A 21 -10.445 0.828 13.219 1.00 0.00 C ATOM 267 CD GLU A 21 -11.272 -0.418 13.473 1.00 0.00 C ATOM 268 OE1 GLU A 21 -10.816 -1.519 13.102 1.00 0.00 O ATOM 269 OE2 GLU A 21 -12.377 -0.290 14.043 1.00 0.00 O ATOM 0 H GLU A 21 -8.293 2.587 11.286 1.00 0.00 H new ATOM 0 HA GLU A 21 -8.385 -0.110 12.071 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.240 2.115 11.522 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.929 0.546 11.154 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.501 0.749 13.758 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.969 1.696 13.619 1.00 0.00 H new ATOM 276 N LYS A 22 -8.773 0.447 8.876 1.00 0.00 N ATOM 277 CA LYS A 22 -8.871 -0.192 7.570 1.00 0.00 C ATOM 278 C LYS A 22 -7.660 -1.084 7.305 1.00 0.00 C ATOM 279 O LYS A 22 -7.754 -2.073 6.579 1.00 0.00 O ATOM 280 CB LYS A 22 -8.993 0.866 6.470 1.00 0.00 C ATOM 281 CG LYS A 22 -10.119 0.593 5.486 1.00 0.00 C ATOM 282 CD LYS A 22 -10.682 1.884 4.912 1.00 0.00 C ATOM 283 CE LYS A 22 -12.046 1.664 4.281 1.00 0.00 C ATOM 284 NZ LYS A 22 -13.101 1.425 5.304 1.00 0.00 N ATOM 0 H LYS A 22 -8.595 1.451 8.842 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.764 -0.816 7.565 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -9.153 1.841 6.931 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -8.051 0.922 5.925 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.751 -0.037 4.676 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.914 0.038 5.985 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.762 2.631 5.702 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.994 2.282 4.166 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -12.313 2.534 3.681 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.999 0.812 3.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -14.039 1.532 4.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.004 0.462 5.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.998 2.114 6.076 1.00 0.00 H new ATOM 298 N LYS A 23 -6.524 -0.724 7.895 1.00 0.00 N ATOM 299 CA LYS A 23 -5.296 -1.489 7.720 1.00 0.00 C ATOM 300 C LYS A 23 -5.262 -2.694 8.656 1.00 0.00 C ATOM 301 O LYS A 23 -4.749 -3.755 8.300 1.00 0.00 O ATOM 302 CB LYS A 23 -4.077 -0.600 7.973 1.00 0.00 C ATOM 303 CG LYS A 23 -3.872 0.468 6.911 1.00 0.00 C ATOM 304 CD LYS A 23 -3.380 1.771 7.518 1.00 0.00 C ATOM 305 CE LYS A 23 -1.905 1.697 7.878 1.00 0.00 C ATOM 306 NZ LYS A 23 -1.319 3.047 8.105 1.00 0.00 N ATOM 0 H LYS A 23 -6.429 0.093 8.498 1.00 0.00 H new ATOM 0 HA LYS A 23 -5.269 -1.851 6.692 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -4.184 -0.118 8.945 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -3.186 -1.226 8.024 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -3.152 0.115 6.173 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -4.810 0.643 6.384 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -3.543 2.586 6.813 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -3.962 2.000 8.410 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -1.781 1.092 8.776 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -1.361 1.195 7.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -0.312 2.952 8.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -1.414 3.617 7.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -1.821 3.516 8.886 1.00 0.00 H new ATOM 320 N ASP A 24 -5.809 -2.522 9.855 1.00 0.00 N ATOM 321 CA ASP A 24 -5.838 -3.595 10.843 1.00 0.00 C ATOM 322 C ASP A 24 -6.689 -4.765 10.357 1.00 0.00 C ATOM 323 O ASP A 24 -6.308 -5.926 10.509 1.00 0.00 O ATOM 324 CB ASP A 24 -6.381 -3.072 12.175 1.00 0.00 C ATOM 325 CG ASP A 24 -5.543 -3.523 13.356 1.00 0.00 C ATOM 326 OD1 ASP A 24 -4.299 -3.533 13.233 1.00 0.00 O ATOM 327 OD2 ASP A 24 -6.130 -3.864 14.405 1.00 0.00 O ATOM 0 H ASP A 24 -6.238 -1.650 10.166 1.00 0.00 H new ATOM 0 HA ASP A 24 -4.818 -3.950 10.986 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -6.412 -1.983 12.149 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -7.406 -3.417 12.307 1.00 0.00 H new ATOM 332 N THR A 25 -7.841 -4.453 9.774 1.00 0.00 N ATOM 333 CA THR A 25 -8.745 -5.481 9.268 1.00 0.00 C ATOM 334 C THR A 25 -8.062 -6.339 8.209 1.00 0.00 C ATOM 335 O THR A 25 -8.378 -7.518 8.053 1.00 0.00 O ATOM 336 CB THR A 25 -10.006 -4.838 8.687 1.00 0.00 C ATOM 337 OG1 THR A 25 -10.373 -3.691 9.431 1.00 0.00 O ATOM 338 CG2 THR A 25 -11.197 -5.771 8.665 1.00 0.00 C ATOM 0 H THR A 25 -8.171 -3.497 9.640 1.00 0.00 H new ATOM 0 HA THR A 25 -9.024 -6.125 10.102 1.00 0.00 H new ATOM 0 HB THR A 25 -9.750 -4.577 7.660 1.00 0.00 H new ATOM 0 HG1 THR A 25 -9.848 -2.922 9.126 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.057 -5.253 8.241 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.964 -6.645 8.056 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.429 -6.089 9.682 1.00 0.00 H new ATOM 346 N VAL A 26 -7.124 -5.741 7.481 1.00 0.00 N ATOM 347 CA VAL A 26 -6.398 -6.452 6.436 1.00 0.00 C ATOM 348 C VAL A 26 -5.591 -7.610 7.013 1.00 0.00 C ATOM 349 O VAL A 26 -5.880 -8.776 6.743 1.00 0.00 O ATOM 350 CB VAL A 26 -5.448 -5.511 5.671 1.00 0.00 C ATOM 351 CG1 VAL A 26 -4.852 -6.218 4.463 1.00 0.00 C ATOM 352 CG2 VAL A 26 -6.176 -4.244 5.251 1.00 0.00 C ATOM 0 H VAL A 26 -6.849 -4.765 7.596 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.145 -6.843 5.745 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.632 -5.230 6.336 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -4.184 -5.537 3.936 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.292 -7.093 4.793 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.653 -6.532 3.793 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.489 -3.591 4.712 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.014 -4.503 4.604 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.548 -3.728 6.136 1.00 0.00 H new ATOM 362 N LEU A 27 -4.578 -7.280 7.808 1.00 0.00 N ATOM 363 CA LEU A 27 -3.727 -8.292 8.423 1.00 0.00 C ATOM 364 C LEU A 27 -4.545 -9.250 9.284 1.00 0.00 C ATOM 365 O LEU A 27 -4.177 -10.412 9.457 1.00 0.00 O ATOM 366 CB LEU A 27 -2.642 -7.628 9.274 1.00 0.00 C ATOM 367 CG LEU A 27 -1.818 -6.559 8.552 1.00 0.00 C ATOM 368 CD1 LEU A 27 -0.862 -5.879 9.520 1.00 0.00 C ATOM 369 CD2 LEU A 27 -1.054 -7.173 7.389 1.00 0.00 C ATOM 0 H LEU A 27 -4.327 -6.319 8.041 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.257 -8.864 7.623 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.112 -7.175 10.147 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -1.966 -8.400 9.641 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.500 -5.806 8.157 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.284 -5.122 8.989 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.430 -5.406 10.321 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.185 -6.621 9.944 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.473 -6.400 6.886 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.382 -7.946 7.762 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.758 -7.614 6.684 1.00 0.00 H new ATOM 381 N ARG A 28 -5.656 -8.756 9.823 1.00 0.00 N ATOM 382 CA ARG A 28 -6.524 -9.570 10.668 1.00 0.00 C ATOM 383 C ARG A 28 -7.030 -10.795 9.911 1.00 0.00 C ATOM 384 O ARG A 28 -6.982 -11.915 10.421 1.00 0.00 O ATOM 385 CB ARG A 28 -7.707 -8.741 11.168 1.00 0.00 C ATOM 386 CG ARG A 28 -8.404 -9.342 12.377 1.00 0.00 C ATOM 387 CD ARG A 28 -9.830 -8.834 12.510 1.00 0.00 C ATOM 388 NE ARG A 28 -10.769 -9.912 12.814 1.00 0.00 N ATOM 389 CZ ARG A 28 -11.067 -10.895 11.967 1.00 0.00 C ATOM 390 NH1 ARG A 28 -10.504 -10.940 10.766 1.00 0.00 N ATOM 391 NH2 ARG A 28 -11.931 -11.836 12.323 1.00 0.00 N ATOM 0 H ARG A 28 -5.976 -7.797 9.690 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.940 -9.910 11.523 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -7.357 -7.740 11.421 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -8.430 -8.631 10.360 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.411 -10.429 12.291 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -7.844 -9.097 13.280 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -9.875 -8.081 13.297 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -10.128 -8.344 11.583 1.00 0.00 H new ATOM 0 HE ARG A 28 -11.222 -9.911 13.728 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -9.839 -10.219 10.487 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -10.737 -11.696 10.122 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -12.366 -11.806 13.245 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -12.160 -12.590 11.675 1.00 0.00 H new ATOM 405 N GLN A 29 -7.516 -10.574 8.694 1.00 0.00 N ATOM 406 CA GLN A 29 -8.033 -11.660 7.870 1.00 0.00 C ATOM 407 C GLN A 29 -6.917 -12.617 7.464 1.00 0.00 C ATOM 408 O GLN A 29 -7.119 -13.829 7.392 1.00 0.00 O ATOM 409 CB GLN A 29 -8.720 -11.099 6.623 1.00 0.00 C ATOM 410 CG GLN A 29 -10.034 -10.394 6.918 1.00 0.00 C ATOM 411 CD GLN A 29 -10.542 -9.592 5.736 1.00 0.00 C ATOM 412 OE1 GLN A 29 -10.111 -8.462 5.505 1.00 0.00 O ATOM 413 NE2 GLN A 29 -11.465 -10.174 4.979 1.00 0.00 N ATOM 0 H GLN A 29 -7.563 -9.654 8.257 1.00 0.00 H new ATOM 0 HA GLN A 29 -8.763 -12.214 8.461 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.045 -10.400 6.130 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.903 -11.913 5.922 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -10.784 -11.133 7.200 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -9.903 -9.731 7.773 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -11.794 -11.112 5.207 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -11.845 -9.683 4.170 1.00 0.00 H new ATOM 422 N VAL A 30 -5.737 -12.063 7.199 1.00 0.00 N