USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 770 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 28 LYS NZ :NH3+ -161:sc= 0.277 (180deg=0) USER MOD Set 1.2: B 51 SER OG : rot 180:sc= 0.248 USER MOD Set 2.1: A 34 HIS : no HD1:sc= -0.0819 X(o=-2.8,f=-3.2) USER MOD Set 2.2: A 39 MET CE :methyl 169:sc= -1.44! (180deg=-1.59!) USER MOD Set 2.3: B 39 MET CE :methyl 159:sc= -1.25 (180deg=-1.48!) USER MOD Set 3.1: B 23 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: B 27 GLN : amide:sc= -0.096 X(o=-0.096,f=-0.31) USER MOD Set 4.1: B 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.2: B 21 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: B 8 GLN : amide:sc= 0 X(o=0.31,f=0.3) USER MOD Set 5.2: B 11 SER OG : rot 90:sc= 0.31 USER MOD Set 6.1: A 51 SER OG : rot 180:sc= 0 USER MOD Set 6.2: B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.1: A 23 TYR OH : rot 180:sc= 0 USER MOD Set 7.2: A 27 GLN : amide:sc= -0.0278 X(o=-0.028,f=0.044) USER MOD Set 8.1: A 8 GLN : amide:sc= 0 X(o=0.18,f=0.18) USER MOD Set 8.2: A 11 SER OG : rot 97:sc= 0.184 USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.137 (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 10 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -160:sc= 0 (180deg=-0.444) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 TYR OH : rot -57:sc= 1.08 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.001) USER MOD Single : A 36 ASN : amide:sc= -0.161 K(o=-0.16,f=-8.3!) USER MOD Single : A 41 LYS NZ :NH3+ -146:sc= 1.26 (180deg=0.656) USER MOD Single : A 42 ASN : amide:sc= 1.11 K(o=1.1,f=-0.00067) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 5 SER OG : rot 180:sc= 0.036 USER MOD Single : B 6 SER OG : rot 180:sc= 0 USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 17 MET CE :methyl -123:sc= -0.139 (180deg=-0.173) USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD Single : B 22 SER OG : rot 180:sc=-0.00222 USER MOD Single : B 24 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : B 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 35 ASN : amide:sc=-0.00661 K(o=-0.0066,f=-1.2) USER MOD Single : B 36 ASN : amide:sc= 0.143 K(o=0.14,f=-7.6!) USER MOD Single : B 41 LYS NZ :NH3+ -149:sc= 1.25 (180deg=0.501) USER MOD Single : B 42 ASN : amide:sc= 0.933 K(o=0.93,f=0) USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.184 18.255 -11.194 1.00 0.00 N ATOM 2 CA GLY A 1 -12.592 17.952 -10.912 1.00 0.00 C ATOM 3 C GLY A 1 -12.684 16.985 -9.755 1.00 0.00 C ATOM 4 O GLY A 1 -11.706 16.813 -9.030 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.031 19.282 -11.133 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.579 17.773 -10.499 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.943 17.925 -12.150 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.131 18.869 -10.675 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.065 17.523 -11.795 1.00 0.00 H new ATOM 8 N SER A 2 -13.852 16.371 -9.568 1.00 0.00 N ATOM 9 CA SER A 2 -14.084 15.421 -8.496 1.00 0.00 C ATOM 10 C SER A 2 -13.100 14.256 -8.642 1.00 0.00 C ATOM 11 O SER A 2 -13.041 13.619 -9.703 1.00 0.00 O ATOM 12 CB SER A 2 -15.551 14.966 -8.508 1.00 0.00 C ATOM 13 OG SER A 2 -15.910 14.323 -7.299 1.00 0.00 O ATOM 0 H SER A 2 -14.666 16.524 -10.164 1.00 0.00 H new ATOM 0 HA SER A 2 -13.908 15.884 -7.525 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.198 15.828 -8.667 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.714 14.286 -9.344 1.00 0.00 H new ATOM 0 HG SER A 2 -16.850 14.049 -7.341 1.00 0.00 H new ATOM 19 N SER A 3 -12.307 14.020 -7.601 1.00 0.00 N ATOM 20 CA SER A 3 -11.313 12.959 -7.543 1.00 0.00 C ATOM 21 C SER A 3 -11.350 12.193 -6.217 1.00 0.00 C ATOM 22 O SER A 3 -10.590 11.234 -6.068 1.00 0.00 O ATOM 23 CB SER A 3 -9.923 13.552 -7.810 1.00 0.00 C ATOM 24 OG SER A 3 -9.584 14.578 -6.894 1.00 0.00 O ATOM 0 H SER A 3 -12.341 14.581 -6.750 1.00 0.00 H new ATOM 0 HA SER A 3 -11.549 12.228 -8.317 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.177 12.759 -7.755 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.890 13.950 -8.824 1.00 0.00 H new ATOM 0 HG SER A 3 -8.691 14.922 -7.104 1.00 0.00 H new ATOM 30 N GLY A 4 -12.199 12.580 -5.258 1.00 0.00 N ATOM 31 CA GLY A 4 -12.266 11.894 -3.982 1.00 0.00 C ATOM 32 C GLY A 4 -13.508 12.258 -3.188 1.00 0.00 C ATOM 33 O GLY A 4 -13.942 13.416 -3.190 1.00 0.00 O ATOM 0 H GLY A 4 -12.844 13.364 -5.350 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.250 10.817 -4.151 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.380 12.138 -3.396 1.00 0.00 H new ATOM 37 N SER A 5 -14.089 11.265 -2.522 1.00 0.00 N ATOM 38 CA SER A 5 -15.283 11.430 -1.704 1.00 0.00 C ATOM 39 C SER A 5 -14.919 12.031 -0.339 1.00 0.00 C ATOM 40 O SER A 5 -13.745 12.089 0.030 1.00 0.00 O ATOM 41 CB SER A 5 -15.966 10.064 -1.564 1.00 0.00 C ATOM 42 OG SER A 5 -16.124 9.465 -2.840 1.00 0.00 O ATOM 0 H SER A 5 -13.737 10.308 -2.537 1.00 0.00 H new ATOM 0 HA SER A 5 -15.976 12.124 -2.179 1.00 0.00 H new ATOM 0 HB2 SER A 5 -15.371 9.416 -0.920 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.939 10.182 -1.086 1.00 0.00 H new ATOM 0 HG SER A 5 -16.559 8.593 -2.740 1.00 0.00 H new ATOM 48 N SER A 6 -15.915 12.479 0.422 1.00 0.00 N ATOM 49 CA SER A 6 -15.748 13.071 1.745 1.00 0.00 C ATOM 50 C SER A 6 -16.958 12.726 2.614 1.00 0.00 C ATOM 51 O SER A 6 -17.912 12.087 2.149 1.00 0.00 O ATOM 52 CB SER A 6 -15.516 14.585 1.615 1.00 0.00 C ATOM 53 OG SER A 6 -14.168 14.891 1.917 1.00 0.00 O ATOM 0 H SER A 6 -16.890 12.438 0.125 1.00 0.00 H new ATOM 0 HA SER A 6 -14.868 12.659 2.238 1.00 0.00 H new ATOM 0 HB2 SER A 6 -15.755 14.913 0.604 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.181 15.123 2.290 1.00 0.00 H new ATOM 0 HG SER A 6 -14.025 15.857 1.831 1.00 0.00 H new ATOM 59 N GLY A 7 -16.943 13.159 3.872 1.00 0.00 N ATOM 60 CA GLY A 7 -17.999 12.888 4.826 1.00 0.00 C ATOM 61 C GLY A 7 -17.827 11.431 5.225 1.00 0.00 C ATOM 62 O GLY A 7 -16.876 11.109 5.938 1.00 0.00 O ATOM 0 H GLY A 7 -16.181 13.717 4.257 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.921 13.544 5.693 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.980 13.060 4.384 1.00 0.00 H new ATOM 66 N GLN A 8 -18.704 10.552 4.744 1.00 0.00 N ATOM 67 CA GLN A 8 -18.642 9.134 5.041 1.00 0.00 C ATOM 68 C GLN A 8 -17.716 8.449 4.031 1.00 0.00 C ATOM 69 O GLN A 8 -17.994 8.452 2.828 1.00 0.00 O ATOM 70 CB GLN A 8 -20.063 8.550 5.029 1.00 0.00 C ATOM 71 CG GLN A 8 -20.105 7.110 5.557 1.00 0.00 C ATOM 72 CD GLN A 8 -21.540 6.679 5.846 1.00 0.00 C ATOM 73 OE1 GLN A 8 -22.294 6.280 4.961 1.00 0.00 O ATOM 74 NE2 GLN A 8 -21.973 6.801 7.088 1.00 0.00 N ATOM 0 H GLN A 8 -19.480 10.811 4.134 1.00 0.00 H new ATOM 0 HA GLN A 8 -18.228 8.962 6.035 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -20.716 9.177 5.636 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -20.454 8.573 4.012 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -19.659 6.437 4.825 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -19.508 7.034 6.466 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -21.342 7.133 7.818 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -22.938 6.564 7.317 1.00 0.00 H new ATOM 83 N LEU A 9 -16.599 7.895 4.516 1.00 0.00 N ATOM 84 CA LEU A 9 -15.609 7.169 3.708 1.00 0.00 C ATOM 85 C LEU A 9 -15.947 5.669 3.731 1.00 0.00 C ATOM 86 O LEU A 9 -15.488 4.919 2.870 1.00 0.00 O ATOM 87 CB LEU A 9 -14.203 7.422 4.283 1.00 0.00 C ATOM 88 CG LEU A 9 -13.071 7.399 3.242 1.00 0.00 C ATOM 89 CD1 LEU A 9 -13.108 8.651 2.352 1.00 0.00 C ATOM 90 CD2 LEU A 9 -11.722 7.347 3.974 1.00 0.00 C ATOM 0 H LEU A 9 -16.351 7.939 5.504 1.00 0.00 H new ATOM 0 HA LEU A 9 -15.631 7.518 2.676 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -14.199 8.390 4.784 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -13.995 6.669 5.043 1.00 0.00 H new ATOM 0 HG LEU A 9 -13.202 6.521 2.609 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -12.296 8.606 1.626 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -14.062 8.696 1.827 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -12.992 9.541 2.971 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -10.912 7.330 3.244 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -11.619 8.226 4.610 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -11.676 6.448 4.588 1.00 0.00 H new ATOM 102 N SER A 10 -16.756 5.221 4.704 1.00 0.00 N ATOM 103 CA SER A 10 -17.191 3.834 4.847 1.00 0.00 C ATOM 104 C SER A 10 -17.900 3.353 3.580 1.00 0.00 C ATOM 105 O SER A 10 -17.760 2.187 3.207 1.00 0.00 O ATOM 106 CB SER A 10 -18.143 3.715 6.037 1.00 0.00 C ATOM 107 OG SER A 10 -17.447 3.941 7.247 1.00 0.00 O ATOM 0 H SER A 10 -17.132 5.833 5.428 1.00 0.00 H new ATOM 0 HA SER A 10 -16.311 3.212 5.012 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.954 4.436 5.936 1.00 0.00 H new ATOM 0 HB3 SER A 10 -18.597 2.724 6.050 1.00 0.00 H new ATOM 0 HG SER A 10 -18.068 3.864 8.001 1.00 0.00 H new ATOM 113 N SER A 11 -18.533 4.272 2.849 1.00 0.00 N ATOM 114 CA SER A 11 -19.259 4.028 1.620 1.00 0.00 C ATOM 115 C SER A 11 -18.377 3.471 0.500 1.00 0.00 C ATOM 116 O SER A 11 -18.902 3.083 -0.540 1.00 0.00 O ATOM 117 CB SER A 11 -19.940 5.326 1.180 1.00 0.00 C ATOM 118 OG SER A 11 -20.200 6.202 2.269 1.00 0.00 O ATOM 0 H SER A 11 -18.549 5.255 3.120 1.00 0.00 H new ATOM 0 HA SER A 11 -20.005 3.259 1.821 1.00 0.00 H new ATOM 0 HB2 SER A 11 -19.308 5.835 0.452 1.00 0.00 H new ATOM 0 HB3 SER A 11 -20.878 5.088 0.678 1.00 0.00 H new ATOM 0 HG SER A 11 -19.482 6.866 2.333 1.00 0.00 H new ATOM 124 N GLU A 12 -17.055 3.441 0.687 1.00 0.00 N ATOM 125 CA GLU A 12 -16.069 2.924 -0.247 1.00 0.00 C ATOM 126 C GLU A 12 -15.449 1.643 0.340 1.00 0.00 C ATOM 127 O GLU A 12 -14.995 0.788 -0.418 1.00 0.00 O ATOM 128 CB GLU A 12 -15.043 4.018 -0.565 1.00 0.00 C ATOM 129 CG GLU A 12 -15.631 5.172 -1.400 1.00 0.00 C ATOM 130 CD GLU A 12 -15.950 4.785 -2.857 1.00 0.00 C ATOM 131 OE1 GLU A 12 -15.547 3.693 -3.306 1.00 0.00 O ATOM 132 OE2 GLU A 12 -16.611 5.562 -3.590 1.00 0.00 O ATOM 0 H GLU A 12 -16.628 3.797 1.542 1.00 0.00 H new ATOM 0 HA GLU A 12 -16.527 2.648 -1.197 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.646 4.418 0.368 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -14.205 3.577 -1.105 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.543 5.527 -0.920 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -14.926 6.004 -1.401 1.00 0.00 H new ATOM 139 N ILE A 13 -15.438 1.482 1.673 1.00 0.00 N ATOM 140 CA ILE A 13 -14.923 0.295 2.364 1.00 0.00 C ATOM 141 C ILE A 13 -15.889 -0.840 2.000 1.00 0.00 C ATOM 142 O ILE A 13 -15.462 -1.924 1.606 1.00 0.00 O ATOM 143 CB ILE A 13 -14.843 0.520 3.902 1.00 0.00 C ATOM 144 CG1 ILE A 13 -13.858 1.664 4.239 1.00 0.00 C ATOM 145 CG2 ILE A 13 -14.445 -0.757 4.672 1.00 0.00 C ATOM 146 CD1 ILE A 13 -13.685 1.937 5.743 1.00 0.00 C ATOM 0 H ILE A 13 -15.796 2.192 2.312 1.00 0.00 H new ATOM 0 HA ILE A 13 -13.904 0.060 2.057 1.00 0.00 H new ATOM 0 HB ILE A 13 -15.847 0.797 4.225 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -12.884 1.425 3.812 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.203 2.577 3.754 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -14.405 -0.541 5.740 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -15.183 -1.538 4.487 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -13.466 -1.096 4.334 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -12.977 2.754 5.886 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.647 