ATOM 423 CA VAL A 30 -4.588 -12.868 6.800 1.00 0.00 C ATOM 424 C VAL A 30 -4.020 -13.641 7.985 1.00 0.00 C ATOM 425 O VAL A 30 -3.652 -14.809 7.859 1.00 0.00 O ATOM 426 CB VAL A 30 -3.474 -11.995 6.192 1.00 0.00 C ATOM 427 CG1 VAL A 30 -2.376 -12.865 5.600 1.00 0.00 C ATOM 428 CG2 VAL A 30 -4.046 -11.057 5.139 1.00 0.00 C ATOM 0 H VAL A 30 -5.552 -11.061 7.253 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.942 -13.571 6.046 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.037 -11.390 6.987 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.598 -12.230 5.175 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.947 -13.491 6.382 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.795 -13.498 4.818 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.245 -10.448 4.720 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.510 -11.642 4.345 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.793 -10.409 5.597 1.00 0.00 H new ATOM 438 N ARG A 31 -3.951 -12.982 9.138 1.00 0.00 N ATOM 439 CA ARG A 31 -3.428 -13.607 10.346 1.00 0.00 C ATOM 440 C ARG A 31 -4.245 -14.838 10.723 1.00 0.00 C ATOM 441 O ARG A 31 -3.692 -15.889 11.047 1.00 0.00 O ATOM 442 CB ARG A 31 -3.430 -12.607 11.504 1.00 0.00 C ATOM 443 CG ARG A 31 -2.212 -11.695 11.524 1.00 0.00 C ATOM 444 CD ARG A 31 -2.347 -10.607 12.577 1.00 0.00 C ATOM 445 NE ARG A 31 -1.124 -10.447 13.359 1.00 0.00 N ATOM 446 CZ ARG A 31 -0.946 -9.495 14.272 1.00 0.00 C ATOM 447 NH1 ARG A 31 -1.909 -8.615 14.518 1.00 0.00 N ATOM 448 NH2 ARG A 31 0.197 -9.421 14.939 1.00 0.00 N ATOM 0 H ARG A 31 -4.251 -12.015 9.260 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.404 -13.922 10.146 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.330 -11.996 11.443 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.479 -13.154 12.445 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.317 -12.285 11.722 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.082 -11.239 10.543 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.594 -9.662 12.092 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.175 -10.849 13.244 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.361 -11.104 13.196 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.790 -8.667 14.006 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -1.768 -7.887 15.219 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.941 -10.094 14.753 1.00 0.00 H new ATOM 0 HH22 ARG A 31 0.333 -8.691 15.639 1.00 0.00 H new ATOM 462 N LEU A 32 -5.567 -14.700 10.679 1.00 0.00 N ATOM 463 CA LEU A 32 -6.462 -15.801 11.018 1.00 0.00 C ATOM 464 C LEU A 32 -6.407 -16.896 9.957 1.00 0.00 C ATOM 465 O LEU A 32 -6.464 -18.083 10.276 1.00 0.00 O ATOM 466 CB LEU A 32 -7.896 -15.290 11.166 1.00 0.00 C ATOM 467 CG LEU A 32 -8.204 -14.606 12.500 1.00 0.00 C ATOM 468 CD1 LEU A 32 -9.190 -13.465 12.300 1.00 0.00 C ATOM 469 CD2 LEU A 32 -8.748 -15.612 13.502 1.00 0.00 C ATOM 0 H LEU A 32 -6.041 -13.837 10.412 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.133 -16.225 11.967 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.100 -14.587 10.359 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.580 -16.129 11.039 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.277 -14.193 12.897 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.397 -12.991 13.259 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.763 -12.731 11.617 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.117 -13.855 11.880 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.961 -15.108 14.445 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.664 -16.055 13.112 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -8.009 -16.395 13.669 1.00 0.00 H new ATOM 481 N ASP A 33 -6.295 -16.489 8.696 1.00 0.00 N ATOM 482 CA ASP A 33 -6.233 -17.438 7.592 1.00 0.00 C ATOM 483 C ASP A 33 -5.416 -16.874 6.432 1.00 0.00 C ATOM 484 O ASP A 33 -5.972 -16.342 5.471 1.00 0.00 O ATOM 485 CB ASP A 33 -7.642 -17.790 7.114 1.00 0.00 C ATOM 486 CG ASP A 33 -7.764 -19.239 6.684 1.00 0.00 C ATOM 487 OD1 ASP A 33 -7.155 -19.606 5.656 1.00 0.00 O ATOM 488 OD2 ASP A 33 -8.465 -20.007 7.375 1.00 0.00 O ATOM 0 H ASP A 33 -6.245 -15.510 8.415 1.00 0.00 H new ATOM 0 HA ASP A 33 -5.742 -18.342 7.952 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -8.354 -17.591 7.915 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -7.911 -17.143 6.279 1.00 0.00 H new ATOM 493 N PRO A 34 -4.078 -16.982 6.508 1.00 0.00 N ATOM 494 CA PRO A 34 -3.184 -16.480 5.458 1.00 0.00 C ATOM 495 C PRO A 34 -3.535 -17.038 4.082 1.00 0.00 C ATOM 496 O PRO A 34 -4.545 -17.723 3.919 1.00 0.00 O ATOM 497 CB PRO A 34 -1.802 -16.973 5.896 1.00 0.00 C ATOM 498 CG PRO A 34 -1.916 -17.169 7.368 1.00 0.00 C ATOM 499 CD PRO A 34 -3.333 -17.603 7.618 1.00 0.00 C ATOM 0 HA PRO A 34 -3.251 -15.397 5.353 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -1.536 -17.903 5.393 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -1.027 -16.246 5.653 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -1.210 -17.922 7.717 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -1.690 -16.247 7.903 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -3.429 -18.689 7.609 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -3.694 -17.259 8.587 1.00 0.00 H new ATOM 507 N CYS A 35 -2.695 -16.739 3.097 1.00 0.00 N ATOM 508 CA CYS A 35 -2.916 -17.211 1.734 1.00 0.00 C ATOM 509 C CYS A 35 -1.766 -16.795 0.822 1.00 0.00 C ATOM 510 O CYS A 35 -0.996 -17.633 0.355 1.00 0.00 O ATOM 511 CB CYS A 35 -4.237 -16.665 1.191 1.00 0.00 C ATOM 512 SG CYS A 35 -4.722 -17.364 -0.405 1.00 0.00 S ATOM 0 H CYS A 35 -1.855 -16.172 3.216 1.00 0.00 H new ATOM 0 HA CYS A 35 -2.963 -18.300 1.756 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -5.026 -16.862 1.917 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.158 -15.582 1.093 1.00 0.00 H new ATOM 0 HG CYS A 35 -5.852 -16.843 -0.781 1.00 0.00 H new ATOM 518 N ASP A 36 -1.657 -15.493 0.572 1.00 0.00 N ATOM 519 CA ASP A 36 -0.601 -14.965 -0.283 1.00 0.00 C ATOM 520 C ASP A 36 -0.659 -13.442 -0.341 1.00 0.00 C ATOM 521 O ASP A 36 -1.737 -12.851 -0.320 1.00 0.00 O ATOM 522 CB ASP A 36 -0.721 -15.545 -1.694 1.00 0.00 C ATOM 523 CG ASP A 36 0.632 -15.798 -2.332 1.00 0.00 C ATOM 524 OD1 ASP A 36 1.561 -16.213 -1.609 1.00 0.00 O ATOM 525 OD2 ASP A 36 0.761 -15.579 -3.555 1.00 0.00 O ATOM 0 H ASP A 36 -2.287 -14.785 0.950 1.00 0.00 H new ATOM 0 HA ASP A 36 0.358 -15.259 0.143 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -1.281 -16.479 -1.653 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -1.292 -14.858 -2.319 1.00 0.00 H new ATOM 530 N LEU A 37 0.510 -12.814 -0.415 1.00 0.00 N ATOM 531 CA LEU A 37 0.592 -11.359 -0.475 1.00 0.00 C ATOM 532 C LEU A 37 1.721 -10.914 -1.399 1.00 0.00 C ATOM 533 O LEU A 37 2.438 -9.959 -1.104 1.00 0.00 O ATOM 534 CB LEU A 37 0.807 -10.781 0.925 1.00 0.00 C ATOM 535 CG LEU A 37 -0.352 -10.994 1.900 1.00 0.00 C ATOM 536 CD1 LEU A 37 0.109 -10.773 3.332 1.00 0.00 C ATOM 537 CD2 LEU A 37 -1.509 -10.068 1.561 1.00 0.00 C ATOM 0 H LEU A 37 1.412 -13.289 -0.435 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.350 -10.984 -0.875 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.706 -11.226 1.351 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.993 -9.711 0.835 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.697 -12.024 1.806 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.729 -10.929 4.012 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.906 -11.477 3.571 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.481 -9.754 3.441 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.325 -10.233 2.265 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.177 -9.032 1.627 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.856 -10.275 0.548 1.00 0.00 H new ATOM 549 N GLN A 38 1.877 -11.616 -2.517 1.00 0.00 N ATOM 550 CA GLN A 38 2.923 -11.291 -3.481 1.00 0.00 C ATOM 551 C GLN A 38 2.381 -10.419 -4.614 1.00 0.00 C ATOM 552 O GLN A 38 2.906 -9.338 -4.876 1.00 0.00 O ATOM 553 CB GLN A 38 3.539 -12.573 -4.049 1.00 0.00 C ATOM 554 CG GLN A 38 5.031 -12.700 -3.784 1.00 0.00 C ATOM 555 CD GLN A 38 5.844 -11.643 -4.506 1.00 0.00 C ATOM 556 OE1 GLN A 38 6.241 -11.827 -5.656 1.00 0.00 O ATOM 557 NE2 GLN A 38 6.095 -10.528 -3.831 1.00 0.00 N ATOM 0 H GLN A 38 1.294 -12.412 -2.778 1.00 0.00 H new ATOM 0 HA GLN A 38 3.696 -10.726 -2.960 1.00 0.00 H new ATOM 0 HB2 GLN A 38 3.027 -13.434 -3.619 1.00 0.00 H new ATOM 0 HB3 GLN A 38 3.365 -12.604 -5.125 1.00 0.00 H new ATOM 0 HG2 GLN A 38 5.214 -12.624 -2.712 1.00 0.00 H new ATOM 0 HG3 GLN A 38 5.369 -13.688 -4.096 1.00 0.00 H new ATOM 0 HE21 GLN A 38 5.746 -10.419 -2.879 1.00 0.00 H new ATOM 0 HE22 GLN A 38 6.637 -9.781 -4.264 1.00 0.00 H new ATOM 566 N PRO A 39 1.321 -10.876 -5.305 1.00 0.00 N ATOM 567 CA PRO A 39 0.720 -10.122 -6.413 1.00 0.00 C ATOM 568 C PRO A 39 0.375 -8.690 -6.021 1.00 0.00 C ATOM 569 O PRO A 39 0.624 -7.752 -6.778 1.00 0.00 O ATOM 570 CB PRO A 39 -0.553 -10.910 -6.732 1.00 0.00 C ATOM 571 CG PRO A 39 -0.263 -12.297 -6.272 1.00 0.00 C ATOM 572 CD PRO A 39 0.625 -12.156 -5.068 1.00 0.00 C ATOM 0 HA PRO A 39 1.402 -10.029 -7.258 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -1.417 -10.493 -6.214 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -0.778 -10.885 -7.798 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -1.183 -12.825 -6.019 1.00 0.00 H new ATOM 0 HG3 PRO A 39 0.230 -12.873 -7.055 1.00 0.00 H new ATOM 0 HD2 PRO A 39 0.048 -12.135 -4.143 1.00 0.00 H new ATOM 0 HD3 PRO A 39 1.327 -12.986 -4.987 1.00 0.00 H new ATOM 580 N ILE A 40 -0.199 -8.529 -4.834 1.00 0.00 N ATOM 581 CA ILE A 40 -0.579 -7.210 -4.341 1.00 0.00 C ATOM 582 C ILE A 40 0.632 -6.287 -4.243 1.00 0.00 C ATOM 583 O ILE A 40 0.502 -5.066 -4.325 1.00 0.00 O ATOM 584 CB ILE A 40 -1.258 -7.300 -2.960 1.00 0.00 C ATOM 585 CG1 ILE A 40 -2.388 -8.331 -2.984 1.00 0.00 C ATOM 586 CG2 ILE A 40 -1.787 -5.936 -2.539 1.00 0.00 C ATOM 587 CD1 ILE A 40 -2.402 -9.240 -1.774 1.00 0.00 C ATOM 0 H ILE A 40 -0.411 -9.295 -4.195 1.00 0.00 H new ATOM 0 HA ILE A 40 -1.287 -6.797 -5.059 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.516 -7.622 -2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.343 -7.810 -3.048 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.295 -8.939 -3.884 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.264 -6.016 -1.562 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.961 -5.227 -2.483 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.516 -5.587 -3.270 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.229 -9.945 -1.858 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.462 -9.788 -1.720 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.526 -8.642 -0.871 1.00 0.00 H new ATOM 599 N PHE A 41 1.810 -6.878 -4.066 1.00 0.00 N ATOM 600 CA PHE A 41 3.043 -6.106 -3.956 1.00 0.00 C ATOM 601 C PHE A 41 3.674 -5.885 -5.326 1.00 0.00 C ATOM 602 O PHE A 41 4.023 -4.761 -5.685 1.00 0.00 O ATOM 603 CB PHE A 41 4.035 -6.819 -3.035 1.00 0.00 C ATOM 604 CG PHE A 41 3.928 -6.398 -1.597 1.00 0.00 C ATOM 605 CD1 PHE A 41 2.997 -6.988 -0.758 1.00 0.00 C ATOM 606 CD2 PHE A 41 4.759 -5.415 -1.085 1.00 0.00 C ATOM 607 CE1 PHE A 41 2.897 -6.603 0.566 1.00 0.00 C ATOM 608 CE2 PHE A 41 4.663 -5.026 0.237 1.00 0.00 C ATOM 609 CZ PHE A 41 3.731 -5.622 1.064 1.00 0.00 C ATOM 0 H PHE A 41 1.937 -7.888 -3.996 1.00 0.00 H new ATOM 0 HA PHE A 41 2.795 -5.134 -3.530 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.873 -7.895 -3.103 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.048 -6.626 -3.387 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.343 -7.757 -1.142 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.491 -4.947 -1.727 1.00 0.00 H new ATOM 0 HE1 PHE A 41 2.167 -7.070 1.211 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.316 -4.257 0.623 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.655 -5.321 2.098 1.00 0.00 H new ATOM 619 N ASP A 42 3.822 -6.964 -6.086 1.00 0.00 N ATOM 620 CA ASP A 42 4.417 -6.890 -7.417 1.00 0.00 C ATOM 621 C ASP A 42 3.688 -5.876 -8.297 1.00 0.00 C ATOM 622 O ASP A 42 4.253 -5.360 -9.262 1.00 0.00 O ATOM 623 CB ASP A 42 4.395 -8.266 -8.084 1.00 0.00 C ATOM 624 CG ASP A 42 5.587 -8.487 -8.995 1.00 0.00 C ATOM 625 OD1 ASP A 42 6.629 -8.966 -8.502 1.00 0.00 O ATOM 626 OD2 ASP A 42 5.477 -8.181 -10.201 1.00 0.00 O ATOM 0 H ASP A 42 3.538 -7.902 -5.804 1.00 0.00 H new ATOM 0 HA ASP A 42 5.450 -6.561 -7.302 1.00 0.00 H new ATOM 0 HB2 ASP A 42 4.381 -9.039 -7.316 1.00 0.00 H new ATOM 0 HB3 ASP A 42 3.476 -8.372 -8.661 1.00 0.00 H new ATOM 631 N ASP A 43 2.431 -5.597 -7.964 1.00 0.00 N ATOM 632 CA ASP A 43 1.630 -4.649 -8.731 1.00 0.00 C ATOM 633 C ASP A 43 1.700 -3.246 -8.127 1.00 0.00 C ATOM 634 O ASP A 43 1.464 -2.254 -8.817 1.00 0.00 O ATOM 635 CB ASP A 43 0.176 -5.119 -8.798 1.00 0.00 C ATOM 636 CG ASP A 43 -0.367 -5.119 -10.213 1.00 0.00 C ATOM 637 OD1 ASP A 43 -0.357 -4.045 -10.852 1.00 0.00 O ATOM 638 OD2 ASP A 43 -0.802 -6.191 -10.682 1.00 0.00 O ATOM 0 H ASP A 43 1.946 -6.013 -7.169 1.00 0.00 H new ATOM 0 HA ASP A 43 2.039 -4.604 -9.740 1.00 0.00 H new ATOM 0 HB2 ASP A 43 0.103 -6.125 -8.384 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.441 -4.472 -8.175 1.00 0.00 H new ATOM 643 N MET A 44 2.019 -3.169 -6.839 1.00 0.00 N ATOM 644 CA MET A 44 2.110 -1.885 -6.150 1.00 0.00 C ATOM 645 C MET A 44 3.554 -1.393 -6.078 1.00 0.00 C ATOM 646 O MET A 44 3.803 -0.202 -5.885 1.00 0.00 O ATOM 647 CB MET A 44 1.528 -1.999 -4.740 1.00 0.00 C ATOM 648 CG MET A 44 0.020 -2.184 -4.719 1.00 0.00 C ATOM 649 SD MET A 44 -0.863 -0.786 -5.437 1.00 0.00 S ATOM 650 CE MET A 44 -0.254 0.557 -4.421 1.00 0.00 C ATOM 0 H MET A 44 2.219 -3.979 -6.251 1.00 0.00 H new ATOM 0 HA MET A 44 1.532 -1.159 -6.721 1.00 0.00 H new ATOM 0 HB2 MET A 44 1.996 -2.840 -4.229 1.00 0.00 H new ATOM 0 HB3 MET A 44 1.784 -1.102 -4.176 1.00 0.00 H new ATOM 0 HG2 MET A 44 -0.238 -3.091 -5.266 1.00 0.00 H new ATOM 0 HG3 MET A 44 -0.310 -2.327 -3.690 1.00 0.00 H new ATOM 0 HE1 MET A 44 -0.940 1.402 -4.486 1.00 0.00 H new ATOM 0 HE2 MET A 44 -0.183 0.226 -3.385 1.00 0.00 H new ATOM 0 HE3 MET A 44 0.732 0.862 -4.773 1.00 0.00 H new ATOM 660 N LEU A 45 4.504 -2.312 -6.230 1.00 0.00 N ATOM 661 CA LEU A 45 5.920 -1.965 -6.177 1.00 0.00 C ATOM 662 C LEU A 45 6.258 -0.869 -7.185 1.00 0.00 C ATOM 663 O LEU A 45 7.173 -0.075 -6.969 1.00 0.00 O ATOM 664 CB LEU A 45 6.779 -3.203 -6.447 1.00 0.00 C ATOM 665 CG LEU A 45 6.992 -4.119 -5.241 1.00 0.00 C ATOM 666 CD1 LEU A 45 7.653 -5.420 -5.670 1.00 0.00 C ATOM 667 CD2 LEU A 45 7.828 -3.418 -4.180 1.00 0.00 C ATOM 0 H LEU A 45 4.318 -3.302 -6.391 1.00 0.00 H new ATOM 0 HA LEU A 45 6.136 -1.588 -5.177 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.315 -3.781 -7.246 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.753 -2.878 -6.813 1.00 0.00 H new ATOM 0 HG LEU A 45 6.019 -4.354 -4.811 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.797 -6.059 -4.799 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.017 -5.930 -6.394 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.620 -5.204 -6.125 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.969 -4.085 -3.329 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.799 -3.153 -4.598 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.315 -2.514 -3.851 1.00 0.00 H new ATOM 679 N HIS A 46 5.514 -0.834 -8.286 1.00 0.00 N ATOM 680 CA HIS A 46 5.736 0.165 -9.325 1.00 0.00 C ATOM 681 C HIS A 46 5.308 1.551 -8.853 1.00 0.00 C ATOM 682 O HIS A 46 5.868 2.561 -9.276 1.00 0.00 O ATOM 683 CB HIS A 46 4.971 -0.213 -10.595 1.00 0.00 C ATOM 684 CG HIS A 46 5.614 0.285 -11.852 1.00 0.00 C ATOM 685 ND1 HIS A 46 4.970 1.064 -12.788 1.00 0.00 N ATOM 686 CD2 HIS A 46 6.874 0.101 -12.321 1.00 0.00 C ATOM 687 CE1 HIS A 46 5.839 1.323 -13.775 1.00 0.00 C ATOM 688 NE2 HIS A 46 7.009 0.762 -13.539 1.00 0.00 N ATOM 0 H HIS A 46 4.753 -1.485 -8.481 1.00 0.00 H new ATOM 0 HA HIS A 46 6.803 0.192 -9.544 1.00 0.00 H new ATOM 0 HB2 HIS A 46 4.883 -1.298 -10.647 1.00 0.00 H new ATOM 0 HB3 HIS A 46 3.959 0.186 -10.532 1.00 0.00 H new ATOM 0 HD2 HIS A 46 7.649 -0.468 -11.828 1.00 0.00 H new ATOM 0 HE1 HIS A 46 5.611 1.914 -14.650 1.00 0.00 H new ATOM 0 HE2 HIS A 46 7.841 0.804 -14.127 1.00 0.00 H new ATOM 696 N PHE A 47 4.310 1.590 -7.975 1.00 0.00 N ATOM 697 CA PHE A 47 3.807 2.853 -7.448 1.00 0.00 C ATOM 698 C PHE A 47 4.783 3.452 -6.440 1.00 0.00 C ATOM 699 O PHE A 47 4.882 4.671 -6.305 1.00 0.00 O ATOM 700 CB PHE A 47 2.440 2.647 -6.791 1.00 0.00 C ATOM 701 CG PHE A 47 1.345 2.337 -7.771 1.00 0.00 C ATOM 702 CD1 PHE A 47 1.231 1.073 -8.326 1.00 0.00 C ATOM 703 CD2 PHE A 47 0.430 3.311 -8.138 1.00 0.00 C ATOM 704 CE1 PHE A 47 0.225 0.784 -9.228 1.00 0.00 C ATOM 705 CE2 PHE A 47 -0.578 3.029 -9.040 1.00 0.00 C ATOM 706 CZ PHE A 47 -0.681 1.764 -9.586 1.00 0.00 C ATOM 0 H PHE A 47 3.835 0.763 -7.614 1.00 0.00 H new ATOM 0 HA PHE A 47 3.702 3.548 -8.281 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.512 1.834 -6.069 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.174 3.545 -6.234 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.937 0.304 -8.050 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.506 4.302 -7.714 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.147 -0.206 -9.652 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.285 3.797 -9.318 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.468 1.542 -10.291 1.00 0.00 H new ATOM 716 N LEU A 48 5.503 2.586 -5.733 1.00 0.00 N ATOM 717 CA LEU A 48 6.471 3.030 -4.737 1.00 0.00 C ATOM 718 C LEU A 48 7.739 3.549 -5.405 1.00 0.00 C ATOM 719 O LEU A 48 7.989 3.280 -6.581 1.00 0.00 O ATOM 720 CB LEU A 48 6.814 1.884 -3.783 1.00 0.00 C ATOM 721 CG LEU A 48 5.689 1.482 -2.825 1.00 0.00 C ATOM 722 CD1 LEU A 48 5.478 -0.024 -2.848 1.00 0.00 C ATOM 723 CD2 LEU A 48 5.995 1.956 -1.412 1.00 0.00 C ATOM 0 H LEU A 48 5.434 1.573 -5.832 1.00 0.00 H new ATOM 0 HA LEU A 48 6.023 3.845 -4.168 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.097 1.012 -4.373 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.687 2.169 -3.196 1.00 0.00 H new ATOM 0 HG LEU A 48 4.769 1.962 -3.157 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.675 -0.289 -2.161 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.211 -0.339 -3.857 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.397 -0.525 -2.543 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.184 1.661 -0.746 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.927 1.505 -1.071 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.093 3.042 -1.406 1.00 0.00 H new ATOM 735 N ASN A 49 8.538 4.293 -4.647 1.00 0.00 N ATOM 736 CA ASN A 49 9.783 4.850 -5.165 1.00 0.00 C ATOM 737 C ASN A 49 10.975 3.985 -4.760 1.00 0.00 C ATOM 738 O ASN A 49 10.879 3.174 -3.840 1.00 0.00 O ATOM 739 CB ASN A 49 9.979 6.279 -4.657 1.00 0.00 C ATOM 740 CG ASN A 49 9.120 7.281 -5.404 1.00 0.00 C ATOM 741 OD1 ASN A 49 8.769 7.071 -6.564 1.00 0.00 O ATOM 742 ND2 ASN A 49 8.779 8.379 -4.739 1.00 0.00 N ATOM 0 H ASN A 49 8.346 4.524 -3.672 1.00 0.00 H new ATOM 0 HA ASN A 49 9.720 4.866 -6.253 1.00 0.00 H new ATOM 0 HB2 ASN A 49 9.739 6.320 -3.594 1.00 0.00 H new ATOM 0 HB3 ASN A 49 11.028 6.557 -4.758 1.00 0.00 H new ATOM 0 HD21 ASN A 49 8.203 9.090 -5.190 1.00 0.00 H new ATOM 0 