2.211 6.176 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -13.308 1.040 6.235 1.00 0.00 H new ATOM 158 N GLU A 14 -17.199 -0.575 2.068 1.00 0.00 N ATOM 159 CA GLU A 14 -18.237 -1.547 1.743 1.00 0.00 C ATOM 160 C GLU A 14 -18.113 -2.033 0.293 1.00 0.00 C ATOM 161 O GLU A 14 -18.503 -3.159 -0.021 1.00 0.00 O ATOM 162 CB GLU A 14 -19.625 -0.921 1.971 1.00 0.00 C ATOM 163 CG GLU A 14 -19.928 -0.685 3.464 1.00 0.00 C ATOM 164 CD GLU A 14 -21.313 -1.185 3.899 1.00 0.00 C ATOM 165 OE1 GLU A 14 -22.276 -1.103 3.101 1.00 0.00 O ATOM 166 OE2 GLU A 14 -21.418 -1.685 5.047 1.00 0.00 O ATOM 0 H GLU A 14 -17.567 0.332 2.354 1.00 0.00 H new ATOM 0 HA GLU A 14 -18.113 -2.409 2.398 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.684 0.027 1.437 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.388 -1.574 1.547 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -19.167 -1.184 4.063 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.853 0.381 3.677 1.00 0.00 H new ATOM 173 N ARG A 15 -17.582 -1.199 -0.605 1.00 0.00 N ATOM 174 CA ARG A 15 -17.403 -1.530 -2.018 1.00 0.00 C ATOM 175 C ARG A 15 -16.227 -2.464 -2.198 1.00 0.00 C ATOM 176 O ARG A 15 -16.286 -3.358 -3.037 1.00 0.00 O ATOM 177 CB ARG A 15 -17.154 -0.271 -2.850 1.00 0.00 C ATOM 178 CG ARG A 15 -18.269 0.749 -2.652 1.00 0.00 C ATOM 179 CD ARG A 15 -18.037 1.963 -3.548 1.00 0.00 C ATOM 180 NE ARG A 15 -19.023 2.016 -4.623 1.00 0.00 N ATOM 181 CZ ARG A 15 -19.419 3.121 -5.247 1.00 0.00 C ATOM 182 NH1 ARG A 15 -18.798 4.285 -5.053 1.00 0.00 N ATOM 183 NH2 ARG A 15 -20.463 3.048 -6.059 1.00 0.00 N ATOM 0 H ARG A 15 -17.260 -0.261 -0.366 1.00 0.00 H new ATOM 0 HA ARG A 15 -18.319 -2.014 -2.358 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -16.198 0.171 -2.568 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -17.084 -0.537 -3.905 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -19.233 0.295 -2.884 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -18.306 1.060 -1.608 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -18.093 2.875 -2.953 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -17.034 1.920 -3.972 1.00 0.00 H new ATOM 0 HE ARG A 15 -19.442 1.134 -4.919 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -18.003 4.339 -4.416 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -19.118 5.121 -5.542 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -20.943 2.158 -6.194 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -20.787 3.882 -6.550 1.00 0.00 H new ATOM 197 N LEU A 16 -15.154 -2.256 -1.438 1.00 0.00 N ATOM 198 CA LEU A 16 -13.970 -3.097 -1.515 1.00 0.00 C ATOM 199 C LEU A 16 -14.350 -4.526 -1.122 1.00 0.00 C ATOM 200 O LEU A 16 -13.893 -5.472 -1.761 1.00 0.00 O ATOM 201 CB LEU A 16 -12.862 -2.500 -0.636 1.00 0.00 C ATOM 202 CG LEU A 16 -12.142 -1.334 -1.344 1.00 0.00 C ATOM 203 CD1 LEU A 16 -11.586 -0.324 -0.338 1.00 0.00 C ATOM 204 CD2 LEU A 16 -11.009 -1.881 -2.215 1.00 0.00 C ATOM 0 H LEU A 16 -15.084 -1.502 -0.755 1.00 0.00 H new ATOM 0 HA LEU A 16 -13.578 -3.135 -2.531 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -13.291 -2.148 0.302 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -12.139 -3.276 -0.384 1.00 0.00 H new ATOM 0 HG LEU A 16 -12.870 -0.816 -1.969 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -11.085 0.484 -0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -12.403 0.085 0.256 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -10.873 -0.821 0.320 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.502 -1.055 -2.714 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.297 -2.419 -1.590 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.420 -2.559 -2.963 1.00 0.00 H new ATOM 216 N MET A 17 -15.224 -4.699 -0.121 1.00 0.00 N ATOM 217 CA MET A 17 -15.656 -6.032 0.303 1.00 0.00 C ATOM 218 C MET A 17 -16.344 -6.786 -0.848 1.00 0.00 C ATOM 219 O MET A 17 -16.271 -8.012 -0.890 1.00 0.00 O ATOM 220 CB MET A 17 -16.613 -5.952 1.505 1.00 0.00 C ATOM 221 CG MET A 17 -15.995 -5.283 2.736 1.00 0.00 C ATOM 222 SD MET A 17 -16.990 -5.477 4.241 1.00 0.00 S ATOM 223 CE MET A 17 -16.323 -4.131 5.252 1.00 0.00 C ATOM 0 H MET A 17 -15.643 -3.933 0.407 1.00 0.00 H new ATOM 0 HA MET A 17 -14.761 -6.578 0.600 1.00 0.00 H new ATOM 0 HB2 MET A 17 -17.506 -5.400 1.212 1.00 0.00 H new ATOM 0 HB3 MET A 17 -16.934 -6.959 1.771 1.00 0.00 H new ATOM 0 HG2 MET A 17 -15.004 -5.703 2.909 1.00 0.00 H new ATOM 0 HG3 MET A 17 -15.861 -4.220 2.533 1.00 0.00 H new ATOM 0 HE1 MET A 17 -16.551 -4.317 6.302 1.00 0.00 H new ATOM 0 HE2 MET A 17 -15.242 -4.078 5.120 1.00 0.00 H new ATOM 0 HE3 MET A 17 -16.773 -3.187 4.944 1.00 0.00 H new ATOM 233 N SER A 18 -16.984 -6.070 -1.779 1.00 0.00 N ATOM 234 CA SER A 18 -17.688 -6.636 -2.923 1.00 0.00 C ATOM 235 C SER A 18 -16.739 -7.414 -3.835 1.00 0.00 C ATOM 236 O SER A 18 -17.078 -8.517 -4.270 1.00 0.00 O ATOM 237 CB SER A 18 -18.390 -5.500 -3.682 1.00 0.00 C ATOM 238 OG SER A 18 -19.360 -5.977 -4.587 1.00 0.00 O ATOM 0 H SER A 18 -17.025 -5.051 -1.752 1.00 0.00 H new ATOM 0 HA SER A 18 -18.433 -7.349 -2.571 1.00 0.00 H new ATOM 0 HB2 SER A 18 -18.864 -4.828 -2.967 1.00 0.00 H new ATOM 0 HB3 SER A 18 -17.647 -4.916 -4.225 1.00 0.00 H new ATOM 0 HG SER A 18 -19.781 -5.220 -5.045 1.00 0.00 H new ATOM 244 N GLN A 19 -15.553 -6.869 -4.131 1.00 0.00 N ATOM 245 CA GLN A 19 -14.609 -7.557 -5.006 1.00 0.00 C ATOM 246 C GLN A 19 -14.055 -8.841 -4.379 1.00 0.00 C ATOM 247 O GLN A 19 -13.656 -9.728 -5.137 1.00 0.00 O ATOM 248 CB GLN A 19 -13.463 -6.627 -5.432 1.00 0.00 C ATOM 249 CG GLN A 19 -13.925 -5.488 -6.354 1.00 0.00 C ATOM 250 CD GLN A 19 -12.872 -5.197 -7.421 1.00 0.00 C ATOM 251 OE1 GLN A 19 -12.791 -5.895 -8.425 1.00 0.00 O ATOM 252 NE2 GLN A 19 -12.046 -4.177 -7.262 1.00 0.00 N ATOM 0 H GLN A 19 -15.231 -5.966 -3.781 1.00 0.00 H new ATOM 0 HA GLN A 19 -15.169 -7.847 -5.895 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -12.998 -6.201 -4.543 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -12.698 -7.212 -5.942 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -14.867 -5.758 -6.830 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -14.111 -4.590 -5.765 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -12.110 -3.594 -6.428 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -11.344 -3.973 -7.974 1.00 0.00 H new ATOM 261 N GLY A 20 -14.078 -8.958 -3.045 1.00 0.00 N ATOM 262 CA GLY A 20 -13.581 -10.114 -2.307 1.00 0.00 C ATOM 263 C GLY A 20 -12.543 -9.748 -1.241 1.00 0.00 C ATOM 264 O GLY A 20 -11.835 -10.642 -0.769 1.00 0.00 O ATOM 0 H GLY A 20 -14.454 -8.229 -2.438 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -14.420 -10.620 -1.829 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -13.139 -10.822 -3.008 1.00 0.00 H new ATOM 268 N TYR A 21 -12.389 -8.463 -0.891 1.00 0.00 N ATOM 269 CA TYR A 21 -11.442 -7.998 0.118 1.00 0.00 C ATOM 270 C TYR A 21 -12.039 -8.137 1.524 1.00 0.00 C ATOM 271 O TYR A 21 -13.201 -8.527 1.669 1.00 0.00 O ATOM 272 CB TYR A 21 -11.036 -6.562 -0.223 1.00 0.00 C ATOM 273 CG TYR A 21 -10.294 -6.411 -1.543 1.00 0.00 C ATOM 274 CD1 TYR A 21 -9.235 -7.282 -1.881 1.00 0.00 C ATOM 275 CD2 TYR A 21 -10.635 -5.368 -2.422 1.00 0.00 C ATOM 276 CE1 TYR A 21 -8.482 -7.060 -3.045 1.00 0.00 C ATOM 277 CE2 TYR A 21 -9.900 -5.149 -3.599 1.00 0.00 C ATOM 278 CZ TYR A 21 -8.798 -5.979 -3.895 1.00 0.00 C ATOM 279 OH TYR A 21 -8.035 -5.737 -4.991 1.00 0.00 O ATOM 0 H TYR A 21 -12.931 -7.709 -1.312 1.00 0.00 H new ATOM 0 HA TYR A 21 -10.543 -8.614 0.115 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -11.932 -5.942 -0.252 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -10.407 -6.176 0.579 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -9.004 -8.121 -1.242 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -11.473 -4.727 -2.189 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -7.661 -7.717 -3.290 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -10.176 -4.351 -4.272 1.00 0.00 H new ATOM 0 HH TYR A 21 -7.102 -5.609 -4.719 1.00 0.00 H new ATOM 289 N SER A 22 -11.279 -7.811 2.571 1.00 0.00 N ATOM 290 CA SER A 22 -11.718 -7.927 3.953 1.00 0.00 C ATOM 291 C SER A 22 -11.515 -6.621 4.699 1.00 0.00 C ATOM 292 O SER A 22 -10.584 -5.868 4.425 1.00 0.00 O ATOM 293 CB SER A 22 -10.882 -9.034 4.594 1.00 0.00 C ATOM 294 OG SER A 22 -11.447 -9.575 5.765 1.00 0.00 O ATOM 0 H SER A 22 -10.328 -7.454 2.476 1.00 0.00 H new ATOM 0 HA SER A 22 -12.782 -8.161 3.995 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.741 -9.835 3.868 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.894 -8.639 4.829 1.00 0.00 H new ATOM 0 HG SER A 22 -10.860 -10.276 6.118 1.00 0.00 H new ATOM 300 N TYR A 23 -12.337 -6.386 5.719 1.00 0.00 N ATOM 301 CA TYR A 23 -12.261 -5.185 6.533 1.00 0.00 C ATOM 302 C TYR A 23 -10.846 -4.974 7.090 1.00 0.00 C ATOM 303 O TYR A 23 -10.382 -3.838 7.135 1.00 0.00 O ATOM 304 CB TYR A 23 -13.323 -5.266 7.633 1.00 0.00 C ATOM 305 CG TYR A 23 -13.384 -4.035 8.504 1.00 0.00 C ATOM 306 CD1 TYR A 23 -13.675 -2.783 7.936 1.00 0.00 C ATOM 307 CD2 TYR A 23 -13.121 -4.139 9.880 1.00 0.00 C ATOM 308 CE1 TYR A 23 -13.693 -1.630 8.735 1.00 0.00 C ATOM 309 CE2 TYR A 23 -13.130 -2.991 10.684 1.00 0.00 C ATOM 310 CZ TYR A 23 -13.415 -1.730 10.120 1.00 0.00 C ATOM 311 OH TYR A 23 -13.399 -0.628 10.916 1.00 0.00 O ATOM 0 H TYR A 23 -13.076 -7.029 6.002 1.00 0.00 H new ATOM 0 HA TYR A 23 -12.468 -4.309 5.918 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -14.299 -5.425 7.174 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -13.120 -6.135 8.259 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -13.886 -2.708 6.879 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -12.912 -5.104 10.318 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -13.918 -0.670 8.295 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -12.918 -3.072 11.740 1.00 0.00 H new ATOM 0 HH TYR A 23 -13.191 -0.892 11.836 1.00 0.00 H new ATOM 321 N GLN A 24 -10.145 -6.048 7.478 1.00 0.00 N ATOM 322 CA GLN A 24 -8.786 -5.966 8.009 1.00 0.00 C ATOM 323 C GLN A 24 -7.832 -5.355 6.976 1.00 0.00 C ATOM 324 O GLN A 24 -7.224 -4.319 7.240 1.00 0.00 O ATOM 325 CB GLN A 24 -8.272 -7.352 8.431 1.00 0.00 C ATOM 326 CG GLN A 24 -8.984 -7.930 9.662 1.00 0.00 C ATOM 327 CD GLN A 24 -8.291 -9.202 10.148 1.00 0.00 C ATOM 328 OE1 GLN A 24 -7.067 -9.277 10.218 1.00 0.00 O ATOM 329 NE2 GLN A 24 -9.023 -10.245 10.484 1.00 0.00 N ATOM 0 H GLN A 24 -10.510 -6.999 7.430 1.00 0.00 H new ATOM 0 HA GLN A 24 -8.817 -5.322 8.888 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -8.392 -8.043 7.596 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -7.204 -7.285 8.639 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -8.995 -7.189 10.462 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -10.023 -8.149 9.416 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -10.040 -10.193 10.429 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.572 -11.104 10.799 1.00 0.00 H new ATOM 338 N ASP A 25 -7.665 -6.011 5.822 1.00 0.00 N ATOM 339 CA ASP A 25 -6.791 -5.546 4.743 1.00 0.00 C ATOM 340 C ASP A 25 -7.203 -4.134 4.316 1.00 0.00 C ATOM 341 O ASP A 25 -6.347 -3.251 4.291 1.00 0.00 O ATOM 342 CB ASP A 25 -6.677 -6.562 3.591 1.00 0.00 C ATOM 343 CG ASP A 25 -7.981 -7.125 3.043 1.00 0.00 C ATOM 344 OD1 ASP A 25 -8.701 -6.393 2.331 1.00 0.00 O ATOM 345 OD2 ASP A 25 -8.264 -8.319 3.264 1.00 0.00 O ATOM 0 H ASP A 25 -8.139 -6.889 5.610 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.770 -5.475 5.117 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -6.140 -6.086 2.770 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -6.063 -7.396 3.932 1.00 0.00 H new ATOM 350 N ILE A 26 -8.492 -3.851 4.099 1.00 0.00 N ATOM 351 CA ILE A 26 -8.948 -2.512 3.704 1.00 0.00 C ATOM 352 C ILE A 26 -8.443 -1.464 4.712 1.00 0.00 C ATOM 353 O ILE A 26 -7.888 -0.433 4.318 1.00 0.00 O ATOM 354 CB ILE A 26 -10.489 -2.465 3.561 1.00 0.00 C ATOM 355 CG1 ILE A 26 -11.013 -3.411 2.456 1.00 0.00 C ATOM 356 CG2 ILE A 26 -10.933 -1.020 3.248 1.00 0.00 C ATOM 357 CD1 ILE A 26 -12.499 -3.763 2.643 1.00 0.00 C ATOM 0 H ILE A 26 -9.243 -4.535 4.191 1.00 0.00 H new ATOM 0 HA ILE A 26 -8.528 -2.276 2.726 1.00 0.00 H new ATOM 0 HB ILE A 26 -10.912 -2.802 4.507 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -10.873 -2.941 1.483 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -10.422 -4.327 2.455 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -12.018 -0.986 3.147 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -10.623 -0.361 4.059 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -10.472 -0.691 2.317 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -12.819 -4.429 1.842 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -12.637 -4.258 3.604 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -13.095 -2.851 2.616 1.00 0.00 H new ATOM 369 N GLN A 27 -8.626 -1.717 6.009 1.00 0.00 N ATOM 370 CA GLN A 27 -8.210 -0.813 7.069 1.00 0.00 C ATOM 371 C GLN A 27 -6.690 -0.653 7.123 1.00 0.00 C ATOM 372 O GLN A 27 -6.224 0.465 7.365 1.00 0.00 O ATOM 373 CB GLN A 27 -8.796 -1.292 8.399 1.00 0.00 C ATOM 374 CG GLN A 27 -10.307 -1.017 8.450 1.00 0.00 C ATOM 375 CD GLN A 27 -10.612 0.436 8.799 1.00 0.00 C ATOM 376 OE1 GLN A 27 -10.684 1.316 7.944 1.00 0.00 O ATOM 377 NE2 GLN A 27 -10.766 0.730 10.077 1.00 0.00 N ATOM 0 H GLN A 27 -9.073 -2.567 6.351 1.00 0.00 H new ATOM 0 HA GLN A 27 -8.600 0.183 6.859 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -8.610 -2.359 8.522 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -8.300 -0.784 9.226 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -10.752 -1.259 7.485 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -10.770 -1.672 9.188 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -10.705 -0.006 10.781 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -10.946 1.693 10.361 1.00 0.00 H new ATOM 386 N LYS A 28 -5.906 -1.718 6.915 1.00 0.00 N ATOM 387 CA LYS A 28 -4.443 -1.608 6.928 1.00 0.00 C ATOM 388 C LYS A 28 -4.034 -0.652 5.804 1.00 0.00 C ATOM 389 O LYS A 28 -3.187 0.217 6.013 1.00 0.00 O ATOM 390 CB LYS A 28 -3.773 -2.987 6.751 1.00 0.00 C ATOM 391 CG LYS A 28 -3.824 -3.878 8.007 1.00 0.00 C ATOM 392 CD LYS A 28 -3.176 -5.242 7.729 1.00 0.00 C ATOM 393 CE LYS A 28 -3.042 -6.106 8.987 1.00 0.00 C ATOM 394 NZ LYS A 28 -2.314 -7.363 8.707 1.00 0.00 N ATOM 0 H LYS A 28 -6.257 -2.659 6.737 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.111 -1.221 7.891 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -4.257 -3.511 5.927 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -2.731 -2.839 6.466 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -3.307 -3.385 8.830 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -4.859 -4.018 8.318 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.771 -5.777 6.989 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.189 -5.088 7.294 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -2.517 -5.545 9.761 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.033 -6.338 9.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -2.512 -8.054 9.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.625 -7.748 7.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -1.292 -7.172 8.673 1.00 0.00 H new ATOM 408 N ALA A 29 -4.643 -0.763 4.617 1.00 0.00 N ATOM 409 CA ALA A 29 -4.311 0.133 3.516 1.00 0.00 C ATOM 410 C ALA A 29 -4.721 1.561 3.868 1.00 0.00 C ATOM 411 O ALA A 29 -3.932 2.474 3.653 1.00 0.00 O ATOM 412 CB ALA A 29 -4.979 -0.295 2.211 1.00 0.00 C ATOM 0 H ALA A 29 -5.359 -1.457 4.401 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.233 0.086 3.364 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -4.705 0.400 1.417 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -4.648 -1.299 1.945 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -6.062 -0.292 2.338 1.00 0.00 H new ATOM 418 N LEU A 30 -5.915 1.774 4.436 1.00 0.00 N ATOM 419 CA LEU A 30 -6.391 3.110 4.791 1.00 0.00 C ATOM 420 C LEU A 30 -5.522 3.805 5.830 1.00 0.00 C ATOM 421 O LEU A 30 -5.456 5.035 5.800 1.00 0.00 O ATOM 422 CB LEU A 30 -7.846 3.085 5.287 1.00 0.00 C ATOM 423 CG LEU A 30 -8.889 3.128 4.159 1.00 0.00 C ATOM 424 CD1 LEU A 30 -10.272 2.801 4.727 1.00 0.00 C ATOM 425 CD2 LEU A 30 -8.944 4.519 3.508 1.00 0.00 C ATOM 0 H LEU A 30 -6.572 1.027 4.660 1.00 0.00 H new ATOM 0 HA LEU A 30 -6.330 3.684 3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -8.002 2.183 5.879 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.008 3.934 5.951 1.00 0.00 H new ATOM 0 HG LEU A 30 -8.601 2.395 3.406 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -11.011 2.832 3.926 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -10.257 1.805 5.169 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.534 3.533 5.491 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -9.690 4.520 2.714 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -9.213 5.262 4.259 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -7.968 4.763 3.089 1.00 0.00 H new ATOM 437 N VAL A 31 -4.900 3.085 6.766 1.00 0.00 N ATOM 438 CA VAL A 31 -4.061 3.745 7.763 1.00 0.00 C ATOM 439 C VAL A 31 -2.721 4.130 7.137 1.00 0.00 C ATOM 440 O VAL A 31 -2.318 5.290 7.233 1.00 0.00 O ATOM 441 CB VAL A 31 -3.996 2.921 9.063 1.00 0.00 C ATOM 442 CG1 VAL A 31 -3.198 1.619 9.020 1.00 0.00 C ATOM 443 CG2 VAL A 31 -3.455 3.750 10.227 1.00 0.00 C ATOM 0 H VAL A 31 -4.959 2.070 6.853 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.504 4.689 8.082 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.040 2.639 9.201 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.233 1.138 9.998 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.629 0.953 8.273 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.162 1.836 8.759 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -3.423 3.136 11.127 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.450 4.098 9.990 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.106 4.608 10.396 1.00 0.00 H new ATOM 453 N ILE A 32 -2.088 3.200 6.417 1.00 0.00 N ATOM 454 CA ILE A 32 -0.803 3.442 5.773 1.00 0.00 C ATOM 455 C ILE A 32 -0.973 4.517 4.688 1.00 0.00 C ATOM 456 O ILE A 32 -0.065 5.309 4.470 1.00 0.00 O ATOM 457 CB ILE A 32 -0.235 2.105 5.246 1.00 0.00 C ATOM 458 CG1 ILE A 32 -0.025 1.062 6.382 1.00 0.00 C ATOM 459 CG2 ILE A 32 1.095 2.369 4.525 1.00 0.00 C ATOM 460 CD1 ILE A 32 0.223 -0.395 5.958 1.00 0.00 C ATOM 0 H ILE A 32 -2.455 2.260 6.267 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.072 3.830 6.482 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.964 1.683 4.554 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.821 1.387 6.987 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.904 1.082 7.026 1.00 0.00 H new ATOM 0 HG21 ILE A 32 1.499 1.428 4.152 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.927 3.049 3.690 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.804 2.817 5.221 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.353 -1.015 6.845 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.630 -0.757 5.384 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.122 -0.447 5.344 1.00 0.00 H new ATOM 472 N ALA A 33 -2.132 4.588 4.022 1.00 0.00 N ATOM 473 CA ALA A 33 -2.416 5.571 2.985 1.00 0.00 C ATOM 474 C ALA A 33 -2.769 6.940 3.584 1.00 0.00 C ATOM 475 O ALA A 33 -3.162 7.837 2.838 1.00 0.00 O ATOM 476 CB ALA A 33 -3.543 5.076 2.078 1.00 0.00 C ATOM 0 H ALA A 33 -2.908 3.950 4.196 1.00 0.00 H new ATOM 0 HA ALA A 33 -1.512 5.696 2.389 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -3.744 5.821 1.308 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.246 4.139 1.607 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -4.443 4.915 2.671 1.00 0.00 H new ATOM 482 N HIS A 34 -2.663 7.124 4.904 1.00 0.00 N ATOM 483 CA HIS A 34 -2.975 8.356 5.620 1.00 0.00 C ATOM 484 C HIS A 34 -4.422 8.777 5.310 1.00 0.00 C ATOM 485 O HIS A 34 -4.680 9.912 4.910 1.00 0.00 O ATOM 486 CB HIS A 34 -1.929 9.460 5.341 1.00 0.00 C ATOM 487 CG HIS A 34 -0.468 9.116 5.562 1.00 0.00 C ATOM 488 ND1 HIS A 34 0.592 9.913 5.185 1.00 0.00 N ATOM 489 CD2 HIS A 34 0.059 8.015 6.191 1.00 0.00 C ATOM 490 CE1 HIS A 34 1.724 9.317 5.585 1.00 0.00 C ATOM 491 NE2 HIS A 34 1.452 8.155 6.202 1.00 0.00 N ATOM 0 H HIS A 34 -2.343 6.382 5.526 1.00 0.00 H new ATOM 0 HA HIS A 34 -2.913 8.180 6.694 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -2.046 9.779 4.305 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -2.171 10.318 5.968 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -0.501 7.189 6.603 1.00 0.00 H new ATOM 0 HE1 HIS A 34 2.716 9.715 5.433 1.00 0.00 H new ATOM 0 HE2 HIS A 34 2.128 7.503 6.600 1.00 0.00 H new ATOM 499 N ASN A 35 -5.366 7.843 5.477 1.00 0.00 N ATOM 500 CA ASN A 35 -6.813 7.981 5.256 1.00 0.00 C ATOM 501 C ASN A 35 -7.182 8.256 3.790 1.00 0.00 C ATOM 502 O ASN A 35 -8.307 8.666 3.506 1.00 0.00 O ATOM 503 CB ASN A 35 -7.449 9.010 6.218 1.00 0.00 C ATOM 504 CG ASN A 35 -7.353 8.603 7.681 1.00 0.00 C ATOM 505 OD1 ASN A 35 -6.294 8.692 8.298 1.00 0.00 O ATOM 506 ND2 ASN A 35 -8.434 8.154 8.294 1.00 0.00 N ATOM 0 H ASN A 35 -5.123 6.904 5.792 1.00 0.00 H new ATOM 0 HA ASN A 35 -7.244 7.008 5.491 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -6.959 9.974 6.083 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -8.498 9.145 5.953 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -8.388 7.883 9.276 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.315 8.079 7.785 1.00 0.00 H new ATOM 513 N ASN A 36 -6.270 8.062 2.833 1.00 0.00 N ATOM 514 CA ASN A 36 -6.559 8.295 1.419 1.00 0.00 C ATOM 515 C ASN A 36 -7.192 7.039 0.826 1.00 0.00 C ATOM 516 O ASN A 36 -6.495 6.051 0.590 1.00 0.00 O ATOM 517 CB ASN A 36 -5.285 8.702 0.677 1.00 0.00 C ATOM 518 CG ASN A 36 -5.546 9.112 -0.767 1.00 0.00 C ATOM 519 OD1 ASN A 36 -6.450 8.614 -1.428 1.00 0.00 O ATOM 520 ND2 ASN A 36 -4.728 9.997 -1.301 1.00 0.00 N ATOM 0 H ASN A 36 -5.319 7.742 3.016 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.266 9.117 1.312 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -4.812 9.530 1.205 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -4.580 7.870 0.692 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -4.843 10.275 -2.276 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -3.980 10.404 -0.740 1.00 0.00 H new ATOM 527 N ILE A 37 -8.509 7.057 0.611 1.00 0.00 N ATOM 528 CA ILE A 37 -9.260 5.932 0.053 1.00 0.00 C ATOM 529 C ILE A 37 -8.785 5.573 -1.366 1.00 0.00 C ATOM 530 O ILE A 37 -8.744 4.393 -1.703 1.00 0.00 O ATOM 531 CB ILE A 37 -10.780 6.228 0.143 1.00 0.00 C ATOM 532 CG1 ILE A 37 -11.687 5.060 -0.291 1.00 0.00 C ATOM 533 CG2 ILE A 37 -11.181 7.466 -0.665 1.00 0.00 C ATOM 534 CD1 ILE A 37 -11.849 3.970 0.772 1.00 0.00 C ATOM 0 H ILE A 37 -9.092 7.866 0.823 1.00 0.00 H new ATOM 0 HA ILE A 37 -9.066 5.039 0.647 1.00 0.00 H new ATOM 0 HB ILE A 37 -10.939 6.400 1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -12.671 5.453 -0.547 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -11.277 