HD22 ASN A 49 9.093 8.511 -3.778 1.00 0.00 H new ATOM 749 N PRO A 50 12.119 4.149 -5.447 1.00 0.00 N ATOM 750 CA PRO A 50 13.333 3.379 -5.153 1.00 0.00 C ATOM 751 C PRO A 50 13.719 3.446 -3.680 1.00 0.00 C ATOM 752 O PRO A 50 14.226 2.477 -3.115 1.00 0.00 O ATOM 753 CB PRO A 50 14.402 4.053 -6.017 1.00 0.00 C ATOM 754 CG PRO A 50 13.644 4.678 -7.136 1.00 0.00 C ATOM 755 CD PRO A 50 12.320 5.095 -6.559 1.00 0.00 C ATOM 0 HA PRO A 50 13.202 2.318 -5.365 1.00 0.00 H new ATOM 0 HB2 PRO A 50 14.957 4.799 -5.449 1.00 0.00 H new ATOM 0 HB3 PRO A 50 15.128 3.328 -6.386 1.00 0.00 H new ATOM 0 HG2 PRO A 50 14.181 5.536 -7.539 1.00 0.00 H new ATOM 0 HG3 PRO A 50 13.507 3.973 -7.956 1.00 0.00 H new ATOM 0 HD2 PRO A 50 12.341 6.127 -6.210 1.00 0.00 H new ATOM 0 HD3 PRO A 50 11.520 5.024 -7.296 1.00 0.00 H new ATOM 763 N GLU A 51 13.475 4.596 -3.062 1.00 0.00 N ATOM 764 CA GLU A 51 13.797 4.791 -1.653 1.00 0.00 C ATOM 765 C GLU A 51 12.744 4.145 -0.757 1.00 0.00 C ATOM 766 O GLU A 51 13.074 3.429 0.188 1.00 0.00 O ATOM 767 CB GLU A 51 13.906 6.284 -1.336 1.00 0.00 C ATOM 768 CG GLU A 51 14.998 6.615 -0.332 1.00 0.00 C ATOM 769 CD GLU A 51 15.239 8.106 -0.203 1.00 0.00 C ATOM 770 OE1 GLU A 51 15.799 8.701 -1.148 1.00 0.00 O ATOM 771 OE2 GLU A 51 14.868 8.679 0.843 1.00 0.00 O ATOM 0 H GLU A 51 13.055 5.408 -3.515 1.00 0.00 H new ATOM 0 HA GLU A 51 14.756 4.312 -1.457 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.096 6.830 -2.260 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.950 6.635 -0.949 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.726 6.209 0.642 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.924 6.126 -0.634 1.00 0.00 H new ATOM 778 N GLU A 52 11.476 4.404 -1.061 1.00 0.00 N ATOM 779 CA GLU A 52 10.374 3.848 -0.284 1.00 0.00 C ATOM 780 C GLU A 52 10.412 2.323 -0.294 1.00 0.00 C ATOM 781 O GLU A 52 10.036 1.677 0.684 1.00 0.00 O ATOM 782 CB GLU A 52 9.035 4.340 -0.837 1.00 0.00 C ATOM 783 CG GLU A 52 8.817 5.834 -0.663 1.00 0.00 C ATOM 784 CD GLU A 52 7.701 6.365 -1.541 1.00 0.00 C ATOM 785 OE1 GLU A 52 7.669 6.014 -2.740 1.00 0.00 O ATOM 786 OE2 GLU A 52 6.859 7.133 -1.031 1.00 0.00 O ATOM 0 H GLU A 52 11.186 4.995 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 52 10.482 4.188 0.746 1.00 0.00 H new ATOM 0 HB2 GLU A 52 8.977 4.094 -1.897 1.00 0.00 H new ATOM 0 HB3 GLU A 52 8.227 3.803 -0.340 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.585 6.045 0.381 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.741 6.362 -0.897 1.00 0.00 H new ATOM 793 N LEU A 53 10.868 1.755 -1.405 1.00 0.00 N ATOM 794 CA LEU A 53 10.954 0.306 -1.543 1.00 0.00 C ATOM 795 C LEU A 53 12.026 -0.267 -0.621 1.00 0.00 C ATOM 796 O LEU A 53 11.912 -1.397 -0.148 1.00 0.00 O ATOM 797 CB LEU A 53 11.258 -0.071 -2.994 1.00 0.00 C ATOM 798 CG LEU A 53 10.114 0.175 -3.980 1.00 0.00 C ATOM 799 CD1 LEU A 53 10.566 -0.107 -5.404 1.00 0.00 C ATOM 800 CD2 LEU A 53 8.910 -0.682 -3.621 1.00 0.00 C ATOM 0 H LEU A 53 11.184 2.276 -2.223 1.00 0.00 H new ATOM 0 HA LEU A 53 9.992 -0.119 -1.258 1.00 0.00 H new ATOM 0 HB2 LEU A 53 12.130 0.493 -3.325 1.00 0.00 H new ATOM 0 HB3 LEU A 53 11.528 -1.126 -3.030 1.00 0.00 H new ATOM 0 HG LEU A 53 9.822 1.223 -3.915 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.739 0.073 -6.091 1.00 0.00 H new ATOM 0 HD12 LEU A 53 11.398 0.549 -5.658 1.00 0.00 H new ATOM 0 HD13 LEU A 53 10.885 -1.146 -5.485 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.105 -0.495 -4.332 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.189 -1.735 -3.658 1.00 0.00 H new ATOM 0 HD23 LEU A 53 8.572 -0.431 -2.616 1.00 0.00 H new ATOM 812 N ARG A 54 13.067 0.520 -0.371 1.00 0.00 N ATOM 813 CA ARG A 54 14.160 0.091 0.493 1.00 0.00 C ATOM 814 C ARG A 54 13.686 -0.068 1.936 1.00 0.00 C ATOM 815 O ARG A 54 14.208 -0.894 2.683 1.00 0.00 O ATOM 816 CB ARG A 54 15.312 1.096 0.431 1.00 0.00 C ATOM 817 CG ARG A 54 16.687 0.452 0.521 1.00 0.00 C ATOM 818 CD ARG A 54 16.975 -0.055 1.926 1.00 0.00 C ATOM 819 NE ARG A 54 18.263 0.420 2.426 1.00 0.00 N ATOM 820 CZ ARG A 54 18.461 1.640 2.923 1.00 0.00 C ATOM 821 NH1 ARG A 54 17.460 2.509 2.986 1.00 0.00 N ATOM 822 NH2 ARG A 54 19.663 1.990 3.359 1.00 0.00 N ATOM 0 H ARG A 54 13.177 1.459 -0.755 1.00 0.00 H new ATOM 0 HA ARG A 54 14.511 -0.877 0.137 1.00 0.00 H new ATOM 0 HB2 ARG A 54 15.243 1.658 -0.501 1.00 0.00 H new ATOM 0 HB3 ARG A 54 15.202 1.813 1.245 1.00 0.00 H new ATOM 0 HG2 ARG A 54 16.749 -0.376 -0.185 1.00 0.00 H new ATOM 0 HG3 ARG A 54 17.449 1.176 0.231 1.00 0.00 H new ATOM 0 HD2 ARG A 54 16.182 0.272 2.599 1.00 0.00 H new ATOM 0 HD3 ARG A 54 16.965 -1.145 1.927 1.00 0.00 H new ATOM 0 HE ARG A 54 19.057 -0.220 2.393 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.533 2.244 2.653 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.618 3.442 3.368 1.00 0.00 H new ATOM 0 HH21 ARG A 54 20.435 1.325 3.314 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.815 2.924 3.740 1.00 0.00 H new ATOM 836 N VAL A 55 12.695 0.732 2.319 1.00 0.00 N ATOM 837 CA VAL A 55 12.152 0.680 3.671 1.00 0.00 C ATOM 838 C VAL A 55 11.285 -0.559 3.871 1.00 0.00 C ATOM 839 O VAL A 55 11.240 -1.127 4.961 1.00 0.00 O ATOM 840 CB VAL A 55 11.314 1.933 3.989 1.00 0.00 C ATOM 841 CG1 VAL A 55 10.928 1.959 5.459 1.00 0.00 C ATOM 842 CG2 VAL A 55 12.074 3.194 3.606 1.00 0.00 C ATOM 0 H VAL A 55 12.253 1.423 1.713 1.00 0.00 H new ATOM 0 HA VAL A 55 13.004 0.638 4.350 1.00 0.00 H new ATOM 0 HB VAL A 55 10.398 1.895 3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 55 10.337 2.851 5.664 1.00 0.00 H new ATOM 0 HG12 VAL A 55 10.341 1.072 5.697 1.00 0.00 H new ATOM 0 HG13 VAL A 55 11.829 1.972 6.072 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.467 4.069 3.838 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.007 3.241 4.167 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.293 3.177 2.538 1.00 0.00 H new ATOM 852 N ILE A 56 10.600 -0.971 2.810 1.00 0.00 N ATOM 853 CA ILE A 56 9.735 -2.143 2.868 1.00 0.00 C ATOM 854 C ILE A 56 10.536 -3.429 2.697 1.00 0.00 C ATOM 855 O ILE A 56 10.222 -4.453 3.303 1.00 0.00 O ATOM 856 CB ILE A 56 8.638 -2.085 1.787 1.00 0.00 C ATOM 857 CG1 ILE A 56 7.943 -0.724 1.807 1.00 0.00 C ATOM 858 CG2 ILE A 56 7.630 -3.206 1.995 1.00 0.00 C ATOM 859 CD1 ILE A 56 6.854 -0.585 0.765 1.00 0.00 C ATOM 0 H ILE A 56 10.627 -0.511 1.900 1.00 0.00 H new ATOM 0 HA ILE A 56 9.266 -2.141 3.852 1.00 0.00 H new ATOM 0 HB ILE A 56 9.103 -2.218 0.810 1.00 0.00 H new ATOM 0 HG12 ILE A 56 7.512 -0.560 2.795 1.00 0.00 H new ATOM 0 HG13 ILE A 56 8.687 0.057 1.650 1.00 0.00 H new ATOM 0 HG21 ILE A 56 6.861 -3.152 1.224 1.00 0.00 H new ATOM 0 HG22 ILE A 56 8.138 -4.168 1.934 1.00 0.00 H new ATOM 0 HG23 ILE A 56 7.167 -3.102 2.976 1.00 0.00 H new ATOM 0 HD11 ILE A 56 6.405 0.406 0.838 1.00 0.00 H new ATOM 0 HD12 ILE A 56 7.282 -0.717 -0.229 1.00 0.00 H new ATOM 0 HD13 ILE A 56 6.089 -1.343 0.934 1.00 0.00 H new ATOM 871 N GLU A 57 11.571 -3.368 1.865 1.00 0.00 N ATOM 872 CA GLU A 57 12.417 -4.528 1.613 1.00 0.00 C ATOM 873 C GLU A 57 13.071 -5.016 2.903 1.00 0.00 C ATOM 874 O GLU A 57 13.325 -6.210 3.068 1.00 0.00 O ATOM 875 CB GLU A 57 13.492 -4.185 0.578 1.00 0.00 C ATOM 876 CG GLU A 57 13.242 -4.806 -0.786 1.00 0.00 C ATOM 877 CD GLU A 57 14.518 -5.280 -1.454 1.00 0.00 C ATOM 878 OE1 GLU A 57 15.497 -4.506 -1.480 1.00 0.00 O ATOM 879 OE2 GLU A 57 14.539 -6.426 -1.950 1.00 0.00 O ATOM 0 H GLU A 57 11.843 -2.528 1.354 1.00 0.00 H new ATOM 0 HA GLU A 57 11.788 -5.328 1.222 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.548 -3.102 0.470 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.461 -4.519 0.948 1.00 0.00 H new ATOM 0 HG2 GLU A 57 12.559 -5.648 -0.678 1.00 0.00 H new ATOM 0 HG3 GLU A 57 12.749 -4.076 -1.429 1.00 0.00 H new ATOM 886 N GLU A 58 13.339 -4.086 3.813 1.00 0.00 N ATOM 887 CA GLU A 58 13.964 -4.422 5.088 1.00 0.00 C ATOM 888 C GLU A 58 13.118 -5.428 5.864 1.00 0.00 C ATOM 889 O GLU A 58 13.647 -6.268 6.591 1.00 0.00 O ATOM 890 CB GLU A 58 14.171 -3.159 5.927 1.00 0.00 C ATOM 891 CG GLU A 58 15.445 -2.405 5.586 1.00 0.00 C ATOM 892 CD GLU A 58 15.735 -1.279 6.560 1.00 0.00 C ATOM 893 OE1 GLU A 58 16.404 -1.536 7.582 1.00 0.00 O ATOM 894 OE2 GLU A 58 15.291 -0.141 6.301 1.00 0.00 O ATOM 0 H GLU A 58 13.134 -3.094 3.692 1.00 0.00 H new ATOM 0 HA GLU A 58 14.933 -4.875 4.879 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.317 -2.496 5.787 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.192 -3.433 6.982 1.00 0.00 H new ATOM 0 HG2 GLU A 58 16.284 -3.101 5.580 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.363 -1.997 4.579 1.00 0.00 H new ATOM 901 N ILE A 59 11.802 -5.335 5.703 1.00 0.00 N ATOM 902 CA ILE A 59 10.883 -6.237 6.389 1.00 0.00 C ATOM 903 C ILE A 59 10.920 -7.634 5.770 1.00 0.00 C ATOM 904 O ILE A 59 10.489 -7.826 4.633 1.00 0.00 O ATOM 905 CB ILE A 59 9.436 -5.706 6.342 1.00 0.00 C ATOM 906 CG1 ILE A 59 9.388 -4.248 6.802 1.00 0.00 C ATOM 907 CG2 ILE A 59 8.526 -6.568 7.202 1.00 0.00 C ATOM 908 CD1 ILE A 59 8.163 -3.502 6.319 1.00 0.00 C ATOM 0 H ILE A 59 11.348 -4.645 5.104 1.00 0.00 H new ATOM 0 HA ILE A 59 11.209 -6.293 7.428 1.00 0.00 H new ATOM 0 HB ILE A 59 9.082 -5.754 5.312 1.00 0.00 H new ATOM 0 HG12 ILE A 59 9.416 -4.218 7.891 1.00 0.00 H new ATOM 0 HG13 ILE A 59 10.281 -3.734 6.446 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.509 -6.180 7.158 1.00 0.00 H new ATOM 0 HG22 ILE A 59 8.539 -7.593 6.832 1.00 0.00 H new ATOM 0 HG23 ILE A 59 8.877 -6.550 8.234 1.00 0.00 H new ATOM 0 HD11 ILE A 59 8.196 -2.475 6.683 1.00 0.00 H new ATOM 0 HD12 ILE A 59 8.144 -3.501 5.229 1.00 0.00 H new ATOM 0 HD13 ILE A 59 7.266 -3.992 6.697 1.00 0.00 H new ATOM 920 N PRO A 60 11.436 -8.634 6.509 1.00 0.00 N ATOM 921 CA PRO A 60 11.522 -10.013 6.018 1.00 0.00 C ATOM 922 C PRO A 60 10.160 -10.698 5.973 1.00 0.00 C ATOM 923 O PRO A 60 9.820 -11.362 4.995 1.00 0.00 O ATOM 924 CB PRO A 60 12.431 -10.695 7.038 1.00 0.00 C ATOM 925 CG PRO A 60 12.230 -9.925 8.296 1.00 0.00 C ATOM 926 CD PRO A 60 11.976 -8.502 7.878 1.00 0.00 C ATOM 0 HA PRO A 60 11.896 -10.060 4.995 1.00 0.00 H new ATOM 0 HB2 PRO A 60 12.164 -11.744 7.168 1.00 0.00 H new ATOM 0 HB3 PRO A 60 13.473 -10.669 6.720 1.00 0.00 H new ATOM 0 HG2 PRO A 60 11.388 -10.320 8.865 1.00 0.00 H new ATOM 0 HG3 PRO A 60 13.108 -9.992 8.938 1.00 0.00 H new ATOM 0 HD2 PRO A 60 11.267 -8.009 8.543 1.00 0.00 H new ATOM 0 HD3 PRO A 60 12.891 -7.910 7.893 1.00 0.00 H new ATOM 934 N GLN A 61 9.385 -10.533 7.040 1.00 0.00 N ATOM 935 CA GLN A 61 8.061 -11.137 7.124 1.00 0.00 C ATOM 936 C GLN A 61 7.152 -10.612 6.016 1.00 0.00 C ATOM 937 O GLN A 61 7.387 -9.537 5.464 1.00 0.00 O ATOM 938 CB GLN A 61 7.435 -10.856 8.493 1.00 0.00 C ATOM 939 CG GLN A 61 7.392 -12.072 9.403 1.00 0.00 C ATOM 940 CD GLN A 61 6.087 -12.182 10.168 1.00 0.00 C ATOM 941 OE1 GLN A 61 5.011 -12.250 9.575 1.00 0.00 O ATOM 942 NE2 GLN A 61 6.178 -12.200 11.493 1.00 0.00 N ATOM 0 H GLN A 61 9.651 -9.986 7.859 1.00 0.00 H new ATOM 0 HA GLN A 61 8.171 -12.214 6.998 1.00 0.00 H new ATOM 0 HB2 GLN A 61 7.999 -10.064 8.985 1.00 0.00 H new ATOM 0 HB3 GLN A 61 6.421 -10.484 8.350 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.536 -12.973 8.807 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.220 -12.022 10.110 1.00 0.00 H new ATOM 0 HE21 GLN A 61 7.092 -12.141 11.942 1.00 0.00 H new ATOM 0 HE22 GLN A 61 5.334 -12.273 12.061 1.00 0.00 H new ATOM 951 N ALA A 62 6.115 -11.378 5.696 1.00 0.00 N ATOM 952 CA ALA A 62 5.170 -10.991 4.655 1.00 0.00 C ATOM 953 C ALA A 62 4.045 -10.137 5.227 1.00 0.00 C ATOM 954 O ALA A 62 3.685 -9.105 4.660 1.00 0.00 O ATOM 955 CB ALA A 62 4.603 -12.227 3.972 1.00 0.00 C ATOM 0 H ALA A 62 5.907 -12.271 6.143 1.00 0.00 H new ATOM 0 HA ALA A 62 5.704 -10.394 3.916 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.899 -11.924 3.197 1.00 0.00 H new ATOM 0 HB2 ALA A 62 5.415 -12.798 3.521 1.00 0.00 H new ATOM 0 HB3 ALA A 62 4.089 -12.845 4.708 1.00 0.00 H new ATOM 961 N GLU A 63 3.493 -10.573 6.355 1.00 0.00 N ATOM 962 CA GLU A 63 2.409 -9.846 7.006 1.00 0.00 C ATOM 963 C GLU A 63 2.851 -8.437 7.389 1.00 0.00 C ATOM 964 O GLU A 63 2.182 -7.456 7.064 1.00 0.00 O ATOM 965 CB GLU A 63 1.936 -10.601 8.249 1.00 0.00 C ATOM 966 CG GLU A 63 0.719 -9.977 8.913 1.00 0.00 C ATOM 967 CD GLU A 63 0.766 -10.073 10.425 1.00 0.00 C ATOM 968 OE1 GLU A 63 1.214 -11.120 10.940 1.00 0.00 O ATOM 969 OE2 GLU A 63 0.356 -9.102 11.095 1.00 0.00 O ATOM 0 H GLU A 63 3.778 -11.426 6.837 1.00 0.00 H new ATOM 0 HA GLU A 63 1.582 -9.768 6.300 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.702 -11.629 7.972 1.00 0.00 H new ATOM 0 HB3 GLU A 63 2.752 -10.643 8.971 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.648 -8.929 8.621 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.182 -10.471 8.549 1.00 0.00 H new ATOM 976 N ASP A 64 3.981 -8.347 8.081 1.00 0.00 N ATOM 977 CA ASP A 64 4.514 -7.058 8.508 1.00 0.00 C ATOM 978 C ASP A 64 4.806 -6.165 7.307 1.00 0.00 C ATOM 979 O ASP A 64 4.709 -4.941 7.394 1.00 0.00 O ATOM 980 CB ASP A 64 5.789 -7.259 9.331 1.00 0.00 C ATOM 981 CG ASP A 64 6.256 -5.978 9.994 1.00 0.00 C ATOM 982 OD1 ASP A 64 5.431 -5.053 10.145 1.00 0.00 O ATOM 983 OD2 ASP A 64 7.446 -5.901 10.363 1.00 0.00 O ATOM 0 H ASP A 64 4.545 -9.150 8.358 1.00 0.00 H new ATOM 0 HA ASP A 64 3.762 -6.568 9.127 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.610 -8.016 10.095 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.580 -7.640 8.684 1.00 0.00 H new ATOM 988 N LYS A 65 5.162 -6.785 6.187 1.00 0.00 N ATOM 989 CA LYS A 65 5.468 -6.047 4.968 1.00 0.00 C ATOM 990 C LYS A 65 4.267 -5.222 4.516 1.00 0.00 C ATOM 991 O LYS A 65 4.400 -4.048 4.169 1.00 0.00 O ATOM 992 CB LYS A 65 5.889 -7.010 3.855 1.00 0.00 C ATOM 993 CG LYS A 65 7.017 -6.478 2.987 1.00 0.00 C ATOM 994 CD LYS A 65 7.695 -7.597 2.210 1.00 0.00 C ATOM 995 CE LYS A 65 9.087 -7.195 1.749 1.00 0.00 C ATOM 996 NZ LYS A 65 9.178 -7.112 0.266 1.00 0.00 N ATOM 0 H LYS A 65 5.246 -7.798 6.099 1.00 0.00 H new ATOM 0 HA LYS A 65 6.293 -5.368 5.182 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.199 -7.955 4.301 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.026 -7.223 3.225 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.624 -5.736 2.292 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.751 -5.971 3.613 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.761 -8.487 2.836 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.087 -7.860 1.345 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.349 -6.230 2.183 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.814 -7.918 2.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.142 -6.835 -0.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.953 -8.039 -0.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.502 -6.403 -0.084 1.00 0.00 H new ATOM 1010 N LEU A 66 3.092 -5.844 4.524 1.00 0.00 N ATOM 1011 CA LEU A 66 1.866 -5.168 4.116 1.00 0.00 C ATOM 1012 C LEU A 66 1.582 -3.970 5.016 1.00 0.00 C ATOM 1013 O LEU A 66 1.046 -2.956 4.567 1.00 0.00 O ATOM 1014 CB LEU A 66 0.686 -6.141 4.151 1.00 0.00 C ATOM 1015 CG LEU A 66 -0.503 -5.751 3.272 1.00 0.00 C ATOM 1016 CD1 LEU A 66 -0.115 -5.790 1.802 1.00 0.00 C ATOM 1017 CD2 LEU A 66 -1.685 -6.670 3.537 1.00 0.00 C ATOM 0 H LEU A 66 2.963 -6.815 4.809 1.00 0.00 H new ATOM 0 HA LEU A 66 2.000 -4.809 3.096 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.038 -7.126 3.843 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.342 -6.233 5.181 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.797 -4.732 3.522 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.973 -5.510 1.192 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.702 -5.091 1.623 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.205 -6.798 1.537 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.522 -6.378 2.903 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.403 -7.699 3.314 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.978 -6.593 4.584 1.00 0.00 H new ATOM 1029 N ASP A 67 1.944 -4.093 6.289 1.00 0.00 N ATOM 1030 CA ASP A 67 1.728 -3.020 7.252 1.00 0.00 C ATOM 1031 C ASP A 67 2.466 -1.754 6.828 1.00 0.00 C ATOM 1032 O ASP A 67 1.948 -0.646 6.966 1.00 0.00 O ATOM 1033 CB ASP A 67 2.195 -3.453 8.642 1.00 0.00 C ATOM 1034 CG ASP A 67 1.498 -2.688 9.751 1.00 0.00 C ATOM 1035 OD1 ASP A 67 1.810 -1.492 9.934 1.00 0.00 O ATOM 1036 OD2 ASP A 67 0.642 -3.284 10.436 1.00 0.00 O ATOM 0 H ASP A 67 2.388 -4.925 6.677 1.00 0.00 H new ATOM 0 HA ASP A 67 0.660 -2.804 7.285 1.00 0.00 H new ATOM 0 HB2 ASP A 67 2.010 -4.520 8.768 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.272 -3.304 8.723 1.00 0.00 H new ATOM 1041 N ARG A 68 3.678 -1.927 6.310 1.00 0.00 N ATOM 1042 CA ARG A 68 4.487 -0.800 5.865 1.00 0.00 C ATOM 1043 C ARG A 68 3.987 -0.266 4.526 1.00 0.00 C ATOM 1044 O ARG A 68 4.110 0.925 4.237 1.00 0.00 O ATOM 1045 CB ARG A 68 5.955 -1.213 5.747 1.00 0.00 C ATOM 1046 CG ARG A 68 6.916 -0.035 5.690 1.00 0.00 C ATOM 1047 CD ARG A 68 7.967 -0.116 6.786 1.00 0.00 C ATOM 1048 NE ARG A 68 8.280 1.198 7.343 1.00 0.00 N ATOM 1049 CZ ARG A 68 7.409 1.946 8.016 1.00 0.00 C ATOM 1050 NH1 ARG A 68 6.171 1.515 8.218 1.00 0.00 N ATOM 1051 NH2 ARG A 68 7.777 3.129 8.490 1.00 0.00 N ATOM 0 H ARG A 68 4.121 -2.838 6.188 1.00 0.00 H new ATOM 0 HA ARG A 68 4.399 -0.007 6.607 1.00 0.00 H new ATOM 0 HB2 ARG A 68 6.216 -1.843 6.597 1.00 0.00 H new ATOM 0 HB3 ARG A 68 6.082 -1.819 4.850 1.00 0.00 H new ATOM 0 HG2 ARG A 68 7.406 -0.011 4.717 1.00 0.00 H new ATOM 0 HG3 ARG A 68 6.358 0.896 5.789 1.00 0.00 H new ATOM 0 HD2 ARG A 68 7.612 -0.771 7.581 1.00 0.00 H new ATOM 0 HD3 ARG A 68 8.875 -0.565 6.385 1.00 0.00 H new ATOM 0 HE ARG A 68 9.222 1.564 7.208 1.00 0.00 H new ATOM 0 HH11 ARG A 68 5.882 0.606 7.857 1.00 0.00 H new ATOM 0 HH12 ARG A 68 5.508 2.093 8.735 1.00 0.00 H new ATOM 0 HH21 ARG A 68 8.728 3.466 8.339 1.00 0.00 H new ATOM 0 HH22 ARG A 68 7.109 3.702 9.006 1.00 0.00 H new ATOM 1065 N LEU A 69 3.423 -1.153 3.714 1.00 0.00 N ATOM 1066 CA LEU A 69 2.902 -0.771 2.406 1.00 0.00 C ATOM 1067 C LEU A 69 1.829 0.304 2.541 1.00 0.00 C ATOM 1068 O LEU A 69 1.875 1.331 1.863 1.00 0.00 O ATOM 1069 CB LEU A 69 2.329 -1.993 1.685 1.00 0.00 C ATOM 1070 CG LEU A 69 2.244 -1.865 0.163 1.00 0.00 C ATOM 1071 CD1 LEU A 69 3.628 -1.663 -0.434 1.00 0.00 C ATOM 1072 CD2 LEU A 69 1.577 -3.093 -0.438 1.00 0.00 C ATOM 0 H LEU A 69 3.315 -2.142 3.938 1.00 0.00 H new ATOM 0 HA LEU A 69 3.726 -0.365 1.819 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.943 -2.860 1.928 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.330 -2.190 2.074 1.00 0.00 H new ATOM 0 HG LEU A 69 1.637 -0.992 -0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.547 -1.574 -1.517 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.071 -0.754 -0.027 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.259 -2.516 -0.186 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.525 -2.985 -1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.158 -3.981 -0.189 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.569 -3.194 -0.034 1.00 0.00 H new ATOM 1084 N PHE A 70 0.864 0.062 3.421 1.00 0.00 N ATOM 1085 CA PHE A 70 -0.221 1.009 3.648 1.00 0.00 C ATOM 1086 C PHE A 70 0.301 2.298 4.275 1.00 0.00 C ATOM 1087 O PHE A 70 -0.266 3.371 4.074 1.00 0.00 O ATOM 