4.612 -1.196 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -12.254 7.631 -0.570 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.645 8.337 -0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -10.929 7.313 -1.714 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -12.501 3.184 0.391 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -10.873 3.548 1.012 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -12.288 4.401 1.671 1.00 0.00 H new ATOM 546 N GLU A 38 -8.436 6.550 -2.210 1.00 0.00 N ATOM 547 CA GLU A 38 -7.978 6.294 -3.581 1.00 0.00 C ATOM 548 C GLU A 38 -6.641 5.554 -3.532 1.00 0.00 C ATOM 549 O GLU A 38 -6.474 4.503 -4.154 1.00 0.00 O ATOM 550 CB GLU A 38 -7.821 7.588 -4.403 1.00 0.00 C ATOM 551 CG GLU A 38 -8.971 8.596 -4.307 1.00 0.00 C ATOM 552 CD GLU A 38 -10.369 8.060 -4.621 1.00 0.00 C ATOM 553 OE1 GLU A 38 -10.564 7.322 -5.621 1.00 0.00 O ATOM 554 OE2 GLU A 38 -11.307 8.442 -3.888 1.00 0.00 O ATOM 0 H GLU A 38 -8.463 7.539 -1.963 1.00 0.00 H new ATOM 0 HA GLU A 38 -8.737 5.688 -4.075 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.903 8.085 -4.088 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -7.692 7.315 -5.450 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.981 9.009 -3.298 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.760 9.422 -4.987 1.00 0.00 H new ATOM 561 N MET A 39 -5.688 6.101 -2.775 1.00 0.00 N ATOM 562 CA MET A 39 -4.354 5.542 -2.587 1.00 0.00 C ATOM 563 C MET A 39 -4.519 4.132 -2.025 1.00 0.00 C ATOM 564 O MET A 39 -3.945 3.185 -2.557 1.00 0.00 O ATOM 565 CB MET A 39 -3.577 6.477 -1.657 1.00 0.00 C ATOM 566 CG MET A 39 -2.067 6.273 -1.510 1.00 0.00 C ATOM 567 SD MET A 39 -1.356 7.624 -0.500 1.00 0.00 S ATOM 568 CE MET A 39 0.299 7.963 -1.193 1.00 0.00 C ATOM 0 H MET A 39 -5.831 6.971 -2.262 1.00 0.00 H new ATOM 0 HA MET A 39 -3.789 5.465 -3.516 1.00 0.00 H new ATOM 0 HB2 MET A 39 -3.741 7.498 -2.001 1.00 0.00 H new ATOM 0 HB3 MET A 39 -4.020 6.400 -0.664 1.00 0.00 H new ATOM 0 HG2 MET A 39 -1.865 5.310 -1.041 1.00 0.00 H new ATOM 0 HG3 MET A 39 -1.596 6.254 -2.493 1.00 0.00 H new ATOM 0 HE1 MET A 39 0.692 8.884 -0.762 1.00 0.00 H new ATOM 0 HE2 MET A 39 0.969 7.136 -0.956 1.00 0.00 H new ATOM 0 HE3 MET A 39 0.225 8.072 -2.275 1.00 0.00 H new ATOM 578 N ALA A 40 -5.366 3.969 -1.004 1.00 0.00 N ATOM 579 CA ALA A 40 -5.621 2.682 -0.389 1.00 0.00 C ATOM 580 C ALA A 40 -6.173 1.697 -1.424 1.00 0.00 C ATOM 581 O ALA A 40 -5.708 0.563 -1.478 1.00 0.00 O ATOM 582 CB ALA A 40 -6.576 2.837 0.798 1.00 0.00 C ATOM 0 H ALA A 40 -5.892 4.736 -0.586 1.00 0.00 H new ATOM 0 HA ALA A 40 -4.681 2.279 -0.011 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.757 1.861 1.249 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.131 3.502 1.538 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.520 3.258 0.453 1.00 0.00 H new ATOM 588 N LYS A 41 -7.135 2.094 -2.267 1.00 0.00 N ATOM 589 CA LYS A 41 -7.696 1.211 -3.298 1.00 0.00 C ATOM 590 C LYS A 41 -6.585 0.709 -4.213 1.00 0.00 C ATOM 591 O LYS A 41 -6.636 -0.452 -4.621 1.00 0.00 O ATOM 592 CB LYS A 41 -8.783 1.929 -4.111 1.00 0.00 C ATOM 593 CG LYS A 41 -10.123 1.960 -3.369 1.00 0.00 C ATOM 594 CD LYS A 41 -11.007 3.090 -3.895 1.00 0.00 C ATOM 595 CE LYS A 41 -12.385 3.049 -3.230 1.00 0.00 C ATOM 596 NZ LYS A 41 -13.376 2.294 -4.018 1.00 0.00 N ATOM 0 H LYS A 41 -7.544 3.028 -2.254 1.00 0.00 H new ATOM 0 HA LYS A 41 -8.161 0.358 -2.804 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.463 2.949 -4.325 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.910 1.427 -5.070 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.634 1.005 -3.491 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -9.950 2.094 -2.301 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.532 4.051 -3.701 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -11.116 3.001 -4.976 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.293 2.598 -2.242 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.744 4.068 -3.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.314 2.727 -3.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -13.108 2.313 -5.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -13.406 1.309 -3.686 1.00 0.00 H new ATOM 610 N ASN A 42 -5.596 1.551 -4.531 1.00 0.00 N ATOM 611 CA ASN A 42 -4.476 1.154 -5.380 1.00 0.00 C ATOM 612 C ASN A 42 -3.670 0.077 -4.653 1.00 0.00 C ATOM 613 O ASN A 42 -3.306 -0.916 -5.273 1.00 0.00 O ATOM 614 CB ASN A 42 -3.580 2.338 -5.778 1.00 0.00 C ATOM 615 CG ASN A 42 -4.184 3.190 -6.881 1.00 0.00 C ATOM 616 OD1 ASN A 42 -3.808 3.071 -8.042 1.00 0.00 O ATOM 617 ND2 ASN A 42 -5.127 4.059 -6.565 1.00 0.00 N ATOM 0 H ASN A 42 -5.552 2.518 -4.209 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.877 0.759 -6.313 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.399 2.961 -4.902 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.612 1.960 -6.106 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -5.550 4.639 -7.290 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -5.433 4.150 -5.596 1.00 0.00 H new ATOM 624 N ILE A 43 -3.400 0.237 -3.350 1.00 0.00 N ATOM 625 CA ILE A 43 -2.652 -0.743 -2.552 1.00 0.00 C ATOM 626 C ILE A 43 -3.395 -2.077 -2.601 1.00 0.00 C ATOM 627 O ILE A 43 -2.832 -3.109 -2.965 1.00 0.00 O ATOM 628 CB ILE A 43 -2.468 -0.267 -1.088 1.00 0.00 C ATOM 629 CG1 ILE A 43 -1.697 1.066 -1.035 1.00 0.00 C ATOM 630 CG2 ILE A 43 -1.757 -1.354 -0.265 1.00 0.00 C ATOM 631 CD1 ILE A 43 -1.578 1.702 0.352 1.00 0.00 C ATOM 0 H ILE A 43 -3.696 1.055 -2.817 1.00 0.00 H new ATOM 0 HA ILE A 43 -1.653 -0.858 -2.972 1.00 0.00 H new ATOM 0 HB ILE A 43 -3.452 -0.094 -0.651 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.694 0.901 -1.428 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.187 1.776 -1.701 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.633 -1.010 0.762 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.355 -2.265 -0.272 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.779 -1.558 -0.700 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.018 2.634 0.278 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.574 1.907 0.745 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -1.057 1.018 1.022 1.00 0.00 H new ATOM 643 N LEU A 44 -4.683 -2.048 -2.260 1.00 0.00 N ATOM 644 CA LEU A 44 -5.546 -3.220 -2.233 1.00 0.00 C ATOM 645 C LEU A 44 -5.576 -3.896 -3.613 1.00 0.00 C ATOM 646 O LEU A 44 -5.740 -5.109 -3.696 1.00 0.00 O ATOM 647 CB LEU A 44 -6.941 -2.821 -1.704 1.00 0.00 C ATOM 648 CG LEU A 44 -6.897 -2.193 -0.285 1.00 0.00 C ATOM 649 CD1 LEU A 44 -8.169 -1.405 0.032 1.00 0.00 C ATOM 650 CD2 LEU A 44 -6.678 -3.204 0.838 1.00 0.00 C ATOM 0 H LEU A 44 -5.162 -1.189 -1.990 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.151 -3.967 -1.545 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.396 -2.111 -2.395 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.582 -3.703 -1.685 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.034 -1.529 -0.320 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.095 -0.983 1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.288 -0.600 -0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -9.031 -2.070 -0.019 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -6.660 -2.685 1.796 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.489 -3.932 0.835 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.729 -3.717 0.685 1.00 0.00 H new ATOM 662 N ARG A 45 -5.394 -3.151 -4.706 1.00 0.00 N ATOM 663 CA ARG A 45 -5.383 -3.690 -6.059 1.00 0.00 C ATOM 664 C ARG A 45 -4.051 -4.365 -6.374 1.00 0.00 C ATOM 665 O ARG A 45 -4.010 -5.571 -6.580 1.00 0.00 O ATOM 666 CB ARG A 45 -5.677 -2.561 -7.059 1.00 0.00 C ATOM 667 CG ARG A 45 -5.871 -3.072 -8.490 1.00 0.00 C ATOM 668 CD ARG A 45 -6.227 -1.873 -9.370 1.00 0.00 C ATOM 669 NE ARG A 45 -6.842 -2.267 -10.643 1.00 0.00 N ATOM 670 CZ ARG A 45 -7.673 -1.517 -11.372 1.00 0.00 C ATOM 671 NH1 ARG A 45 -8.038 -0.309 -10.951 1.00 0.00 N ATOM 672 NH2 ARG A 45 -8.144 -1.959 -12.529 1.00 0.00 N ATOM 0 H ARG A 45 -5.248 -2.142 -4.670 1.00 0.00 H new ATOM 0 HA ARG A 45 -6.158 -4.452 -6.142 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -6.573 -2.027 -6.744 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.856 -1.844 -7.042 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -4.962 -3.554 -8.850 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -6.663 -3.820 -8.525 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -6.911 -1.220 -8.828 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -5.325 -1.294 -9.571 1.00 0.00 H new ATOM 0 HE ARG A 45 -6.615 -3.194 -11.002 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -7.683 0.051 -10.065 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -8.673 0.257 -11.514 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -7.873 -2.881 -12.871 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -8.778 -1.378 -13.077 1.00 0.00 H new ATOM 686 N GLU A 46 -2.965 -3.602 -6.378 1.00 0.00 N ATOM 687 CA GLU A 46 -1.635 -4.088 -6.714 1.00 0.00 C ATOM 688 C GLU A 46 -1.061 -5.125 -5.748 1.00 0.00 C ATOM 689 O GLU A 46 -0.255 -5.954 -6.182 1.00 0.00 O ATOM 690 CB GLU A 46 -0.675 -2.895 -6.825 1.00 0.00 C ATOM 691 CG GLU A 46 -1.119 -1.801 -7.814 1.00 0.00 C ATOM 692 CD GLU A 46 -1.399 -2.329 -9.220 1.00 0.00 C ATOM 693 OE1 GLU A 46 -0.433 -2.756 -9.894 1.00 0.00 O ATOM 694 OE2 GLU A 46 -2.566 -2.272 -9.671 1.00 0.00 O ATOM 0 H GLU A 46 -2.986 -2.610 -6.143 1.00 0.00 H new ATOM 0 HA GLU A 46 -1.740 -4.609 -7.666 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.558 -2.447 -5.838 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.306 -3.262 -7.127 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -2.018 -1.318 -7.430 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -0.345 -1.036 -7.869 1.00 0.00 H new ATOM 701 N PHE A 47 -1.464 -5.120 -4.471 1.00 0.00 N ATOM 702 CA PHE A 47 -0.954 -6.063 -3.479 1.00 0.00 C ATOM 703 C PHE A 47 -1.968 -7.111 -3.069 1.00 0.00 C ATOM 704 O PHE A 47 -1.669 -8.308 -3.095 1.00 0.00 O ATOM 705 CB PHE A 47 -0.431 -5.345 -2.235 1.00 0.00 C ATOM 706 CG PHE A 47 0.885 -4.679 -2.521 1.00 0.00 C ATOM 707 CD1 PHE A 47 2.071 -5.419 -2.368 1.00 0.00 C ATOM 708 CD2 PHE A 47 0.915 -3.380 -3.056 1.00 0.00 C ATOM 709 CE1 PHE A 47 3.291 -4.866 -2.779 1.00 0.00 C ATOM 710 CE2 PHE A 47 2.134 -2.836 -3.479 1.00 0.00 C ATOM 711 CZ PHE A 47 3.315 -3.583 -3.348 1.00 0.00 C ATOM 0 H PHE A 47 -2.151 -4.463 -4.102 1.00 0.00 H new ATOM 0 HA PHE A 47 -0.130 -6.579 -3.973 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -1.157 -4.601 -1.906 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -0.314 -6.059 -1.419 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.042 -6.408 -1.936 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.004 -2.805 -3.140 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.208 -5.424 -2.659 1.00 0.00 H new ATOM 0 HE2 PHE A 47 2.165 -1.844 -3.905 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.252 -3.167 -3.688 1.00 0.00 H new ATOM 721 N SER A 48 -3.144 -6.668 -2.639 1.00 0.00 N ATOM 722 CA SER A 48 -4.169 -7.602 -2.212 1.00 0.00 C ATOM 723 C SER A 48 -4.858 -8.266 -3.410 1.00 0.00 C ATOM 724 O SER A 48 -5.612 -9.216 -3.213 1.00 0.00 O ATOM 725 CB SER A 48 -5.142 -6.883 -1.282 1.00 0.00 C ATOM 726 OG SER A 48 -5.573 -7.708 -0.226 1.00 0.00 O ATOM 0 H SER A 48 -3.405 -5.684 -2.579 1.00 0.00 H new ATOM 0 HA SER A 48 -3.713 -8.419 -1.653 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.662 -5.993 -0.874 