1088 CB PHE A 70 -1.290 0.387 4.548 1.00 0.00 C ATOM 1089 CG PHE A 70 -2.200 -0.567 3.828 1.00 0.00 C ATOM 1090 CD1 PHE A 70 -1.689 -1.686 3.191 1.00 0.00 C ATOM 1091 CD2 PHE A 70 -3.568 -0.344 3.788 1.00 0.00 C ATOM 1092 CE1 PHE A 70 -2.524 -2.565 2.527 1.00 0.00 C ATOM 1093 CE2 PHE A 70 -4.408 -1.220 3.126 1.00 0.00 C ATOM 1094 CZ PHE A 70 -3.885 -2.331 2.495 1.00 0.00 C ATOM 0 H PHE A 70 0.811 -0.783 3.990 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.665 1.251 2.682 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.802 -0.139 5.368 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -1.889 1.183 4.991 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.626 -1.874 3.213 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -3.982 0.524 4.280 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.113 -3.433 2.034 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.472 -1.035 3.102 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.539 -3.016 1.977 1.00 0.00 H new ATOM 1104 N GLU A 71 1.387 2.185 5.034 1.00 0.00 N ATOM 1105 CA GLU A 71 1.984 3.342 5.689 1.00 0.00 C ATOM 1106 C GLU A 71 2.539 4.323 4.661 1.00 0.00 C ATOM 1107 O GLU A 71 2.488 5.538 4.856 1.00 0.00 O ATOM 1108 CB GLU A 71 3.097 2.898 6.641 1.00 0.00 C ATOM 1109 CG GLU A 71 3.132 3.679 7.945 1.00 0.00 C ATOM 1110 CD GLU A 71 4.110 4.835 7.906 1.00 0.00 C ATOM 1111 OE1 GLU A 71 4.435 5.303 6.794 1.00 0.00 O ATOM 1112 OE2 GLU A 71 4.551 5.276 8.989 1.00 0.00 O ATOM 0 H GLU A 71 1.870 1.304 5.210 1.00 0.00 H new ATOM 0 HA GLU A 71 1.205 3.846 6.262 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.970 1.839 6.865 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.058 3.005 6.138 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.134 4.059 8.163 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.402 3.007 8.760 1.00 0.00 H new ATOM 1119 N ILE A 72 3.068 3.788 3.565 1.00 0.00 N ATOM 1120 CA ILE A 72 3.631 4.616 2.507 1.00 0.00 C ATOM 1121 C ILE A 72 2.574 4.981 1.471 1.00 0.00 C ATOM 1122 O ILE A 72 2.397 6.153 1.137 1.00 0.00 O ATOM 1123 CB ILE A 72 4.802 3.906 1.799 1.00 0.00 C ATOM 1124 CG1 ILE A 72 5.784 3.345 2.830 1.00 0.00 C ATOM 1125 CG2 ILE A 72 5.509 4.864 0.853 1.00 0.00 C ATOM 1126 CD1 ILE A 72 6.879 2.497 2.221 1.00 0.00 C ATOM 0 H ILE A 72 3.118 2.785 3.387 1.00 0.00 H new ATOM 0 HA ILE A 72 4.000 5.525 2.982 1.00 0.00 H new ATOM 0 HB ILE A 72 4.405 3.077 1.214 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.237 4.172 3.376 1.00 0.00 H new ATOM 0 HG13 ILE A 72 5.234 2.747 3.556 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.333 4.347 0.361 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.804 5.220 0.102 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.897 5.712 1.417 1.00 0.00 H new ATOM 0 HD11 ILE A 72 7.538 2.133 3.009 1.00 0.00 H new ATOM 0 HD12 ILE A 72 6.435 1.650 1.699 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.454 3.097 1.516 1.00 0.00 H new ATOM 1138 N ILE A 73 1.871 3.972 0.967 1.00 0.00 N ATOM 1139 CA ILE A 73 0.829 4.189 -0.029 1.00 0.00 C ATOM 1140 C ILE A 73 -0.363 4.920 0.578 1.00 0.00 C ATOM 1141 O ILE A 73 -0.983 5.765 -0.070 1.00 0.00 O ATOM 1142 CB ILE A 73 0.348 2.859 -0.640 1.00 0.00 C ATOM 1143 CG1 ILE A 73 1.541 2.032 -1.121 1.00 0.00 C ATOM 1144 CG2 ILE A 73 -0.620 3.118 -1.786 1.00 0.00 C ATOM 1145 CD1 ILE A 73 2.335 2.699 -2.224 1.00 0.00 C ATOM 0 H ILE A 73 2.004 2.996 1.232 1.00 0.00 H new ATOM 0 HA ILE A 73 1.266 4.802 -0.817 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.176 2.293 0.130 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.202 1.837 -0.276 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.183 1.065 -1.476 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -0.950 2.168 -2.206 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.484 3.670 -1.415 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.121 3.702 -2.559 1.00 0.00 H new ATOM 0 HD11 ILE A 73 3.165 2.055 -2.515 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.689 2.870 -3.085 1.00 0.00 H new ATOM 0 HD13 ILE A 73 2.723 3.653 -1.867 1.00 0.00 H new ATOM 1157 N GLY A 74 -0.681 4.591 1.825 1.00 0.00 N ATOM 1158 CA GLY A 74 -1.798 5.227 2.499 1.00 0.00 C ATOM 1159 C GLY A 74 -1.634 6.731 2.598 1.00 0.00 C ATOM 1160 O GLY A 74 -2.619 7.466 2.656 1.00 0.00 O ATOM 0 H GLY A 74 -0.185 3.895 2.382 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.719 4.999 1.963 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.900 4.809 3.500 1.00 0.00 H new ATOM 1164 N VAL A 75 -0.386 7.188 2.614 1.00 0.00 N ATOM 1165 CA VAL A 75 -0.096 8.614 2.706 1.00 0.00 C ATOM 1166 C VAL A 75 0.518 9.133 1.409 1.00 0.00 C ATOM 1167 O VAL A 75 1.290 10.092 1.416 1.00 0.00 O ATOM 1168 CB VAL A 75 0.864 8.921 3.872 1.00 0.00 C ATOM 1169 CG1 VAL A 75 0.935 10.421 4.128 1.00 0.00 C ATOM 1170 CG2 VAL A 75 0.434 8.179 5.129 1.00 0.00 C ATOM 0 H VAL A 75 0.440 6.592 2.564 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.046 9.118 2.886 1.00 0.00 H new ATOM 0 HB VAL A 75 1.860 8.575 3.596 1.00 0.00 H new ATOM 0 HG11 VAL A 75 1.618 10.617 4.955 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.295 10.926 3.232 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.057 10.794 4.381 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.124 8.408 5.941 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.572 8.490 5.409 1.00 0.00 H new ATOM 0 HG23 VAL A 75 0.442 7.106 4.939 1.00 0.00 H new ATOM 1180 N LYS A 76 0.171 8.492 0.297 1.00 0.00 N ATOM 1181 CA LYS A 76 0.688 8.889 -1.007 1.00 0.00 C ATOM 1182 C LYS A 76 -0.349 9.701 -1.777 1.00 0.00 C ATOM 1183 O LYS A 76 -0.174 10.900 -1.999 1.00 0.00 O ATOM 1184 CB LYS A 76 1.092 7.656 -1.817 1.00 0.00 C ATOM 1185 CG LYS A 76 2.369 7.848 -2.620 1.00 0.00 C ATOM 1186 CD LYS A 76 2.960 6.516 -3.054 1.00 0.00 C ATOM 1187 CE LYS A 76 3.762 5.873 -1.934 1.00 0.00 C ATOM 1188 NZ LYS A 76 4.926 5.104 -2.456 1.00 0.00 N ATOM 0 H LYS A 76 -0.466 7.696 0.273 1.00 0.00 H new ATOM 0 HA LYS A 76 1.568 9.513 -0.847 1.00 0.00 H new ATOM 0 HB2 LYS A 76 1.222 6.813 -1.139 1.00 0.00 H new ATOM 0 HB3 LYS A 76 0.281 7.396 -2.497 1.00 0.00 H new ATOM 0 HG2 LYS A 76 2.159 8.458 -3.499 1.00 0.00 H new ATOM 0 HG3 LYS A 76 3.098 8.393 -2.021 1.00 0.00 H new ATOM 0 HD2 LYS A 76 2.159 5.844 -3.362 1.00 0.00 H new ATOM 0 HD3 LYS A 76 3.601 6.667 -3.922 1.00 0.00 H new ATOM 0 HE2 LYS A 76 4.114 6.645 -1.250 1.00 0.00 H new ATOM 0 HE3 LYS A 76 3.116 5.209 -1.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.583 4.897 -1.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 4.593 4.212 -2.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 5.415 5.665 -3.182 1.00 0.00 H new ATOM 1202 N SER A 77 -1.428 9.040 -2.181 1.00 0.00 N ATOM 1203 CA SER A 77 -2.494 9.699 -2.925 1.00 0.00 C ATOM 1204 C SER A 77 -3.744 8.827 -2.972 1.00 0.00 C ATOM 1205 O SER A 77 -3.779 7.744 -2.386 1.00 0.00 O ATOM 1206 CB SER A 77 -2.029 10.021 -4.347 1.00 0.00 C ATOM 1207 OG SER A 77 -2.767 11.101 -4.893 1.00 0.00 O ATOM 0 H SER A 77 -1.587 8.048 -2.006 1.00 0.00 H new ATOM 0 HA SER A 77 -2.740 10.628 -2.411 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.968 10.269 -4.338 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.145 9.141 -4.979 1.00 0.00 H new ATOM 0 HG SER A 77 -2.958 10.923 -5.838 1.00 0.00 H new ATOM 1213 N GLN A 78 -4.766 9.305 -3.673 1.00 0.00 N ATOM 1214 CA GLN A 78 -6.019 8.568 -3.796 1.00 0.00 C ATOM 1215 C GLN A 78 -5.933 7.525 -4.906 1.00 0.00 C ATOM 1216 O GLN A 78 -6.633 6.513 -4.874 1.00 0.00 O ATOM 1217 CB GLN A 78 -7.176 9.530 -4.076 1.00 0.00 C ATOM 1218 CG GLN A 78 -8.546 8.915 -3.850 1.00 0.00 C ATOM 1219 CD GLN A 78 -9.045 9.108 -2.432 1.00 0.00 C ATOM 1220 OE1 GLN A 78 -9.415 8.149 -1.755 1.00 0.00 O ATOM 1221 NE2 GLN A 78 -9.058 10.355 -1.973 1.00 0.00 N ATOM 0 H GLN A 78 -4.752 10.199 -4.164 1.00 0.00 H new ATOM 0 HA GLN A 78 -6.201 8.054 -2.852 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.071 10.407 -3.437 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.108 9.876 -5.107 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.258 9.359 -4.545 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.503 7.849 -4.074 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -8.742 11.121 -2.568 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -9.384 10.546 -1.025 1.00 0.00 H new ATOM 1230 N GLU A 79 -5.071 7.776 -5.887 1.00 0.00 N ATOM 1231 CA GLU A 79 -4.896 6.857 -7.005 1.00 0.00 C ATOM 1232 C GLU A 79 -4.093 5.631 -6.583 1.00 0.00 C ATOM 1233 O GLU A 79 -4.289 4.537 -7.112 1.00 0.00 O ATOM 1234 CB GLU A 79 -4.198 7.563 -8.168 1.00 0.00 C ATOM 1235 CG GLU A 79 -2.867 8.193 -7.788 1.00 0.00 C ATOM 1236 CD GLU A 79 -2.735 9.622 -8.277 1.00 0.00 C ATOM 1237 OE1 GLU A 79 -3.357 10.518 -7.669 1.00 0.00 O ATOM 1238 OE2 GLU A 79 -2.009 9.845 -9.269 1.00 0.00 O ATOM 0 H GLU A 79 -4.483 8.608 -5.930 1.00 0.00 H new ATOM 0 HA GLU A 79 -5.883 6.527 -7.329 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.034 6.845 -8.972 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.858 8.337 -8.561 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -2.757 8.173 -6.704 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -2.055 7.595 -8.202 1.00 0.00 H new ATOM 1245 N ALA A 80 -3.189 5.821 -5.628 1.00 0.00 N ATOM 1246 CA ALA A 80 -2.356 4.730 -5.136 1.00 0.00 C ATOM 1247 C ALA A 80 -3.013 4.027 -3.953 1.00 0.00 C ATOM 1248 O ALA A 80 -2.821 2.829 -3.746 1.00 0.00 O ATOM 1249 CB ALA A 80 -0.981 5.251 -4.746 1.00 0.00 C ATOM 0 H ALA A 80 -3.014 6.720 -5.179 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.242 4.002 -5.939 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -0.370 