1.00 0.00 H new ATOM 0 HB3 SER A 48 -6.006 -6.545 -1.854 1.00 0.00 H new ATOM 0 HG SER A 48 -6.193 -7.210 0.346 1.00 0.00 H new ATOM 732 N GLY A 49 -4.627 -7.800 -4.638 1.00 0.00 N ATOM 733 CA GLY A 49 -5.197 -8.345 -5.858 1.00 0.00 C ATOM 734 C GLY A 49 -4.144 -9.169 -6.607 1.00 0.00 C ATOM 735 O GLY A 49 -3.043 -9.392 -6.086 1.00 0.00 O ATOM 0 H GLY A 49 -4.014 -7.003 -4.810 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.057 -8.970 -5.619 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -5.557 -7.536 -6.494 1.00 0.00 H new ATOM 739 N PRO A 50 -4.486 -9.669 -7.805 1.00 0.00 N ATOM 740 CA PRO A 50 -3.600 -10.465 -8.648 1.00 0.00 C ATOM 741 C PRO A 50 -2.602 -9.546 -9.381 1.00 0.00 C ATOM 742 O PRO A 50 -2.403 -8.390 -8.998 1.00 0.00 O ATOM 743 CB PRO A 50 -4.570 -11.174 -9.605 1.00 0.00 C ATOM 744 CG PRO A 50 -5.633 -10.106 -9.848 1.00 0.00 C ATOM 745 CD PRO A 50 -5.763 -9.451 -8.476 1.00 0.00 C ATOM 0 HA PRO A 50 -2.981 -11.177 -8.103 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -4.079 -11.476 -10.530 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -4.994 -12.074 -9.160 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -5.324 -9.392 -10.611 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -6.576 -10.540 -10.181 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -5.978 -8.387 -8.570 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -6.582 -9.892 -7.909 1.00 0.00 H new ATOM 753 N SER A 51 -1.954 -10.058 -10.428 1.00 0.00 N ATOM 754 CA SER A 51 -0.994 -9.331 -11.261 1.00 0.00 C ATOM 755 C SER A 51 -1.465 -9.335 -12.730 1.00 0.00 C ATOM 756 O SER A 51 -0.762 -8.845 -13.612 1.00 0.00 O ATOM 757 CB SER A 51 0.407 -9.918 -11.041 1.00 0.00 C ATOM 758 OG SER A 51 1.448 -8.999 -11.317 1.00 0.00 O ATOM 0 H SER A 51 -2.087 -11.023 -10.730 1.00 0.00 H new ATOM 0 HA SER A 51 -0.937 -8.281 -10.975 1.00 0.00 H new ATOM 0 HB2 SER A 51 0.494 -10.256 -10.008 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.529 -10.796 -11.675 1.00 0.00 H new ATOM 0 HG SER A 51 2.314 -9.429 -11.158 1.00 0.00 H new ATOM 764 N SER A 52 -2.650 -9.894 -13.009 1.00 0.00 N ATOM 765 CA SER A 52 -3.287 -9.987 -14.318 1.00 0.00 C ATOM 766 C SER A 52 -4.806 -9.927 -14.092 1.00 0.00 C ATOM 767 O SER A 52 -5.552 -10.842 -14.443 1.00 0.00 O ATOM 768 CB SER A 52 -2.874 -11.279 -15.034 1.00 0.00 C ATOM 769 OG SER A 52 -1.471 -11.449 -15.130 1.00 0.00 O ATOM 0 H SER A 52 -3.220 -10.318 -12.277 1.00 0.00 H new ATOM 0 HA SER A 52 -2.973 -9.164 -14.960 1.00 0.00 H new ATOM 0 HB2 SER A 52 -3.300 -12.131 -14.503 1.00 0.00 H new ATOM 0 HB3 SER A 52 -3.302 -11.282 -16.037 1.00 0.00 H new ATOM 0 HG SER A 52 -1.274 -12.290 -15.594 1.00 0.00 H new ATOM 775 N GLY A 53 -5.273 -8.885 -13.404 1.00 0.00 N ATOM 776 CA GLY A 53 -6.670 -8.649 -13.081 1.00 0.00 C ATOM 777 C GLY A 53 -6.822 -7.189 -12.753 1.00 0.00 C ATOM 778 O GLY A 53 -6.247 -6.725 -11.748 1.00 0.00 O ATOM 0 H GLY A 53 -4.658 -8.155 -13.044 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -7.308 -8.921 -13.922 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.977 -9.265 -12.236 1.00 0.00 H new TER 782 GLY A 53 ATOM 783 N GLY B 1 13.317 15.771 13.763 1.00 0.00 N ATOM 784 CA GLY B 1 14.663 15.565 13.220 1.00 0.00 C ATOM 785 C GLY B 1 14.612 14.966 11.827 1.00 0.00 C ATOM 786 O GLY B 1 13.975 15.544 10.940 1.00 0.00 O ATOM 0 H1 GLY B 1 13.386 16.182 14.716 1.00 0.00 H new ATOM 0 H2 GLY B 1 12.789 16.419 13.144 1.00 0.00 H new ATOM 0 H3 GLY B 1 12.820 14.859 13.814 1.00 0.00 H new ATOM 0 HA2 GLY B 1 15.194 16.516 13.189 1.00 0.00 H new ATOM 0 HA3 GLY B 1 15.227 14.906 13.881 1.00 0.00 H new ATOM 790 N SER B 2 15.309 13.846 11.597 1.00 0.00 N ATOM 791 CA SER B 2 15.333 13.189 10.293 1.00 0.00 C ATOM 792 C SER B 2 13.975 12.546 9.994 1.00 0.00 C ATOM 793 O SER B 2 13.361 11.941 10.875 1.00 0.00 O ATOM 794 CB SER B 2 16.466 12.152 10.255 1.00 0.00 C ATOM 795 OG SER B 2 16.519 11.501 8.998 1.00 0.00 O ATOM 0 H SER B 2 15.868 13.375 12.309 1.00 0.00 H new ATOM 0 HA SER B 2 15.523 13.931 9.518 1.00 0.00 H new ATOM 0 HB2 SER B 2 17.419 12.642 10.455 1.00 0.00 H new ATOM 0 HB3 SER B 2 16.315 11.415 11.044 1.00 0.00 H new ATOM 0 HG SER B 2 17.249 10.847 8.999 1.00 0.00 H new ATOM 801 N SER B 3 13.539 12.606 8.739 1.00 0.00 N ATOM 802 CA SER B 3 12.283 12.060 8.237 1.00 0.00 C ATOM 803 C SER B 3 12.494 11.035 7.111 1.00 0.00 C ATOM 804 O SER B 3 11.508 10.508 6.594 1.00 0.00 O ATOM 805 CB SER B 3 11.359 13.219 7.828 1.00 0.00 C ATOM 806 OG SER B 3 12.080 14.274 7.214 1.00 0.00 O ATOM 0 H SER B 3 14.082 13.062 8.006 1.00 0.00 H new ATOM 0 HA SER B 3 11.798 11.497 9.035 1.00 0.00 H new ATOM 0 HB2 SER B 3 10.597 12.851 7.141 1.00 0.00 H new ATOM 0 HB3 SER B 3 10.839 13.598 8.708 1.00 0.00 H new ATOM 0 HG SER B 3 11.461 14.992 6.966 1.00 0.00 H new ATOM 812 N GLY B 4 13.739 10.723 6.734 1.00 0.00 N ATOM 813 CA GLY B 4 14.079 9.759 5.690 1.00 0.00 C ATOM 814 C GLY B 4 15.342 10.181 4.942 1.00 0.00 C ATOM 815 O GLY B 4 15.785 11.325 5.070 1.00 0.00 O ATOM 0 H GLY B 4 14.561 11.149 7.162 1.00 0.00 H new ATOM 0 HA2 GLY B 4 14.227 8.775 6.134 1.00 0.00 H new ATOM 0 HA3 GLY B 4 13.250 9.670 4.988 1.00 0.00 H new ATOM 819 N SER B 5 15.939 9.266 4.178 1.00 0.00 N ATOM 820 CA SER B 5 17.139 9.498 3.376 1.00 0.00 C ATOM 821 C SER B 5 16.751 10.205 2.068 1.00 0.00 C ATOM 822 O SER B 5 15.571 10.511 1.869 1.00 0.00 O ATOM 823 CB SER B 5 17.797 8.143 3.105 1.00 0.00 C ATOM 824 OG SER B 5 16.858 7.215 2.594 1.00 0.00 O ATOM 0 H SER B 5 15.588 8.311 4.098 1.00 0.00 H new ATOM 0 HA SER B 5 17.846 10.139 3.903 1.00 0.00 H new ATOM 0 HB2 SER B 5 18.614 8.267 2.394 1.00 0.00 H new ATOM 0 HB3 SER B 5 18.232 7.755 4.026 1.00 0.00 H new ATOM 0 HG SER B 5 17.303 6.358 2.427 1.00 0.00 H new ATOM 830 N SER B 6 17.698 10.522 1.184 1.00 0.00 N ATOM 831 CA SER B 6 17.437 11.176 -0.092 1.00 0.00 C ATOM 832 C SER B 6 18.653 11.018 -1.002 1.00 0.00 C ATOM 833 O SER B 6 19.768 10.754 -0.545 1.00 0.00 O ATOM 834 CB SER B 6 17.194 12.671 0.150 1.00 0.00 C ATOM 835 OG SER B 6 16.637 13.336 -0.968 1.00 0.00 O ATOM 0 H SER B 6 18.687 10.326 1.341 1.00 0.00 H new ATOM 0 HA SER B 6 16.563 10.724 -0.560 1.00 0.00 H new ATOM 0 HB2 SER B 6 16.527 12.790 1.004 1.00 0.00 H new ATOM 0 HB3 SER B 6 18.138 13.147 0.414 1.00 0.00 H new ATOM 0 HG SER B 6 16.504 14.283 -0.753 1.00 0.00 H new ATOM 841 N GLY B 7 18.447 11.250 -2.298 1.00 0.00 N ATOM 842 CA GLY B 7 19.475 11.179 -3.320 1.00 0.00 C ATOM 843 C GLY B 7 19.592 9.816 -3.981 1.00 0.00 C ATOM 844 O GLY B 7 19.841 9.772 -5.189 1.00 0.00 O ATOM 0 H GLY B 7 17.531 11.499 -2.670 1.00 0.00 H new ATOM 0 HA2 GLY B 7 19.265 11.926 -4.085 1.00 0.00 H new ATOM 0 HA3 GLY B 7 20.435 11.440 -2.875 1.00 0.00 H new ATOM 848 N GLN B 8 19.421 8.712 -3.253 1.00 0.00 N ATOM 849 CA GLN B 8 19.525 7.379 -3.831 1.00 0.00 C ATOM 850 C GLN B 8 18.533 6.464 -3.126 1.00 0.00 C ATOM 851 O GLN B 8 18.901 5.696 -2.237 1.00 0.00 O ATOM 852 CB GLN B 8 20.983 6.891 -3.777 1.00 0.00 C ATOM 853 CG GLN B 8 21.198 5.630 -4.627 1.00 0.00 C ATOM 854 CD GLN B 8 22.684 5.367 -4.846 1.00 0.00 C ATOM 855 OE1 GLN B 8 23.318 4.590 -4.143 1.00 0.00 O ATOM 856 NE2 GLN B 8 23.285 6.022 -5.826 1.00 0.00 N ATOM 0 H GLN B 8 19.209 8.719 -2.255 1.00 0.00 H new ATOM 0 HA GLN B 8 19.259 7.383 -4.888 1.00 0.00 H new ATOM 0 HB2 GLN B 8 21.644 7.683 -4.129 1.00 0.00 H new ATOM 0 HB3 GLN B 8 21.258 6.683 -2.743 1.00 0.00 H new ATOM 0 HG2 GLN B 8 20.742 4.772 -4.133 1.00 0.00 H new ATOM 0 HG3 GLN B 8 20.700 5.746 -5.589 1.00 0.00 H new ATOM 0 HE21 GLN B 8 22.753 6.668 -6.409 1.00 0.00 H new ATOM 0 HE22 GLN B 8 24.280 5.881 -5.999 1.00 0.00 H new ATOM 865 N LEU B 9 17.246 6.569 -3.465 1.00 0.00 N ATOM 866 CA LEU B 9 16.225 5.727 -2.836 1.00 0.00 C ATOM 867 C LEU B 9 16.460 4.247 -3.140 1.00 0.00 C ATOM 868 O LEU B 9 16.006 3.402 -2.366 1.00 0.00 O ATOM 869 CB LEU B 9 14.807 6.190 -3.210 1.00 0.00 C ATOM 870 CG LEU B 9 14.106 6.891 -2.030 1.00 0.00 C ATOM 871 CD1 LEU B 9 14.828 8.165 -1.565 1.00 0.00 C ATOM 872 CD2 LEU B 9 12.673 7.248 -2.427 1.00 0.00 C ATOM 0 H LEU B 9 16.888 7.221 -4.163 1.00 0.00 H new ATOM 0 HA LEU B 9 16.314 5.841 -1.756 1.00 0.00 H new ATOM 0 HB2 LEU B 9 14.859 6.871 -4.059 1.00 0.00 H new ATOM 0 HB3 LEU B 9 14.215 5.331 -3.526 1.00 0.00 H new ATOM 0 HG LEU B 9 14.120 6.189 -1.196 1.00 0.00 H new ATOM 0 HD11 LEU B 9 14.283 8.609 -0.732 1.00 0.00 H new ATOM 0 HD12 LEU B 9 15.839 7.914 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU B 9 14.876 8.877 -2.389 1.00 0.00 H new ATOM 0 HD21 LEU B 9 12.177 7.744 -1.593 1.00 0.00 H new ATOM 0 HD22 LEU B 9 12.690 7.916 -3.288 1.00 0.00 H new ATOM 0 HD23 LEU B 9 12.129 6.339 -2.684 1.00 0.00 H new ATOM 884 N SER B 10 17.191 3.911 -4.214 1.00 0.00 N ATOM 885 CA SER B 10 17.477 2.518 -4.538 1.00 0.00 C ATOM 886 C SER B 10 18.256 1.841 -3.397 1.00 0.00 C ATOM 887 O SER B 10 18.134 0.633 -3.216 1.00 0.00 O ATOM 888 CB SER B 10 18.210 2.408 -5.877 1.00 0.00 C ATOM 889 OG SER B 10 17.462 3.013 -6.924 1.00 0.00 O ATOM 0 H SER B 10 17.590 4.586 -4.866 1.00 0.00 H new ATOM 0 HA SER B 10 16.531 1.987 -4.645 1.00 0.00 H new ATOM 0 HB2 SER B 10 19.186 2.887 -5.801 1.00 0.00 H new ATOM 0 HB3 SER B 10 18.387 1.359 -6.112 1.00 0.00 H new ATOM 0 HG SER B 10 17.954 2.930 -7.768 1.00 0.00 H new ATOM 895 N SER B 11 18.990 2.593 -2.569 1.00 0.00 N ATOM 896 CA SER B 11 19.733 2.032 -1.451 1.00 0.00 C ATOM 897 C SER B 11 18.788 1.346 -0.460 1.00 0.00 C ATOM 898 O SER B 11 19.156 0.357 0.167 1.00 0.00 O ATOM 899 CB SER B 11 20.446 3.169 -0.720 1.00 0.00 C ATOM 900 OG SER B 11 21.245 3.938 -1.592 1.00 0.00 O ATOM 0 H SER B 11 19.081 3.605 -2.661 1.00 0.00 H new ATOM 0 HA SER B 11 20.443 1.300 -1.834 1.00 0.00 H new ATOM 0 HB2 SER B 11 19.707 3.813 -0.243 1.00 0.00 H new ATOM 0 HB3 SER B 11 21.069 2.756 0.073 1.00 0.00 H new ATOM 0 HG SER B 11 20.711 4.671 -1.964 1.00 0.00 H new ATOM 906 N GLU B 12 17.573 1.878 -0.279 1.00 0.00 N ATOM 907 CA GLU B 12 16.600 1.297 0.636 1.00 0.00 C ATOM 908 C GLU B 12 15.885 0.114 -0.023 1.00 0.00 C ATOM 909 O GLU B 12 15.407 -0.762 0.695 1.00 0.00 O ATOM 910 CB GLU B 12 15.607 2.360 1.112 1.00 0.00 C ATOM 911 CG GLU B 12 16.253 3.536 1.864 1.00 0.00 C ATOM 912 CD GLU B 12 17.100 3.127 3.081 1.00 0.00 C ATOM 913 OE1 GLU B 12 16.567 2.500 4.030 1.00 0.00 O ATOM 914 OE2 GLU B 12 18.317 3.435 3.101 1.00 0.00 O ATOM 0 H GLU B 12 17.245 2.715 -0.760 1.00 0.00 H new ATOM 0 HA GLU B 12 17.126 0.920 1.514 1.00 0.00 H new ATOM 0 HB2 GLU B 12 15.067 2.749 0.249 1.00 0.00 H new ATOM 0 HB3 GLU B 12 14.871 1.888 1.763 1.00 0.00 H new ATOM 0 HG2 GLU B 12 16.882 4.093 1.170 1.00 0.00 H new ATOM 0 HG3 GLU B 12 15.467 4.214 2.196 1.00 0.00 H new ATOM 921 N ILE B 13 15.811 0.072 -1.361 1.00 0.00 N ATOM 922 CA ILE B 13 15.184 -1.024 -2.103 1.00 0.00 C ATOM 923 C ILE B 13 16.000 -2.274 -1.757 1.00 0.00 C ATOM 924 O ILE B 13 15.437 -3.310 -1.420 1.00 0.00 O ATOM 925 CB ILE B 13 15.133 -0.712 -3.626 1.00 0.00 C ATOM 926 CG1 ILE B 13 14.225 0.515 -3.877 1.00 0.00 C ATOM 927 CG2 ILE B 13 14.703 -1.902 -4.506 1.00 0.00 C ATOM 928 CD1 ILE B 13 14.069 0.898 -5.354 1.00 0.00 C ATOM 0 H ILE B 13 16.189 0.805 -1.961 1.00 0.00 H new ATOM 0 HA ILE B 13 14.141 -1.174 -1.826 1.00 0.00 H new ATOM 0 HB ILE B 13 16.157 -0.491 -3.928 1.00 0.00 H new ATOM 0 HG12 ILE B 13 13.238 0.312 -3.461 1.00 0.00 H new ATOM 0 HG13 ILE B 13 14.631 1.369 -3.334 1.00 0.00 H new ATOM 0 HG21 ILE B 13 14.695 -1.596 -5.552 1.00 0.00 H new ATOM 0 HG22 ILE B 13 15.406 -2.725 -4.374 1.00 0.00 H new ATOM 0 HG23 ILE B 13 13.704 -2.227 -4.215 1.00 0.00 H new ATOM 0 HD11 ILE