4.426 -4.380 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -0.502 5.700 -5.616 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.085 6.001 -3.962 1.00 0.00 H new ATOM 1255 N SER A 81 -3.787 4.780 -3.180 1.00 0.00 N ATOM 1256 CA SER A 81 -4.473 4.231 -2.016 1.00 0.00 C ATOM 1257 C SER A 81 -5.589 3.279 -2.438 1.00 0.00 C ATOM 1258 O SER A 81 -5.690 2.162 -1.932 1.00 0.00 O ATOM 1259 CB SER A 81 -5.045 5.359 -1.155 1.00 0.00 C ATOM 1260 OG SER A 81 -6.056 4.879 -0.285 1.00 0.00 O ATOM 0 H SER A 81 -3.955 5.773 -3.338 1.00 0.00 H new ATOM 0 HA SER A 81 -3.746 3.670 -1.429 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.246 5.815 -0.571 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.455 6.138 -1.798 1.00 0.00 H new ATOM 0 HG SER A 81 -6.706 5.592 -0.114 1.00 0.00 H new ATOM 1266 N GLN A 82 -6.426 3.731 -3.366 1.00 0.00 N ATOM 1267 CA GLN A 82 -7.536 2.921 -3.854 1.00 0.00 C ATOM 1268 C GLN A 82 -7.034 1.618 -4.469 1.00 0.00 C ATOM 1269 O GLN A 82 -7.564 0.543 -4.189 1.00 0.00 O ATOM 1270 CB GLN A 82 -8.351 3.705 -4.885 1.00 0.00 C ATOM 1271 CG GLN A 82 -9.847 3.452 -4.799 1.00 0.00 C ATOM 1272 CD GLN A 82 -10.438 3.894 -3.475 1.00 0.00 C ATOM 1273 OE1 GLN A 82 -10.408 5.076 -3.132 1.00 0.00 O ATOM 1274 NE2 GLN A 82 -10.979 2.943 -2.721 1.00 0.00 N ATOM 0 H GLN A 82 -6.357 4.654 -3.795 1.00 0.00 H new ATOM 0 HA GLN A 82 -8.174 2.676 -3.005 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.163 4.770 -4.750 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -8.004 3.444 -5.885 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.348 3.980 -5.611 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.041 2.389 -4.942 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.982 1.976 -3.045 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -11.391 3.180 -1.819 1.00 0.00 H new ATOM 1283 N THR A 83 -6.008 1.723 -5.309 1.00 0.00 N ATOM 1284 CA THR A 83 -5.435 0.553 -5.965 1.00 0.00 C ATOM 1285 C THR A 83 -4.913 -0.448 -4.940 1.00 0.00 C ATOM 1286 O THR A 83 -4.993 -1.660 -5.144 1.00 0.00 O ATOM 1287 CB THR A 83 -4.303 0.975 -6.904 1.00 0.00 C ATOM 1288 OG1 THR A 83 -4.666 2.130 -7.640 1.00 0.00 O ATOM 1289 CG2 THR A 83 -3.918 -0.101 -7.898 1.00 0.00 C ATOM 0 H THR A 83 -5.557 2.605 -5.551 1.00 0.00 H new ATOM 0 HA THR A 83 -6.222 0.072 -6.545 1.00 0.00 H new ATOM 0 HB THR A 83 -3.449 1.172 -6.257 1.00 0.00 H new ATOM 0 HG1 THR A 83 -4.142 2.896 -7.326 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.110 0.263 -8.533 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.586 -0.990 -7.362 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.781 -0.351 -8.515 1.00 0.00 H new ATOM 1297 N LEU A 84 -4.379 0.065 -3.836 1.00 0.00 N ATOM 1298 CA LEU A 84 -3.842 -0.785 -2.780 1.00 0.00 C ATOM 1299 C LEU A 84 -4.962 -1.513 -2.042 1.00 0.00 C ATOM 1300 O LEU A 84 -4.772 -2.622 -1.545 1.00 0.00 O ATOM 1301 CB LEU A 84 -3.023 0.048 -1.791 1.00 0.00 C ATOM 1302 CG LEU A 84 -2.451 -0.731 -0.606 1.00 0.00 C ATOM 1303 CD1 LEU A 84 -1.112 -1.352 -0.972 1.00 0.00 C ATOM 1304 CD2 LEU A 84 -2.305 0.176 0.607 1.00 0.00 C ATOM 0 H LEU A 84 -4.307 1.065 -3.650 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.194 -1.528 -3.244 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.199 0.517 -2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.652 0.852 -1.408 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.144 -1.534 -0.355 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.720 -1.902 -0.117 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -1.245 -2.034 -1.812 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.410 -0.566 -1.250 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.897 -0.395 1.441 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.632 0.999 0.367 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.281 0.574 0.883 1.00 0.00 H new ATOM 1316 N LEU A 85 -6.130 -0.882 -1.975 1.00 0.00 N ATOM 1317 CA LEU A 85 -7.279 -1.471 -1.296 1.00 0.00 C ATOM 1318 C LEU A 85 -8.039 -2.413 -2.223 1.00 0.00 C ATOM 1319 O LEU A 85 -8.655 -3.379 -1.772 1.00 0.00 O ATOM 1320 CB LEU A 85 -8.214 -0.373 -0.787 1.00 0.00 C ATOM 1321 CG LEU A 85 -7.649 0.486 0.346 1.00 0.00 C ATOM 1322 CD1 LEU A 85 -8.199 1.903 0.266 1.00 0.00 C ATOM 1323 CD2 LEU A 85 -7.970 -0.137 1.695 1.00 0.00 C ATOM 0 H LEU A 85 -6.306 0.036 -2.382 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.910 -2.048 -0.448 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.473 0.278 -1.622 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.140 -0.835 -0.445 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.565 0.532 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.787 2.500 1.079 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.920 2.348 -0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.285 1.877 0.350 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.561 0.486 2.490 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.051 -0.213 1.813 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -7.528 -1.132 1.751 1.00 0.00 H new ATOM 1335 N ASP A 86 -7.995 -2.126 -3.520 1.00 0.00 N ATOM 1336 CA ASP A 86 -8.683 -2.948 -4.509 1.00 0.00 C ATOM 1337 C ASP A 86 -7.878 -4.203 -4.831 1.00 0.00 C ATOM 1338 O ASP A 86 -8.439 -5.290 -4.981 1.00 0.00 O ATOM 1339 CB ASP A 86 -8.930 -2.144 -5.787 1.00 0.00 C ATOM 1340 CG ASP A 86 -10.316 -1.530 -5.824 1.00 0.00 C ATOM 1341 OD1 ASP A 86 -10.551 -0.549 -5.087 1.00 0.00 O ATOM 1342 OD2 ASP A 86 -11.167 -2.030 -6.589 1.00 0.00 O ATOM 0 H ASP A 86 -7.490 -1.330 -3.911 1.00 0.00 H new ATOM 0 HA ASP A 86 -9.641 -3.253 -4.088 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.183 -1.354 -5.866 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.800 -2.793 -6.653 1.00 0.00 H new ATOM 1347 N SER A 87 -6.564 -4.047 -4.939 1.00 0.00 N ATOM 1348 CA SER A 87 -5.683 -5.169 -5.246 1.00 0.00 C ATOM 1349 C SER A 87 -5.793 -6.260 -4.185 1.00 0.00 C ATOM 1350 O SER A 87 -5.755 -7.449 -4.497 1.00 0.00 O ATOM 1351 CB SER A 87 -4.234 -4.692 -5.353 1.00 0.00 C ATOM 1352 OG SER A 87 -3.483 -5.526 -6.217 1.00 0.00 O ATOM 0 H SER A 87 -6.084 -3.155 -4.819 1.00 0.00 H new ATOM 0 HA SER A 87 -5.994 -5.588 -6.203 1.00 0.00 H new ATOM 0 HB2 SER A 87 -4.212 -3.667 -5.723 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.777 -4.684 -4.363 1.00 0.00 H new ATOM 0 HG SER A 87 -2.561 -5.198 -6.269 1.00 0.00 H new ATOM 1358 N VAL A 88 -5.929 -5.846 -2.929 1.00 0.00 N ATOM 1359 CA VAL A 88 -6.043 -6.787 -1.822 1.00 0.00 C ATOM 1360 C VAL A 88 -7.308 -7.634 -1.942 1.00 0.00 C ATOM 1361 O VAL A 88 -7.350 -8.771 -1.475 1.00 0.00 O ATOM 1362 CB VAL A 88 -6.051 -6.061 -0.464 1.00 0.00 C ATOM 1363 CG1 VAL A 88 -6.021 -7.062 0.682 1.00 0.00 C ATOM 1364 CG2 VAL A 88 -4.879 -5.095 -0.366 1.00 0.00 C ATOM 0 H VAL A 88 -5.963 -4.865 -2.653 1.00 0.00 H new ATOM 0 HA VAL A 88 -5.170 -7.437 -1.873 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.974 -5.487 -0.389 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -6.027 -6.528 1.632 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.897 -7.708 0.624 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -5.118 -7.668 0.612 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.902 -4.592 0.601 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.944 -5.646 -0.466 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.950 -4.354 -1.162 1.00 0.00 H new ATOM 1374 N TYR A 89 -8.336 -7.070 -2.569 1.00 0.00 N ATOM 1375 CA TYR A 89 -9.601 -7.776 -2.746 1.00 0.00 C ATOM 1376 C TYR A 89 -9.685 -8.412 -4.130 1.00 0.00 C ATOM 1377 O TYR A 89 -10.359 -9.425 -4.317 1.00 0.00 O ATOM 1378 CB TYR A 89 -10.775 -6.817 -2.541 1.00 0.00 C ATOM 1379 CG TYR A 89 -11.038 -6.481 -1.091 1.00 0.00 C ATOM 1380 CD1 TYR A 89 -11.349 -7.476 -0.173 1.00 0.00 C ATOM 1381 CD2 TYR A 89 -10.975 -5.168 -0.639 1.00 0.00 C ATOM 1382 CE1 TYR A 89 -11.590 -7.174 1.154 1.00 0.00 C ATOM 1383 CE2 TYR A 89 -11.214 -4.857 0.686 1.00 0.00 C ATOM 1384 CZ TYR A 89 -11.521 -5.863 1.578 1.00 0.00 C ATOM 1385 OH TYR A 89 -11.761 -5.557 2.898 1.00 0.00 O ATOM 0 H TYR A 89 -8.318 -6.129 -2.962 1.00 0.00 H new ATOM 0 HA TYR A 89 -9.652 -8.569 -2.000 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -10.580 -5.895 -3.089 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -11.674 -7.259 -2.971 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -11.403 -8.503 -0.502 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -10.735 -4.378 -1.335 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -11.831 -7.960 1.855 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -11.161 -3.832 1.021 1.00 0.00 H new ATOM 0 HH TYR A 89 -11.671 -4.590 3.031 1.00 0.00 H new ATOM 1395 N SER A 90 -9.001 -7.810 -5.097 1.00 0.00 N ATOM 1396 CA SER A 90 -9.001 -8.319 -6.463 1.00 0.00 C ATOM 1397 C SER A 90 -8.122 -9.560 -6.587 1.00 0.00 C ATOM 1398 O SER A 90 -8.384 -10.438 -7.408 1.00 0.00 O ATOM 1399 CB SER A 90 -8.516 -7.238 -7.432 1.00 0.00 C ATOM 1400 OG SER A 90 -9.216 -7.303 -8.662 1.00 0.00 O ATOM 0 H SER A 90 -8.440 -6.969 -4.960 1.00 0.00 H new ATOM 0 HA SER A 90 -10.024 -8.596 -6.718 1.00 0.00 H new ATOM 0 HB2 SER A 90 -8.654 -6.254 -6.983 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.448 -7.359 -7.611 1.00 0.00 H new ATOM 0 HG SER A 90 -8.888 -6.601 -9.262 1.00 0.00 H new ATOM 1406 N HIS A 91 -7.077 -9.624 -5.768 1.00 0.00 N ATOM 1407 CA HIS A 91 -6.159 -10.758 -5.789 1.00 0.00 C ATOM 1408 C HIS A 91 -6.610 -11.844 -4.817 1.00 0.00 C ATOM 1409 O HIS A 91 -6.437 -13.034 -5.078 1.00 0.00 O ATOM 1410 CB HIS A 91 -4.744 -10.299 -5.439 1.00 0.00 C ATOM 1411 CG HIS A 91 -3.964 -9.811 -6.620 1.00 0.00 C ATOM 1412 ND1 HIS A 91 -3.947 -10.442 -7.844 