B 13 13.417 1.767 -5.438 1.00 0.00 H new ATOM 0 HD12 ILE B 13 15.047 1.136 -5.773 1.00 0.00 H new ATOM 0 HD13 ILE B 13 13.632 0.063 -5.902 1.00 0.00 H new ATOM 940 N GLU B 14 17.330 -2.173 -1.765 1.00 0.00 N ATOM 941 CA GLU B 14 18.202 -3.298 -1.434 1.00 0.00 C ATOM 942 C GLU B 14 18.043 -3.723 0.029 1.00 0.00 C ATOM 943 O GLU B 14 18.177 -4.901 0.365 1.00 0.00 O ATOM 944 CB GLU B 14 19.660 -2.923 -1.694 1.00 0.00 C ATOM 945 CG GLU B 14 19.891 -2.550 -3.165 1.00 0.00 C ATOM 946 CD GLU B 14 21.367 -2.467 -3.536 1.00 0.00 C ATOM 947 OE1 GLU B 14 22.243 -2.660 -2.667 1.00 0.00 O ATOM 948 OE2 GLU B 14 21.675 -2.251 -4.728 1.00 0.00 O ATOM 0 H GLU B 14 17.829 -1.315 -2.000 1.00 0.00 H new ATOM 0 HA GLU B 14 17.914 -4.136 -2.068 1.00 0.00 H new ATOM 0 HB2 GLU B 14 19.940 -2.084 -1.057 1.00 0.00 H new ATOM 0 HB3 GLU B 14 20.306 -3.759 -1.424 1.00 0.00 H new ATOM 0 HG2 GLU B 14 19.403 -3.288 -3.802 1.00 0.00 H new ATOM 0 HG3 GLU B 14 19.417 -1.590 -3.369 1.00 0.00 H new ATOM 955 N ARG B 15 17.755 -2.776 0.928 1.00 0.00 N ATOM 956 CA ARG B 15 17.583 -3.111 2.341 1.00 0.00 C ATOM 957 C ARG B 15 16.305 -3.920 2.496 1.00 0.00 C ATOM 958 O ARG B 15 16.274 -4.850 3.304 1.00 0.00 O ATOM 959 CB ARG B 15 17.612 -1.846 3.202 1.00 0.00 C ATOM 960 CG ARG B 15 19.025 -1.245 3.150 1.00 0.00 C ATOM 961 CD ARG B 15 19.073 0.146 3.767 1.00 0.00 C ATOM 962 NE ARG B 15 19.347 0.094 5.208 1.00 0.00 N ATOM 963 CZ ARG B 15 19.715 1.155 5.924 1.00 0.00 C ATOM 964 NH1 ARG B 15 19.510 2.382 5.461 1.00 0.00 N ATOM 965 NH2 ARG B 15 20.286 0.984 7.111 1.00 0.00 N ATOM 0 H ARG B 15 17.638 -1.787 0.705 1.00 0.00 H new ATOM 0 HA ARG B 15 18.410 -3.726 2.696 1.00 0.00 H new ATOM 0 HB2 ARG B 15 16.881 -1.124 2.837 1.00 0.00 H new ATOM 0 HB3 ARG B 15 17.340 -2.083 4.231 1.00 0.00 H new ATOM 0 HG2 ARG B 15 19.718 -1.900 3.678 1.00 0.00 H new ATOM 0 HG3 ARG B 15 19.360 -1.194 2.114 1.00 0.00 H new ATOM 0 HD2 ARG B 15 19.843 0.737 3.272 1.00 0.00 H new ATOM 0 HD3 ARG B 15 18.123 0.653 3.596 1.00 0.00 H new ATOM 0 HE ARG B 15 19.251 -0.802 5.686 1.00 0.00 H new ATOM 0 HH11 ARG B 15 19.068 2.517 4.552 1.00 0.00 H new ATOM 0 HH12 ARG B 15 19.794 3.190 6.015 1.00 0.00 H new ATOM 0 HH21 ARG B 15 20.441 0.042 7.471 1.00 0.00 H new ATOM 0 HH22 ARG B 15 20.569 1.794 7.662 1.00 0.00 H new ATOM 979 N LEU B 16 15.274 -3.575 1.724 1.00 0.00 N ATOM 980 CA LEU B 16 13.998 -4.265 1.717 1.00 0.00 C ATOM 981 C LEU B 16 14.225 -5.656 1.123 1.00 0.00 C ATOM 982 O LEU B 16 13.779 -6.639 1.706 1.00 0.00 O ATOM 983 CB LEU B 16 12.972 -3.451 0.910 1.00 0.00 C ATOM 984 CG LEU B 16 12.313 -2.334 1.741 1.00 0.00 C ATOM 985 CD1 LEU B 16 11.717 -1.283 0.797 1.00 0.00 C ATOM 986 CD2 LEU B 16 11.231 -2.906 2.668 1.00 0.00 C ATOM 0 H LEU B 16 15.311 -2.790 1.074 1.00 0.00 H new ATOM 0 HA LEU B 16 13.597 -4.371 2.725 1.00 0.00 H new ATOM 0 HB2 LEU B 16 13.465 -3.011 0.043 1.00 0.00 H new ATOM 0 HB3 LEU B 16 12.200 -4.121 0.532 1.00 0.00 H new ATOM 0 HG LEU B 16 13.071 -1.865 2.369 1.00 0.00 H new ATOM 0 HD11 LEU B 16 11.250 -0.491 1.383 1.00 0.00 H new ATOM 0 HD12 LEU B 16 12.508 -0.859 0.179 1.00 0.00 H new ATOM 0 HD13 LEU B 16 10.969 -1.751 0.157 1.00 0.00 H new ATOM 0 HD21 LEU B 16 10.781 -2.098 3.244 1.00 0.00 H new ATOM 0 HD22 LEU B 16 10.463 -3.397 2.071 1.00 0.00 H new ATOM 0 HD23 LEU B 16 11.680 -3.630 3.348 1.00 0.00 H new ATOM 998 N MET B 17 14.965 -5.775 0.014 1.00 0.00 N ATOM 999 CA MET B 17 15.262 -7.054 -0.638 1.00 0.00 C ATOM 1000 C MET B 17 15.787 -8.092 0.358 1.00 0.00 C ATOM 1001 O MET B 17 15.417 -9.264 0.262 1.00 0.00 O ATOM 1002 CB MET B 17 16.296 -6.864 -1.753 1.00 0.00 C ATOM 1003 CG MET B 17 15.710 -6.239 -3.011 1.00 0.00 C ATOM 1004 SD MET B 17 16.966 -5.841 -4.250 1.00 0.00 S ATOM 1005 CE MET B 17 15.903 -5.543 -5.679 1.00 0.00 C ATOM 0 H MET B 17 15.380 -4.974 -0.462 1.00 0.00 H new ATOM 0 HA MET B 17 14.326 -7.420 -1.060 1.00 0.00 H new ATOM 0 HB2 MET B 17 17.106 -6.234 -1.385 1.00 0.00 H new ATOM 0 HB3 MET B 17 16.732 -7.831 -2.004 1.00 0.00 H new ATOM 0 HG2 MET B 17 14.982 -6.924 -3.446 1.00 0.00 H new ATOM 0 HG3 MET B 17 15.171 -5.330 -2.742 1.00 0.00 H new ATOM 0 HE1 MET B 17 16.193 -6.207 -6.493 1.00 0.00 H new ATOM 0 HE2 MET B 17 14.865 -5.735 -5.407 1.00 0.00 H new ATOM 0 HE3 MET B 17 16.008 -4.507 -6.001 1.00 0.00 H new ATOM 1015 N SER B 18 16.583 -7.650 1.334 1.00 0.00 N ATOM 1016 CA SER B 18 17.184 -8.463 2.386 1.00 0.00 C ATOM 1017 C SER B 18 16.141 -9.273 3.188 1.00 0.00 C ATOM 1018 O SER B 18 16.460 -10.342 3.713 1.00 0.00 O ATOM 1019 CB SER B 18 18.006 -7.525 3.284 1.00 0.00 C ATOM 1020 OG SER B 18 19.123 -8.149 3.889 1.00 0.00 O ATOM 0 H SER B 18 16.837 -6.665 1.413 1.00 0.00 H new ATOM 0 HA SER B 18 17.831 -9.217 1.938 1.00 0.00 H new ATOM 0 HB2 SER B 18 18.352 -6.679 2.690 1.00 0.00 H new ATOM 0 HB3 SER B 18 17.359 -7.124 4.064 1.00 0.00 H new ATOM 0 HG SER B 18 19.601 -7.498 4.443 1.00 0.00 H new ATOM 1026 N GLN B 19 14.894 -8.799 3.295 1.00 0.00 N ATOM 1027 CA GLN B 19 13.804 -9.471 4.013 1.00 0.00 C ATOM 1028 C GLN B 19 13.189 -10.613 3.190 1.00 0.00 C ATOM 1029 O GLN B 19 12.356 -11.361 3.707 1.00 0.00 O ATOM 1030 CB GLN B 19 12.679 -8.453 4.261 1.00 0.00 C ATOM 1031 CG GLN B 19 13.029 -7.327 5.238 1.00 0.00 C ATOM 1032 CD GLN B 19 12.658 -7.717 6.663 1.00 0.00 C ATOM 1033 OE1 GLN B 19 13.483 -8.230 7.416 1.00 0.00 O ATOM 1034 NE2 GLN B 19 11.414 -7.503 7.059 1.00 0.00 N ATOM 0 H GLN B 19 14.608 -7.915 2.874 1.00 0.00 H new ATOM 0 HA GLN B 19 14.221 -9.874 4.936 1.00 0.00 H new ATOM 0 HB2 GLN B 19 12.393 -8.010 3.307 1.00 0.00 H new ATOM 0 HB3 GLN B 19 11.806 -8.984 4.640 1.00 0.00 H new ATOM 0 HG2 GLN B 19 14.095 -7.108 5.181 1.00 0.00 H new ATOM 0 HG3 GLN B 19 12.501 -6.416 4.956 1.00 0.00 H new ATOM 0 HE21 GLN B 19 10.742 -7.076 6.421 1.00 0.00 H new ATOM 0 HE22 GLN B 19 11.127 -7.765 8.002 1.00 0.00 H new ATOM 1043 N GLY B 20 13.579 -10.739 1.921 1.00 0.00 N ATOM 1044 CA GLY B 20 13.081 -11.730 0.982 1.00 0.00 C ATOM 1045 C GLY B 20 12.119 -11.078 -0.017 1.00 0.00 C ATOM 1046 O GLY B 20 11.377 -11.789 -0.696 1.00 0.00 O ATOM 0 H GLY B 20 14.280 -10.125 1.508 1.00 0.00 H new ATOM 0 HA2 GLY B 20 13.915 -12.188 0.449 1.00 0.00 H new ATOM 0 HA3 GLY B 20 12.571 -12.528 1.521 1.00 0.00 H new ATOM 1050 N TYR B 21 12.055 -9.741 -0.071 1.00 0.00 N ATOM 1051 CA TYR B 21 11.183 -9.011 -0.968 1.00 0.00 C ATOM 1052 C TYR B 21 11.833 -8.957 -2.357 1.00 0.00 C ATOM 1053 O TYR B 21 13.044 -9.187 -2.485 1.00 0.00 O ATOM 1054 CB TYR B 21 10.964 -7.620 -0.357 1.00 0.00 C ATOM 1055 CG TYR B 21 10.323 -7.567 1.032 1.00 0.00 C ATOM 1056 CD1 TYR B 21 9.290 -8.450 1.403 1.00 0.00 C ATOM 1057 CD2 TYR B 21 10.713 -6.566 1.939 1.00 0.00 C ATOM 1058 CE1 TYR B 21 8.634 -8.292 2.637 1.00 0.00 C ATOM 1059 CE2 TYR B 21 10.087 -6.423 3.186 1.00 0.00 C ATOM 1060 CZ TYR B 21 9.039 -7.288 3.541 1.00 0.00 C ATOM 1061 OH TYR B 21 8.493 -7.185 4.781 1.00 0.00 O ATOM 0 H TYR B 21 12.622 -9.136 0.523 1.00 0.00 H new ATOM 0 HA TYR B 21 10.213 -9.492 -1.091 1.00 0.00 H new ATOM 0 HB2 TYR B 21 11.929 -7.117 -0.305 1.00 0.00 H new ATOM 0 HB3 TYR B 21 10.341 -7.043 -1.041 1.00 0.00 H new ATOM 0 HD1 TYR B 21 9.001 -9.250 0.738 1.00 0.00 H new ATOM 0 HD2 TYR B 21 11.513 -5.892 1.669 1.00 0.00 H new ATOM 0 HE1 TYR B 21 7.813 -8.945 2.895 1.00 0.00 H new ATOM 0 HE2 TYR B 21 10.409 -5.652 3.870 1.00 0.00 H new ATOM 0 HH TYR B 21 8.902 -6.432 5.257 1.00 0.00 H new ATOM 1071 N SER B 22 11.053 -8.653 -3.395 1.00 0.00 N ATOM 1072 CA SER B 22 11.525 -8.568 -4.773 1.00 0.00 C ATOM 1073 C SER B 22 11.336 -7.151 -5.290 1.00 0.00 C ATOM 1074 O SER B 22 10.453 -6.413 -4.856 1.00 0.00 O ATOM 1075 CB SER B 22 10.734 -9.549 -5.653 1.00 0.00 C ATOM 1076 OG SER B 22 11.060 -9.419 -7.030 1.00 0.00 O ATOM 0 H SER B 22 10.057 -8.456 -3.297 1.00 0.00 H new ATOM 0 HA SER B 22 12.583 -8.827 -4.808 1.00 0.00 H new ATOM 0 HB2 SER B 22 10.936 -10.570 -5.328 1.00 0.00 H new ATOM 0 HB3 SER B 22 9.666 -9.377 -5.516 1.00 0.00 H new ATOM 0 HG SER B 22 10.536 -10.062 -7.552 1.00 0.00 H new ATOM 1082 N TYR B 23 12.148 -6.796 -6.284 1.00 0.00 N ATOM 1083 CA TYR B 23 12.122 -5.504 -6.942 1.00 0.00 C ATOM 1084 C TYR B 23 10.709 -5.190 -7.443 1.00 0.00 C ATOM 1085 O TYR B 23 10.270 -4.043 -7.379 1.00 0.00 O ATOM 1086 CB TYR B 23 13.116 -5.549 -8.106 1.00 0.00 C ATOM 1087 CG TYR B 23 13.254 -4.224 -8.812 1.00 0.00 C ATOM 1088 CD1 TYR B 23 13.873 -3.153 -8.148 1.00 0.00 C ATOM 1089 CD2 TYR B 23 12.739 -4.051 -10.109 1.00 0.00 C ATOM 1090 CE1 TYR B 23 13.984 -1.902 -8.770 1.00 0.00 C ATOM 1091 CE2 TYR B 23 12.861 -2.807 -10.748 1.00 0.00 C ATOM 1092 CZ TYR B 23 13.492 -1.729 -10.087 1.00 0.00 C ATOM 1093 OH TYR B 23 13.575 -0.529 -10.724 1.00 0.00 O ATOM 0 H TYR B 23 12.860 -7.422 -6.660 1.00 0.00 H new ATOM 0 HA TYR B 23 12.404 -4.716 -6.244 1.00 0.00 H new ATOM 0 HB2 TYR B 23 14.092 -5.859 -7.732 1.00 0.00 H new ATOM 0 HB3 TYR B 23 12.795 -6.305 -8.823 1.00 0.00 H new ATOM 0 HD1 TYR B 23 14.266 -3.294 -7.152 1.00 0.00 H new ATOM 0 HD2 TYR B 23 12.251 -4.873 -10.612 1.00 0.00 H new ATOM 0 HE1 TYR B 23 14.442 -1.075 -8.248 1.00 0.00 H new ATOM 0 HE2 TYR B 23 12.472 -2.674 -11.747 1.00 0.00 H new ATOM 0 HH TYR B 23 13.185 -0.607 -11.620 1.00 0.00 H new ATOM 1103 N GLN B 24 9.981 -6.209 -7.915 1.00 0.00 N ATOM 1104 CA GLN B 24 8.630 -6.042 -8.423 1.00 0.00 C ATOM 1105 C GLN B 24 7.717 -5.436 -7.360 1.00 0.00 C ATOM 1106 O GLN B 24 7.094 -4.398 -7.606 1.00 0.00 O ATOM 1107 CB GLN B 24 8.037 -7.381 -8.906 1.00 0.00 C ATOM 1108 CG GLN B 24 8.893 -8.127 -9.937 1.00 0.00 C ATOM 1109 CD GLN B 24 8.169 -9.349 -10.499 1.00 0.00 C ATOM 1110 OE1 GLN B 24 6.976 -9.318 -10.799 1.00 0.00 O ATOM 1111 NE2 GLN B 24 8.867 -10.451 -10.681 1.00 0.00 N ATOM 0 H GLN B 24 10.320 -7.170 -7.952 1.00 0.00 H new ATOM 0 HA GLN B 24 8.691 -5.362 -9.273 1.00 0.00 H new ATOM 0 HB2 GLN B 24 7.887 -8.029 -8.042 1.00 0.00 H new ATOM 0 HB3 GLN B 24 7.054 -7.193 -9.338 1.00 0.00 H new ATOM 0 HG2 GLN B 24 9.151 -7.451 -10.752 1.00 0.00 H new ATOM 0 HG3 GLN B 24 9.829 -8.440 -9.474 1.00 0.00 H new ATOM 0 HE21 GLN B 24 9.856 -10.475 -10.432 1.00 0.00 H new ATOM 0 HE22 GLN B 24 8.419 -11.280 -11.071 1.00 0.00 H new ATOM 1120 N ASP B 25 7.618 -6.114 -6.214 1.00 0.00 N ATOM 1121 CA ASP B 25 6.784 -5.709 -5.091 1.00 0.00 C ATOM 1122 C ASP B 25 7.269 -4.386 -4.495 1.00 0.00 C ATOM 1123 O ASP B 25 6.455 -3.475 -4.341 1.00 0.00 O ATOM 1124 CB ASP B 25 6.592 -6.859 -4.078 1.00 0.00 C ATOM 1125 CG ASP B 25 7.828 -7.352 -3.325 1.00 0.00 C ATOM 1126 OD1 ASP B 25 8.369 -6.585 -2.500 1.00 0.00 O ATOM 1127 OD2 ASP B 25 8.194 -8.542 -3.500 1.00 0.00 O ATOM 0 H ASP B 25 8.129 -6.980 -6.042 1.00 0.00 H new ATOM 0 HA ASP B 25 5.777 -5.501 -5.452 1.00 0.00 H new ATOM 0 HB2 ASP B 25 5.855 -6.538 -3.341 1.00 0.00 H new ATOM 0 HB3 ASP B 25 6.162 -7.707 -4.610 1.00 0.00 H new ATOM 1132 N ILE B 26 8.575 -4.201 -4.278 1.00 0.00 N ATOM 1133 CA ILE B 26 9.127 -2.963 -3.723 1.00 0.00 C ATOM 1134 C ILE B 26 8.677 -1.771 -4.582 1.00 0.00 C ATOM 1135 O ILE B 26 8.182 -0.767 -4.058 1.00 0.00 O ATOM 1136 CB ILE B 26 10.673 -3.038 -3.617 1.00 0.00 C ATOM 1137 CG1 ILE B 26 11.168 -4.157 -2.676 1.00 0.00 C ATOM 1138 CG2 ILE B 26 11.217 -1.697 -3.090 1.00 0.00 C ATOM 1139 CD1 ILE B 26 12.575 -4.673 -2.988 1.00 0.00 C ATOM 0 H ILE B 26 9.281 -4.908 -4.483 1.00 0.00 H new ATOM 0 HA ILE B 26 8.747 -2.826 -2.711 1.00 0.00 H new ATOM 0 HB ILE B 26 11.039 -3.258 -4.620 1.00 0.00 H new ATOM 0 HG12 ILE B 26 11.150 -3.787 -1.651 1.00 0.00 H new ATOM 0 HG13 ILE B 26 10.469 -4.992 -2.726 1.00 0.00 H new ATOM 0 HG21 ILE B 26 12.303 -1.749 -3.015 1.00 0.00 H