1.00 0.00 N ATOM 1413 CD2 HIS A 91 -3.161 -8.724 -6.749 1.00 0.00 C ATOM 1414 CE1 HIS A 91 -3.152 -9.737 -8.660 1.00 0.00 C ATOM 1415 NE2 HIS A 91 -2.650 -8.684 -8.043 1.00 0.00 N ATOM 0 H HIS A 91 -6.845 -8.905 -5.082 1.00 0.00 H new ATOM 0 HA HIS A 91 -6.160 -11.176 -6.796 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.802 -9.502 -4.698 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -4.207 -11.126 -4.976 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -4.451 -11.295 -8.086 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.952 -8.005 -5.971 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -2.949 -9.997 -9.688 1.00 0.00 H new ATOM 1423 N LEU A 92 -7.186 -11.427 -3.694 1.00 0.00 N ATOM 1424 CA LEU A 92 -7.659 -12.365 -2.683 1.00 0.00 C ATOM 1425 C LEU A 92 -9.185 -12.386 -2.626 1.00 0.00 C ATOM 1426 O LEU A 92 -9.796 -11.631 -1.870 1.00 0.00 O ATOM 1427 CB LEU A 92 -7.092 -11.995 -1.311 1.00 0.00 C ATOM 1428 CG LEU A 92 -5.572 -12.127 -1.181 1.00 0.00 C ATOM 1429 CD1 LEU A 92 -4.975 -10.869 -0.568 1.00 0.00 C ATOM 1430 CD2 LEU A 92 -5.209 -13.349 -0.350 1.00 0.00 C ATOM 0 H LEU A 92 -7.336 -10.445 -3.461 1.00 0.00 H new ATOM 0 HA LEU A 92 -7.311 -13.361 -2.958 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -7.373 -10.967 -1.084 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -7.562 -12.627 -0.558 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.154 -12.254 -2.180 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.894 -10.983 -0.484 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -5.202 -10.012 -1.203 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.401 -10.709 0.423 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.125 -13.425 -0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -5.641 -13.253 0.646 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -5.601 -14.245 -0.831 1.00 0.00 H new ATOM 1442 N PRO A 93 -9.823 -13.258 -3.427 1.00 0.00 N ATOM 1443 CA PRO A 93 -11.285 -13.372 -3.462 1.00 0.00 C ATOM 1444 C PRO A 93 -11.847 -13.986 -2.184 1.00 0.00 C ATOM 1445 O PRO A 93 -12.993 -13.732 -1.814 1.00 0.00 O ATOM 1446 CB PRO A 93 -11.541 -14.293 -4.656 1.00 0.00 C ATOM 1447 CG PRO A 93 -10.297 -15.101 -4.786 1.00 0.00 C ATOM 1448 CD PRO A 93 -9.172 -14.197 -4.360 1.00 0.00 C ATOM 0 HA PRO A 93 -11.769 -12.399 -3.547 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.410 -14.929 -4.486 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.737 -13.720 -5.562 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -10.342 -15.991 -4.158 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -10.158 -15.441 -5.812 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -8.370 -14.754 -3.875 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -8.730 -13.677 -5.210 1.00 0.00 H new ATOM 1456 N ASP A 94 -11.033 -14.796 -1.514 1.00 0.00 N ATOM 1457 CA ASP A 94 -11.450 -15.447 -0.277 1.00 0.00 C ATOM 1458 C ASP A 94 -11.810 -14.416 0.787 1.00 0.00 C ATOM 1459 O ASP A 94 -12.758 -14.603 1.552 1.00 0.00 O ATOM 1460 CB ASP A 94 -10.341 -16.365 0.240 1.00 0.00 C ATOM 1461 CG ASP A 94 -10.204 -17.628 -0.586 1.00 0.00 C ATOM 1462 OD1 ASP A 94 -11.203 -18.367 -0.712 1.00 0.00 O ATOM 1463 OD2 ASP A 94 -9.097 -17.879 -1.107 1.00 0.00 O ATOM 0 H ASP A 94 -10.081 -15.017 -1.807 1.00 0.00 H new ATOM 0 HA ASP A 94 -12.336 -16.044 -0.492 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -9.394 -15.825 0.233 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -10.548 -16.633 1.276 1.00 0.00 H new ATOM 1468 N LEU A 95 -11.048 -13.328 0.833 1.00 0.00 N ATOM 1469 CA LEU A 95 -11.287 -12.267 1.804 1.00 0.00 C ATOM 1470 C LEU A 95 -12.692 -11.693 1.651 1.00 0.00 C ATOM 1471 O LEU A 95 -13.308 -11.265 2.627 1.00 0.00 O ATOM 1472 CB LEU A 95 -10.249 -11.155 1.641 1.00 0.00 C ATOM 1473 CG LEU A 95 -8.801 -11.577 1.898 1.00 0.00 C ATOM 1474 CD1 LEU A 95 -7.869 -10.380 1.786 1.00 0.00 C ATOM 1475 CD2 LEU A 95 -8.671 -12.231 3.267 1.00 0.00 C ATOM 0 H LEU A 95 -10.259 -13.158 0.209 1.00 0.00 H new ATOM 0 HA LEU A 95 -11.197 -12.696 2.802 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.321 -10.757 0.629 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.500 -10.342 2.322 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.515 -12.307 1.140 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -6.843 -10.699 1.972 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.941 -9.955 0.785 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -8.154 -9.627 2.521 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -7.635 -12.525 3.433 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.976 -11.524 4.038 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.310 -13.113 3.311 1.00 0.00 H new ATOM 1487 N LEU A 96 -13.192 -11.688 0.419 1.00 0.00 N ATOM 1488 CA LEU A 96 -14.525 -11.167 0.139 1.00 0.00 C ATOM 1489 C LEU A 96 -15.601 -12.105 0.675 1.00 0.00 C ATOM 1490 O LEU A 96 -15.327 -13.263 0.992 1.00 0.00 O ATOM 1491 CB LEU A 96 -14.711 -10.968 -1.367 1.00 0.00 C ATOM 1492 CG LEU A 96 -13.725 -9.996 -2.019 1.00 0.00 C ATOM 1493 CD1 LEU A 96 -13.363 -10.463 -3.420 1.00 0.00 C ATOM 1494 CD2 LEU A 96 -14.309 -8.593 -2.057 1.00 0.00 C ATOM 0 H LEU A 96 -12.695 -12.038 -0.400 1.00 0.00 H new ATOM 0 HA LEU A 96 -14.624 -10.205 0.642 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -14.622 -11.936 -1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -15.724 -10.610 -1.548 1.00 0.00 H new ATOM 0 HG LEU A 96 -12.815 -9.974 -1.420 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -12.661 -9.760 -3.868 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -12.904 -11.450 -3.367 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -14.264 -10.515 -4.031 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -13.595 -7.914 -2.524 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -15.234 -8.599 -2.634 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -14.517 -8.258 -1.041 1.00 0.00 H new ATOM 1506 N SER A 97 -16.825 -11.597 0.776 1.00 0.00 N ATOM 1507 CA SER A 97 -17.943 -12.390 1.275 1.00 0.00 C ATOM 1508 C SER A 97 -19.275 -11.751 0.895 1.00 0.00 C ATOM 1509 O SER A 97 -20.200 -12.435 0.455 1.00 0.00 O ATOM 1510 CB SER A 97 -17.851 -12.541 2.794 1.00 0.00 C ATOM 1511 OG SER A 97 -17.114 -13.698 3.148 1.00 0.00 O ATOM 0 H SER A 97 -17.068 -10.640 0.519 1.00 0.00 H new ATOM 0 HA SER A 97 -17.890 -13.377 0.816 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.376 -11.658 3.222 1.00 0.00 H new ATOM 0 HB3 SER A 97 -18.853 -12.601 3.218 1.00 0.00 H new ATOM 0 HG SER A 97 -16.368 -13.815 2.523 1.00 0.00 H new ATOM 1517 N GLY A 98 -19.367 -10.437 1.068 1.00 0.00 N ATOM 1518 CA GLY A 98 -20.590 -9.729 0.740 1.00 0.00 C ATOM 1519 C GLY A 98 -20.378 -8.231 0.611 1.00 0.00 C ATOM 1520 O GLY A 98 -21.052 -7.448 1.280 1.00 0.00 O ATOM 0 H GLY A 98 -18.616 -9.849 1.430 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -20.991 -10.118 -0.196 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -21.336 -9.922 1.511 1.00 0.00 H new ATOM 1524 N PRO A 99 -19.440 -7.800 -0.249 1.00 0.00 N ATOM 1525 CA PRO A 99 -19.150 -6.377 -0.454 1.00 0.00 C ATOM 1526 C PRO A 99 -20.278 -5.654 -1.181 1.00 0.00 C ATOM 1527 O PRO A 99 -20.806 -6.148 -2.178 1.00 0.00 O ATOM 1528 CB PRO A 99 -17.884 -6.391 -1.313 1.00 0.00 C ATOM 1529 CG PRO A 99 -17.928 -7.696 -2.030 1.00 0.00 C ATOM 1530 CD PRO A 99 -18.588 -8.665 -1.088 1.00 0.00 C ATOM 0 HA PRO A 99 -19.034 -5.846 0.491 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -17.871 -5.555 -2.012 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -16.988 -6.307 -0.699 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -18.490 -7.611 -2.960 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -16.925 -8.030 -2.294 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -19.176 -9.410 -1.624 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -17.855 -9.208 -0.491 1.00 0.00 H new ATOM 1538 N SER A 100 -20.645 -4.480 -0.677 1.00 0.00 N ATOM 1539 CA SER A 100 -21.711 -3.687 -1.280 1.00 0.00 C ATOM 1540 C SER A 100 -21.140 -2.477 -2.010 1.00 0.00 C ATOM 1541 O SER A 100 -20.455 -1.645 -1.414 1.00 0.00 O ATOM 1542 CB SER A 100 -22.703 -3.230 -0.209 1.00 0.00 C ATOM 1543 OG SER A 100 -22.145 -2.212 0.603 1.00 0.00 O ATOM 0 H SER A 100 -20.220 -4.056 0.148 1.00 0.00 H new ATOM 0 HA SER A 100 -22.232 -4.314 -2.004 1.00 0.00 H new ATOM 0 HB2 SER A 100 -23.612 -2.862 -0.685 1.00 0.00 H new ATOM 0 HB3 SER A 100 -22.989 -4.079 0.412 1.00 0.00 H new ATOM 0 HG SER A 100 -21.294 -1.916 0.218 1.00 0.00 H new ATOM 1549 N SER A 101 -21.429 -2.383 -3.305 1.00 0.00 N ATOM 1550 CA SER A 101 -20.944 -1.273 -4.117 1.00 0.00 C ATOM 1551 C SER A 101 -21.980 -0.868 -5.159 1.00 0.00 C ATOM 1552 O SER A 101 -22.636 -1.719 -5.761 1.00 0.00 O ATOM 1553 CB SER A 101 -19.632 -1.653 -4.806 1.00 0.00 C ATOM 1554 OG SER A 101 -19.126 -0.574 -5.572 1.00 0.00 O ATOM 0 H SER A 101 -21.996 -3.062 -3.813 1.00 0.00 H new ATOM 0 HA SER A 101 -20.767 -0.423 -3.458 1.00 0.00 H new ATOM 0 HB2 SER A 101 -18.897 -1.948 -4.057 1.00 0.00 H new ATOM 0 HB3 SER A 101 -19.793 -2.517 -5.451 1.00 0.00 H new ATOM 0 HG SER A 101 -18.286 -0.842 -6.000 1.00 0.00 H new ATOM 1560 N GLY A 102 -22.123 0.437 -5.369 1.00 0.00 N ATOM 1561 CA GLY A 102 -23.082 0.932 -6.339 1.00 0.00 C ATOM 1562 C GLY A 102 -22.445 1.839 -7.374 1.00 0.00 C ATOM 1563 O GLY A 102 -23.160 2.280 -8.298 1.00 0.00 O ATOM 1564 OXT GLY A 102 -21.231 2.110 -7.259 1.00 0.00 O ATOM 0 H GLY A 102 -21.592 1.160 -4.884 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -23.554 0.088 -6.842 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -23.871 1.476 -5.820 1.00 0.00 H new TER 1568 GLY A 102