new ATOM 0 HG22 ILE B 26 10.938 -0.897 -3.776 1.00 0.00 H new ATOM 0 HG23 ILE B 26 10.795 -1.495 -2.106 1.00 0.00 H new ATOM 0 HD11 ILE B 26 12.841 -5.456 -2.278 1.00 0.00 H new ATOM 0 HD12 ILE B 26 12.598 -5.077 -4.000 1.00 0.00 H new ATOM 0 HD13 ILE B 26 13.289 -3.853 -2.908 1.00 0.00 H new ATOM 1151 N GLN B 27 8.831 -1.878 -5.906 1.00 0.00 N ATOM 1152 CA GLN B 27 8.454 -0.809 -6.813 1.00 0.00 C ATOM 1153 C GLN B 27 6.945 -0.574 -6.810 1.00 0.00 C ATOM 1154 O GLN B 27 6.537 0.581 -6.727 1.00 0.00 O ATOM 1155 CB GLN B 27 8.980 -1.097 -8.224 1.00 0.00 C ATOM 1156 CG GLN B 27 10.510 -0.994 -8.307 1.00 0.00 C ATOM 1157 CD GLN B 27 11.010 0.447 -8.201 1.00 0.00 C ATOM 1158 OE1 GLN B 27 11.315 0.960 -7.130 1.00 0.00 O ATOM 1159 NE2 GLN B 27 11.102 1.160 -9.305 1.00 0.00 N ATOM 0 H GLN B 27 9.217 -2.702 -6.367 1.00 0.00 H new ATOM 0 HA GLN B 27 8.916 0.114 -6.461 1.00 0.00 H new ATOM 0 HB2 GLN B 27 8.668 -2.096 -8.529 1.00 0.00 H new ATOM 0 HB3 GLN B 27 8.532 -0.395 -8.927 1.00 0.00 H new ATOM 0 HG2 GLN B 27 10.954 -1.588 -7.508 1.00 0.00 H new ATOM 0 HG3 GLN B 27 10.849 -1.424 -9.250 1.00 0.00 H new ATOM 0 HE21 GLN B 27 10.851 0.745 -10.202 1.00 0.00 H new ATOM 0 HE22 GLN B 27 11.424 2.127 -9.262 1.00 0.00 H new ATOM 1168 N LYS B 28 6.099 -1.615 -6.881 1.00 0.00 N ATOM 1169 CA LYS B 28 4.641 -1.414 -6.889 1.00 0.00 C ATOM 1170 C LYS B 28 4.187 -0.588 -5.686 1.00 0.00 C ATOM 1171 O LYS B 28 3.250 0.196 -5.812 1.00 0.00 O ATOM 1172 CB LYS B 28 3.880 -2.754 -6.961 1.00 0.00 C ATOM 1173 CG LYS B 28 3.895 -3.334 -8.383 1.00 0.00 C ATOM 1174 CD LYS B 28 3.085 -4.633 -8.520 1.00 0.00 C ATOM 1175 CE LYS B 28 3.274 -5.157 -9.949 1.00 0.00 C ATOM 1176 NZ LYS B 28 2.447 -6.339 -10.264 1.00 0.00 N ATOM 0 H LYS B 28 6.394 -2.590 -6.933 1.00 0.00 H new ATOM 0 HA LYS B 28 4.399 -0.852 -7.791 1.00 0.00 H new ATOM 0 HB2 LYS B 28 4.331 -3.467 -6.271 1.00 0.00 H new ATOM 0 HB3 LYS B 28 2.849 -2.606 -6.638 1.00 0.00 H new ATOM 0 HG2 LYS B 28 3.497 -2.592 -9.075 1.00 0.00 H new ATOM 0 HG3 LYS B 28 4.927 -3.525 -8.679 1.00 0.00 H new ATOM 0 HD2 LYS B 28 3.424 -5.372 -7.794 1.00 0.00 H new ATOM 0 HD3 LYS B 28 2.030 -4.448 -8.318 1.00 0.00 H new ATOM 0 HE2 LYS B 28 3.035 -4.360 -10.653 1.00 0.00 H new ATOM 0 HE3 LYS B 28 4.324 -5.410 -10.098 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 2.627 -6.637 -11.244 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 2.690 -7.115 -9.616 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 1.441 -6.098 -10.154 1.00 0.00 H new ATOM 1190 N ALA B 29 4.826 -0.750 -4.528 1.00 0.00 N ATOM 1191 CA ALA B 29 4.476 -0.002 -3.327 1.00 0.00 C ATOM 1192 C ALA B 29 4.927 1.442 -3.481 1.00 0.00 C ATOM 1193 O ALA B 29 4.140 2.351 -3.227 1.00 0.00 O ATOM 1194 CB ALA B 29 5.116 -0.635 -2.095 1.00 0.00 C ATOM 0 H ALA B 29 5.599 -1.403 -4.399 1.00 0.00 H new ATOM 0 HA ALA B 29 3.394 -0.026 -3.194 1.00 0.00 H new ATOM 0 HB1 ALA B 29 4.843 -0.062 -1.208 1.00 0.00 H new ATOM 0 HB2 ALA B 29 4.763 -1.661 -1.988 1.00 0.00 H new ATOM 0 HB3 ALA B 29 6.200 -0.635 -2.207 1.00 0.00 H new ATOM 1200 N LEU B 30 6.180 1.657 -3.899 1.00 0.00 N ATOM 1201 CA LEU B 30 6.739 2.990 -4.097 1.00 0.00 C ATOM 1202 C LEU B 30 5.849 3.819 -5.021 1.00 0.00 C ATOM 1203 O LEU B 30 5.559 4.962 -4.680 1.00 0.00 O ATOM 1204 CB LEU B 30 8.177 2.908 -4.631 1.00 0.00 C ATOM 1205 CG LEU B 30 9.215 2.643 -3.525 1.00 0.00 C ATOM 1206 CD1 LEU B 30 10.514 2.094 -4.118 1.00 0.00 C ATOM 1207 CD2 LEU B 30 9.531 3.929 -2.748 1.00 0.00 C ATOM 0 H LEU B 30 6.834 0.903 -4.109 1.00 0.00 H new ATOM 0 HA LEU B 30 6.774 3.492 -3.130 1.00 0.00 H new ATOM 0 HB2 LEU B 30 8.237 2.115 -5.376 1.00 0.00 H new ATOM 0 HB3 LEU B 30 8.424 3.841 -5.138 1.00 0.00 H new ATOM 0 HG LEU B 30 8.784 1.907 -2.846 1.00 0.00 H new ATOM 0 HD11 LEU B 30 11.232 1.915 -3.318 1.00 0.00 H new ATOM 0 HD12 LEU B 30 10.309 1.158 -4.639 1.00 0.00 H new ATOM 0 HD13 LEU B 30 10.927 2.817 -4.821 1.00 0.00 H new ATOM 0 HD21 LEU B 30 10.267 3.714 -1.973 1.00 0.00 H new ATOM 0 HD22 LEU B 30 9.932 4.678 -3.431 1.00 0.00 H new ATOM 0 HD23 LEU B 30 8.619 4.309 -2.288 1.00 0.00 H new ATOM 1219 N VAL B 31 5.373 3.256 -6.134 1.00 0.00 N ATOM 1220 CA VAL B 31 4.508 3.948 -7.091 1.00 0.00 C ATOM 1221 C VAL B 31 3.267 4.515 -6.391 1.00 0.00 C ATOM 1222 O VAL B 31 2.924 5.688 -6.556 1.00 0.00 O ATOM 1223 CB VAL B 31 4.102 2.967 -8.213 1.00 0.00 C ATOM 1224 CG1 VAL B 31 3.107 3.583 -9.205 1.00 0.00 C ATOM 1225 CG2 VAL B 31 5.302 2.478 -9.031 1.00 0.00 C ATOM 0 H VAL B 31 5.581 2.293 -6.399 1.00 0.00 H new ATOM 0 HA VAL B 31 5.054 4.785 -7.526 1.00 0.00 H new ATOM 0 HB VAL B 31 3.640 2.133 -7.685 1.00 0.00 H new ATOM 0 HG11 VAL B 31 2.857 2.850 -9.972 1.00 0.00 H new ATOM 0 HG12 VAL B 31 2.201 3.878 -8.676 1.00 0.00 H new ATOM 0 HG13 VAL B 31 3.555 4.459 -9.673 1.00 0.00 H new ATOM 0 HG21 VAL B 31 4.959 1.792 -9.805 1.00 0.00 H new ATOM 0 HG22 VAL B 31 5.797 3.331 -9.495 1.00 0.00 H new ATOM 0 HG23 VAL B 31 6.004 1.963 -8.375 1.00 0.00 H new ATOM 1235 N ILE B 32 2.579 3.675 -5.619 1.00 0.00 N ATOM 1236 CA ILE B 32 1.365 4.044 -4.900 1.00 0.00 C ATOM 1237 C ILE B 32 1.689 5.032 -3.778 1.00 0.00 C ATOM 1238 O ILE B 32 0.867 5.882 -3.444 1.00 0.00 O ATOM 1239 CB ILE B 32 0.678 2.771 -4.360 1.00 0.00 C ATOM 1240 CG1 ILE B 32 0.425 1.737 -5.478 1.00 0.00 C ATOM 1241 CG2 ILE B 32 -0.660 3.134 -3.699 1.00 0.00 C ATOM 1242 CD1 ILE B 32 0.139 0.332 -4.946 1.00 0.00 C ATOM 0 H ILE B 32 2.856 2.704 -5.475 1.00 0.00 H new ATOM 0 HA ILE B 32 0.674 4.542 -5.580 1.00 0.00 H new ATOM 0 HB ILE B 32 1.350 2.326 -3.627 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -0.418 2.067 -6.085 1.00 0.00 H new ATOM 0 HG13 ILE B 32 1.295 1.700 -6.134 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -1.137 2.229 -3.321 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -0.483 3.823 -2.873 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -1.312 3.608 -4.433 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -0.030 -0.346 -5.782 1.00 0.00 H new ATOM 0 HD12 ILE B 32 0.991 -0.017 -4.362 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -0.748 0.356 -4.313 1.00 0.00 H new ATOM 1254 N ALA B 33 2.882 4.939 -3.194 1.00 0.00 N ATOM 1255 CA ALA B 33 3.329 5.802 -2.128 1.00 0.00 C ATOM 1256 C ALA B 33 3.891 7.120 -2.663 1.00 0.00 C ATOM 1257 O ALA B 33 4.539 7.819 -1.894 1.00 0.00 O ATOM 1258 CB ALA B 33 4.360 5.058 -1.281 1.00 0.00 C ATOM 0 H ALA B 33 3.574 4.240 -3.464 1.00 0.00 H new ATOM 0 HA ALA B 33 2.474 6.063 -1.504 1.00 0.00 H new ATOM 0 HB1 ALA B 33 4.702 5.705 -0.473 1.00 0.00 H new ATOM 0 HB2 ALA B 33 3.906 4.161 -0.860 1.00 0.00 H new ATOM 0 HB3 ALA B 33 5.209 4.777 -1.905 1.00 0.00 H new ATOM 1264 N HIS B 34 3.680 7.492 -3.934 1.00 0.00 N ATOM 1265 CA HIS B 34 4.226 8.732 -4.509 1.00 0.00 C ATOM 1266 C HIS B 34 5.755 8.753 -4.316 1.00 0.00 C ATOM 1267 O HIS B 34 6.361 9.777 -3.996 1.00 0.00 O ATOM 1268 CB HIS B 34 3.558 9.988 -3.912 1.00 0.00 C ATOM 1269 CG HIS B 34 2.106 10.240 -4.224 1.00 0.00 C ATOM 1270 ND1 HIS B 34 1.490 11.444 -3.986 1.00 0.00 N ATOM 1271 CD2 HIS B 34 1.196 9.417 -4.836 1.00 0.00 C ATOM 1272 CE1 HIS B 34 0.248 11.375 -4.486 1.00 0.00 C ATOM 1273 NE2 HIS B 34 0.026 10.164 -5.024 1.00 0.00 N ATOM 0 H HIS B 34 3.127 6.943 -4.592 1.00 0.00 H new ATOM 0 HA HIS B 34 4.004 8.749 -5.576 1.00 0.00 H new ATOM 0 HB2 HIS B 34 3.661 9.936 -2.828 1.00 0.00 H new ATOM 0 HB3 HIS B 34 4.126 10.857 -4.245 1.00 0.00 H new ATOM 0 HD2 HIS B 34 1.352 8.387 -5.120 1.00 0.00 H new ATOM 0 HE1 HIS B 34 -0.472 12.179 -4.460 1.00 0.00 H new ATOM 0 HE2 HIS B 34 -0.830 9.849 -5.481 1.00 0.00 H new ATOM 1281 N ASN B 35 6.393 7.592 -4.483 1.00 0.00 N ATOM 1282 CA ASN B 35 7.824 7.324 -4.344 1.00 0.00 C ATOM 1283 C ASN B 35 8.319 7.525 -2.900 1.00 0.00 C ATOM 1284 O ASN B 35 9.528 7.543 -2.671 1.00 0.00 O ATOM 1285 CB ASN B 35 8.659 8.064 -5.416 1.00 0.00 C ATOM 1286 CG ASN B 35 8.433 7.510 -6.823 1.00 0.00 C ATOM 1287 OD1 ASN B 35 7.308 7.253 -7.244 1.00 0.00 O ATOM 1288 ND2 ASN B 35 9.485 7.303 -7.595 1.00 0.00 N ATOM 0 H ASN B 35 5.880 6.749 -4.739 1.00 0.00 H new ATOM 0 HA ASN B 35 7.981 6.264 -4.545 1.00 0.00 H new ATOM 0 HB2 ASN B 35 8.405 9.124 -5.402 1.00 0.00 H new ATOM 0 HB3 ASN B 35 9.717 7.987 -5.165 1.00 0.00 H new ATOM 0 HD21 ASN B 35 9.361 6.931 -8.537 1.00 0.00 H new ATOM 0 HD22 ASN B 35 10.421 7.515 -7.249 1.00 0.00 H new ATOM 1295 N ASN B 36 7.423 7.692 -1.919 1.00 0.00 N ATOM 1296 CA ASN B 36 7.743 7.881 -0.503 1.00 0.00 C ATOM 1297 C ASN B 36 8.225 6.527 0.029 1.00 0.00 C ATOM 1298 O ASN B 36 7.418 5.614 0.208 1.00 0.00 O ATOM 1299 CB ASN B 36 6.498 8.377 0.258 1.00 0.00 C ATOM 1300 CG ASN B 36 6.784 8.738 1.707 1.00 0.00 C ATOM 1301 OD1 ASN B 36 7.586 8.102 2.384 1.00 0.00 O ATOM 1302 ND2 ASN B 36 6.108 9.735 2.246 1.00 0.00 N ATOM 0 H ASN B 36 6.419 7.699 -2.099 1.00 0.00 H new ATOM 0 HA ASN B 36 8.519 8.634 -0.365 1.00 0.00 H new ATOM 0 HB2 ASN B 36 6.092 9.250 -0.253 1.00 0.00 H new ATOM 0 HB3 ASN B 36 5.730 7.604 0.228 1.00 0.00 H new ATOM 0 HD21 ASN B 36 6.252 9.978 3.226 1.00 0.00 H new ATOM 0 HD22 ASN B 36 5.442 10.263 1.682 1.00 0.00 H new ATOM 1309 N ILE B 37 9.533 6.357 0.238 1.00 0.00 N ATOM 1310 CA ILE B 37 10.109 5.102 0.725 1.00 0.00 C ATOM 1311 C ILE B 37 9.625 4.747 2.132 1.00 0.00 C ATOM 1312 O ILE B 37 9.404 3.572 2.402 1.00 0.00 O ATOM 1313 CB ILE B 37 11.647 5.117 0.583 1.00 0.00 C ATOM 1314 CG1 ILE B 37 12.343 3.809 1.017 1.00 0.00 C ATOM 1315 CG2 ILE B 37 12.306 6.289 1.324 1.00 0.00 C ATOM 1316 CD1 ILE B 37 12.178 2.630 0.049 1.00 0.00 C ATOM 0 H ILE B 37 10.224 7.089 0.073 1.00 0.00 H new ATOM 0 HA ILE B 37 9.744 4.292 0.093 1.00 0.00 H new ATOM 0 HB ILE B 37 11.792 5.234 -0.491 1.00 0.00 H new ATOM 0 HG12 ILE B 37 13.407 4.007 1.145 1.00 0.00 H new ATOM 0 HG13 ILE B 37 11.954 3.515 1.992 1.00 0.00 H new ATOM 0 HG21 ILE B 37 13.386 6.245 1.187 1.00 0.00 H new ATOM 0 HG22 ILE B 37 11.928 7.230 0.925 1.00 0.00 H new ATOM 0 HG23 ILE B 37 12.072 6.225 2.387 1.00 0.00 H new ATOM 0 HD11 ILE B 37 12.703 1.760 0.443 1.00 0.00 H new ATOM 0 HD12 ILE B 37 11.119 2.396 -0.062 1.00 0.00 H new ATOM 0 HD13 ILE B 37 12.595 2.896 -0.922 1.00 0.00 H new ATOM 1328 N GLU B 38 9.464 5.721 3.026 1.00 0.00 N ATOM 1329 CA GLU B 38 8.995 5.466 4.393 1.00 0.00 C ATOM 1330 C GLU B 38 7.583 4.878 4.344 1.00 0.00 C ATOM 1331 O GLU B 38 7.302 3.847 4.961 1.00 0.00 O ATOM 1332 CB GLU B 38 8.998 6.762 5.211 1.00 0.00 C ATOM 1333 CG GLU B 38 10.404 7.273 5.563 1.00 0.00 C ATOM 1334 CD GLU B 38 11.075 6.514 6.723 1.00 0.00 C ATOM 1335 OE1 GLU B 38 10.527 5.513 7.236 1.00 0.00 O ATOM 1336 OE2 GLU B 38 12.182 6.913 7.162 1.00 0.00 O ATOM 0 H GLU B 38 9.653 6.704 2.828 1.00 0.00 H new ATOM 0 HA GLU B 38 9.667 4.755 4.874 1.00 0.00 H new ATOM 0 HB2 GLU B 38 8.471 7.535 4.651 1.00 0.00 H new ATOM 0 HB3 GLU B 38 8.440 6.599 6.133 1.00 0.00 H new ATOM 0 HG2 GLU B 38 11.038 7.199 4.679 1.00 0.00 H new ATOM 0 HG3 GLU B 38 10.341 8.330 5.822 1.00 0.00 H new ATOM 1343 N MET B 39 6.702 5.526 3.582 1.00 0.00 N ATOM 1344 CA MET B 39 5.322 5.106 3.409 1.00 0.00 C ATOM 1345 C MET B 39 5.327 3.728 2.754 1.00 0.00 C ATOM 1346 O MET B 39 4.693 2.810 3.264 1.00 0.00 O ATOM 1347 CB MET B 39 4.593 6.154 2.565 1.00 0.00 C ATOM 1348 CG MET B 39 3.071 6.023 2.508 1.00 0.00 C ATOM 1349 SD MET B 39 2.339 7.399 1.565 1.00 0.00 S ATOM 1350 CE MET B 39 0.705 7.552 2.338 1.00 0.00 C ATOM 0 H MET B 39 6.937 6.371 3.061 1.00 0.00 H new ATOM 0 HA MET B 39 4.796 5.028 4.360 1.00 0.00 H new ATOM 0 HB2 MET B 39 4.839 7.142 2.955 1.00 0.00 H new ATOM 0 HB3 MET B 39 4.981 6.107 1.547 1.00 0.00 H new ATOM 0 HG2 MET B 39 2.800 5.074 2.045 1.00 0.00 H new ATOM 0 HG3 MET B 39 2.664 6.012 3.519 1.00 0.00 H new ATOM 0 HE1 MET B 39 0.302 8.546 2.143 1.00 0.00 H new ATOM 0 HE2 MET B 39 0.034 6.800 1.922 1.00 0.00 H new ATOM 0 HE3 MET B 39 0.796 7.402 3.414 1.00 0.00 H new ATOM 1360 N ALA B 40 6.094 3.538 1.674 1.00 0.00 N ATOM 1361 CA ALA B 40 6.178 2.263 0.978 1.00 0.00 C ATOM 1362 C ALA B 40 6.635 1.153 1.928 1.00 0.00 C ATOM 1363 O ALA B 40 6.058 0.069 1.906 1.00 0.00 O ATOM 1364 CB ALA B 40 7.109 2.377 -0.228 1.00 0.00 C ATOM 0 H ALA B 40 6.673 4.270 1.263 1.00 0.00 H new ATOM 0 HA ALA B 40 5.184 1.999 0.616 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.162 1.416 -0.739 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.725 3.132 -0.914 1.00 0.00 H new ATOM 0 HB3 ALA B 40 8.105 2.665 0.107 1.00 0.00 H new ATOM 1370 N LYS B 41 7.642 1.404 2.776 1.00 0.00 N ATOM 1371 CA LYS B 41 8.149 0.428 3.744 1.00 0.00 C ATOM 1372 C LYS B 41 7.005 -0.039 4.643 1.00 0.00 C ATOM 1373 O LYS B 41 7.002 -1.207 5.036 1.00 0.00 O ATOM 1374 CB LYS B 41 9.304 1.020 4.577 1.00 0.00 C ATOM 1375 CG LYS B 41 10.656 0.980 3.848 1.00 0.00 C ATOM 1376 CD LYS B 41 11.719 1.803 4.584 1.00 0.00 C ATOM 1377 CE LYS B 41 13.070 1.729 3.854 1.00 0.00 C ATOM 1378 NZ LYS B 41 14.161 1.254 4.726 1.00 0.00 N ATOM 0 H LYS B 41 8.130 2.299 2.808 1.00 0.00 H new ATOM 0 HA LYS B 41 8.548 -0.431 3.204 1.00 0.00 H new ATOM 0 HB2 LYS B 41 9.067 2.053 4.833 1.00 0.00 H new ATOM 0 HB3 LYS B 41 9.387 0.470 5.514 1.00 0.00 H new ATOM 0 HG2 LYS B 41 10.992 -0.053 3.760 1.00 0.00 H new ATOM 0 HG3 LYS B 41 10.535 1.364 2.835 1.00 0.00 H new ATOM 0 HD2 LYS B 41 11.396 2.842 4.656 1.00 0.00 H new ATOM 0 HD3 LYS B 41 11.831 1.433 5.603 1.00 0.00 H new ATOM 0 HE2 LYS B 41 12.979 1.063 2.996 1.00 0.00 H new ATOM 0 HE3 LYS B 41 13.324 2.715 3.466 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 15.058 1.687 4.427 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 13.959 1.520 5.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 14.236 0.219 4.655 1.00 0.00 H new ATOM 1392 N ASN B 42 6.063 0.844 4.991 1.00 0.00 N ATOM 1393 CA ASN B 42 4.916 0.487 5.824 1.00 0.00 C ATOM 1394 C ASN B 42 4.018 -0.464 5.027 1.00 0.00 C ATOM 1395 O ASN B 42 3.629 -1.497 5.567 1.00 0.00 O ATOM 1396 CB ASN B 42 4.100 1.712 6.280 1.00 0.00 C ATOM 1397 CG ASN B 42 4.684 2.486 7.448 1.00 0.00 C ATOM 1398 OD1 ASN B 42 4.161 2.413 8.555 1.00 0.00 O ATOM 1399 ND2 ASN B 42 5.733 3.265 7.268 1.00 0.00 N ATOM 0 H ASN B 42 6.076 1.822 4.703 1.00 0.00 H new ATOM 0 HA ASN B 42 5.293 0.010 6.729 1.00 0.00 H new ATOM 0 HB2 ASN B 42 3.992 2.391 5.434 1.00 0.00 H new ATOM 0 HB3 ASN B 42 3.098 1.379 6.551 1.00 0.00 H new ATOM 0 HD21 ASN B 42 6.107 3.805 8.048 1.00 0.00 H new ATOM 0 HD22 ASN B 42 6.170 3.328 6.348 1.00 0.00 H new ATOM 1406 N ILE B 43 3.701 -0.143 3.760 1.00 0.00 N ATOM 1407 CA ILE B 43 2.851 -0.971 2.889 1.00 0.00 C ATOM 1408 C ILE B 43 3.437 -2.383 2.836 1.00 0.00 C ATOM 1409 O ILE B 43 2.781 -3.340 3.235 1.00 0.00 O ATOM 1410 CB ILE B 43 2.689 -0.388 1.454 1.00 0.00 C ATOM 1411 CG1 ILE B 43 2.324 1.110 1.437 1.00 0.00 C ATOM 1412 CG2 ILE B 43 1.601 -1.153 0.686 1.00 0.00 C ATOM 1413 CD1 ILE B 43 2.197 1.721 0.041 1.00 0.00 C ATOM 0 H ILE B 43 4.032 0.709 3.308 1.00 0.00 H new ATOM 0 HA ILE B 43 1.848 -0.987 3.316 1.00 0.00 H new ATOM 0 HB ILE B 43 3.663 -0.503 0.979 1.00 0.00 H new ATOM 0 HG12 ILE B 43 1.380 1.246 1.966 1.00 0.00 H new ATOM 0 HG13 ILE B 43 3.083 1.661 1.992 1.00 0.00 H new ATOM 0 HG21 ILE B 43 1.499 -0.734 -0.315 1.00 0.00 H new ATOM 0 HG22 ILE B 43 1.878 -2.205 0.613 1.00 0.00 H new ATOM 0 HG23 ILE B 43 0.652 -1.064 1.215 1.00 0.00 H new ATOM 0 HD11 ILE B 43 1.938 2.776 0.128 1.00 0.00 H new ATOM 0 HD12 ILE B 43 3.145 1.622 -0.487 1.00 0.00 H new ATOM 0 HD13 ILE B 43 1.417 1.201 -0.514 1.00 0.00 H new ATOM 1425 N LEU B 44 4.693 -2.484 2.400 1.00 0.00 N ATOM 1426 CA LEU B 44 5.467 -3.706 2.243 1.00 0.00 C ATOM 1427 C LEU B 44 5.483 -4.511 3.539 1.00 0.00 C ATOM 1428 O LEU B 44 5.298 -5.721 3.486 1.00 0.00 O ATOM 1429 CB LEU B 44 6.864 -3.343 1.695 1.00 0.00 C ATOM 1430 CG LEU B 44 6.799 -2.658 0.302 1.00 0.00 C ATOM 1431 CD1 LEU B 44 8.037 -1.796 0.028 1.00 0.00 C ATOM 1432 CD2 LEU B 44 6.578 -3.647 -0.852 1.00 0.00 C ATOM 0 H LEU B 44 5.227 -1.658 2.131 1.00 0.00 H new ATOM 0 HA LEU B 44 5.003 -4.369 1.513 1.00 0.00 H new ATOM 0 HB2 LEU B 44 7.365 -2.679 2.399 1.00 0.00 H new ATOM 0 HB3 LEU B 44 7.469 -4.247 1.623 1.00 0.00 H new ATOM 0 HG LEU B 44 5.924 -2.010 0.344 1.00 0.00 H new ATOM 0 HD11 LEU B 44 7.950 -1.336 -0.956 1.00 0.00 H new ATOM 0 HD12 LEU B 44 8.113 -1.017 0.787 1.00 0.00 H new ATOM 0 HD13 LEU B 44 8.930 -2.421 0.058 1.00 0.00 H new ATOM 0 HD21 LEU B 44 6.543 -3.103 -1.796 1.00 0.00 H new ATOM 0 HD22 LEU B 44 7.398 -4.365 -0.878 1.00 0.00 H new ATOM 0 HD23 LEU B 44 5.637 -4.176 -0.703 1.00 0.00 H new ATOM 1444 N ARG B 45 5.643 -3.871 4.700 1.00 0.00 N ATOM 1445 CA ARG B 45 5.661 -4.588 5.972 1.00 0.00 C ATOM 1446 C ARG B 45 4.338 -5.299 6.249 1.00 0.00 C ATOM 1447 O ARG B 45 4.360 -6.428 6.729 1.00 0.00 O ATOM 1448 CB ARG B 45 6.004 -3.615 7.108 1.00 0.00 C ATOM 1449 CG ARG B 45 6.351 -4.355 8.402 1.00 0.00 C ATOM 1450 CD ARG B 45 6.942 -3.383 9.427 1.00 0.00 C ATOM 1451 NE ARG B 45 7.530 -4.118 10.551 1.00 0.00 N ATOM 1452 CZ ARG B 45 8.342 -3.631 11.492 1.00 0.00 C ATOM 1453 NH1 ARG B 45 8.699 -2.349 11.496 1.00 0.00 N ATOM 1454 NH2 ARG B 45 8.819 -4.430 12.432 1.00 0.00 N ATOM 0 H ARG B 45 5.761 -2.861 4.783 1.00 0.00 H new ATOM 0 HA ARG B 45 6.428 -5.360 5.913 1.00 0.00 H new ATOM 0 HB2 ARG B 45 6.845 -2.989 6.810 1.00 0.00 H new ATOM 0 HB3 ARG B 45 5.159 -2.950 7.285 1.00 0.00 H new ATOM 0 HG2 ARG B 45 5.457 -4.826 8.811 1.00 0.00 H new ATOM 0 HG3 ARG B 45 7.064 -5.152 8.193 1.00 0.00 H new ATOM 0 HD2 ARG B 45 7.702 -2.763 8.953 1.00 0.00 H new ATOM 0 HD3 ARG B 45 6.164 -2.711 9.791 1.00 0.00 H new ATOM 0 HE ARG B 45 7.293 -5.108 10.622 1.00 0.00 H new ATOM 0 HH11 ARG B 45 8.351 -1.720 10.772 1.00 0.00 H new ATOM 0 HH12 ARG B 45 9.320 -1.995 12.223 1.00 0.00 H new ATOM 0 HH21 ARG B 45 8.566 -5.418 12.438 1.00 0.00 H new ATOM 0 HH22 ARG B 45 9.439 -4.058 13.151 1.00 0.00 H new ATOM 1468 N GLU B 46 3.201 -4.669 5.956 1.00 0.00 N ATOM 1469 CA GLU B 46 1.899 -5.271 6.212 1.00 0.00 C ATOM 1470 C GLU B 46 1.389 -6.135 5.060 1.00 0.00 C ATOM 1471 O GLU B 46 1.123 -7.321 5.250 1.00 0.00 O ATOM 1472 CB GLU B 46 0.870 -4.178 6.544 1.00 0.00 C ATOM 1473 CG GLU B 46 1.035 -3.588 7.950 1.00 0.00 C ATOM 1474 CD GLU B 46 0.953 -4.652 9.046 1.00 0.00 C ATOM 1475 OE1 GLU B 46 -0.125 -5.246 9.272 1.00 0.00 O ATOM 1476 OE2 GLU B 46 1.967 -4.875 9.745 1.00 0.00 O ATOM 0 H GLU B 46 3.159 -3.739 5.540 1.00 0.00 H new ATOM 0 HA GLU B 46 2.030 -5.938 7.064 1.00 0.00 H new ATOM 0 HB2 GLU B 46 0.954 -3.376 5.810 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -0.133 -4.594 6.449 1.00 0.00 H new ATOM 0 HG2 GLU B 46 1.996 -3.077 8.015 1.00 0.00 H new ATOM 0 HG3 GLU B 46 0.263 -2.838 8.118 1.00 0.00 H new ATOM 1483 N PHE B 47 1.245 -5.563 3.866 1.00 0.00 N ATOM 1484 CA PHE B 47 0.720 -6.260 2.702 1.00 0.00 C ATOM 1485 C PHE B 47 1.644 -7.285 2.065 1.00 0.00 C ATOM 1486 O PHE B 47 1.142 -8.166 1.364 1.00 0.00 O ATOM 1487 CB PHE B 47 0.298 -5.242 1.640 1.00 0.00 C ATOM 1488 CG PHE B 47 -1.006 -4.576 1.996 1.00 0.00 C ATOM 1489 CD1 PHE B 47 -2.221 -5.216 1.675 1.00 0.00 C ATOM 1490 CD2 PHE B 47 -1.010 -3.394 2.759 1.00 0.00 C ATOM 1491 CE1 PHE B 47 -3.437 -4.654 2.079 1.00 0.00 C ATOM 1492 CE2 PHE B 47 -2.228 -2.854 3.188 1.00 0.00 C ATOM 1493 CZ PHE B 47 -3.431 -3.475 2.834 1.00 0.00 C ATOM 0 H PHE B 47 1.494 -4.591 3.681 1.00 0.00 H new ATOM 0 HA PHE B 47 -0.125 -6.833 3.084 1.00 0.00 H new ATOM 0 HB2 PHE B 47 1.075 -4.486 1.531 1.00 0.00 H new ATOM 0 HB3 PHE B 47 0.201 -5.741 0.676 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -2.213 -6.141 1.117 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -0.080 -2.907 3.012 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.371 -5.125 1.811 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -2.239 -1.959 3.792 1.00 0.00 H new ATOM 0 HZ PHE B 47 -4.368 -3.039 3.148 1.00 0.00 H new ATOM 1503 N SER B 48 2.952 -7.190 2.284 1.00 0.00 N ATOM 1504 CA SER B 48 3.929 -8.101 1.706 1.00 0.00 C ATOM 1505 C SER B 48 4.727 -8.836 2.794 1.00 0.00 C ATOM 1506 O SER B 48 5.505 -9.737 2.472 1.00 0.00 O ATOM 1507 CB SER B 48 4.797 -7.264 0.753 1.00 0.00 C ATOM 1508 OG SER B 48 5.481 -8.037 -0.212 1.00 0.00 O ATOM 0 H SER B 48 3.366 -6.469 2.875 1.00 0.00 H new ATOM 0 HA SER B 48 3.451 -8.903 1.144 1.00 0.00 H new ATOM 0 HB2 SER B 48 4.165 -6.537 0.243 1.00 0.00 H new ATOM 0 HB3 SER B 48 5.524 -6.700 1.337 1.00 0.00 H new ATOM 0 HG SER B 48 6.013 -7.447 -0.787 1.00 0.00 H new ATOM 1514 N GLY B 49 4.547 -8.479 4.068 1.00 0.00 N ATOM 1515 CA GLY B 49 5.218 -9.073 5.210 1.00 0.00 C ATOM 1516 C GLY B 49 4.229 -9.864 6.065 1.00 0.00 C ATOM 1517 O GLY B 49 3.054 -9.998 5.711 1.00 0.00 O ATOM 0 H GLY B 49 3.901 -7.736 4.335 1.00 0.00 H new ATOM 0 HA2 GLY B 49 6.017 -9.730 4.867 1.00 0.00 H new ATOM 0 HA3 GLY B 49 5.683 -8.292 5.812 1.00 0.00 H new ATOM 1521 N PRO B 50 4.689 -10.429 7.189 1.00 0.00 N ATOM 1522 CA PRO B 50 3.853 -11.223 8.075 1.00 0.00 C ATOM 1523 C PRO B 50 2.862 -10.387 8.891 1.00 0.00 C ATOM 1524 O PRO B 50 3.212 -9.334 9.423 1.00 0.00 O ATOM 1525 CB PRO B 50 4.853 -11.957 8.966 1.00 0.00 C ATOM 1526 CG PRO B 50 6.017 -10.972 9.076 1.00 0.00 C ATOM 1527 CD PRO B 50 6.053 -10.337 7.691 1.00 0.00 C ATOM 0 HA PRO B 50 3.208 -11.899 7.514 1.00 0.00 H new ATOM 0 HB2 PRO B 50 4.428 -12.187 9.943 1.00 0.00 H new ATOM 0 HB3 PRO B 50 5.167 -12.903 8.524 1.00 0.00 H new ATOM 0 HG2 PRO B 50 5.847 -10.231 9.857 1.00 0.00 H new ATOM 0 HG3 PRO B 50 6.953 -11.477 9.314 1.00 0.00 H new ATOM 0 HD2 PRO B 50 6.384 -9.300 7.743 1.00 0.00 H new ATOM 0 HD3 PRO B 50 6.749 -10.861 7.036 1.00 0.00 H new ATOM 1535 N SER B 51 1.642 -10.905 9.072 1.00 0.00 N ATOM 1536 CA SER B 51 0.581 -10.243 9.836 1.00 0.00 C ATOM 1537 C SER B 51 0.832 -10.330 11.351 1.00 0.00 C ATOM 1538 O SER B 51 0.216 -9.588 12.115 1.00 0.00 O ATOM 1539 CB SER B 51 -0.773 -10.885 9.476 1.00 0.00 C ATOM 1540 OG SER B 51 -1.874 -10.050 9.788 1.00 0.00 O ATOM 0 H SER B 51 1.361 -11.807 8.687 1.00 0.00 H new ATOM 0 HA SER B 51 0.571 -9.185 9.573 1.00 0.00 H new ATOM 0 HB2 SER B 51 -0.789 -11.117 8.411 1.00 0.00 H new ATOM 0 HB3 SER B 51 -0.876 -11.830 10.010 1.00 0.00 H new ATOM 0 HG SER B 51 -2.708 -10.501 9.540 1.00 0.00 H new ATOM 1546 N SER B 52 1.730 -11.214 11.799 1.00 0.00 N ATOM 1547 CA SER B 52 2.054 -11.408 13.211 1.00 0.00 C ATOM 1548 C SER B 52 3.558 -11.293 13.507 1.00 0.00 C ATOM 1549 O SER B 52 3.958 -11.530 14.649 1.00 0.00 O ATOM 1550 CB SER B 52 1.524 -12.781 13.662 1.00 0.00 C ATOM 1551 OG SER B 52 0.152 -12.979 13.344 1.00 0.00 O ATOM 0 H SER B 52 2.260 -11.824 11.177 1.00 0.00 H new ATOM 0 HA SER B 52 1.572 -10.608 13.773 1.00 0.00 H new ATOM 0 HB2 SER B 52 2.117 -13.565 13.192 1.00 0.00 H new ATOM 0 HB3 SER B 52 1.660 -12.881 14.739 1.00 0.00 H new ATOM 0 HG SER B 52 -0.130 -13.866 13.651 1.00 0.00 H new ATOM 1557 N GLY B 53 4.399 -11.007 12.507 1.00 0.00 N ATOM 1558 CA GLY B 53 5.838 -10.884 12.697 1.00 0.00 C ATOM 1559 C GLY B 53 6.148 -9.517 13.259 1.00 0.00 C ATOM 1560 O GLY B 53 5.809 -8.514 12.592 1.00 0.00 O ATOM 0 H GLY B 53 4.095 -10.855 11.545 1.00 0.00 H new ATOM 0 HA2 GLY B 53 6.195 -11.659 13.375 1.00 0.00 H new ATOM 0 HA3 GLY B 53 6.356 -11.027 11.749 1.00 0.00 H new TER 1564 GLY B 53