USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 748 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: B 13 ASN : amide:sc=-0.00835 K(o=-0.015,f=1.3) USER MOD Set 1.2: B 19 THR OG1 : rot 180:sc=-0.00694 USER MOD Set 2.1: B 11 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 21 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 21 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: A 35 ASN : amide:sc= 0.607 K(o=0.61,f=-0.19) USER MOD Set 4.1: A 13 ASN : amide:sc=-0.00789 K(o=-0.016,f=1.3) USER MOD Set 4.2: A 19 THR OG1 : rot 180:sc=-0.00812 USER MOD Single : A 1 MET CE :methyl -128:sc= 0 (180deg=-0.2) USER MOD Single : A 1 MET N :NH3+ 161:sc= -0.197 (180deg=-0.385) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -161:sc= -0.0577 (180deg=-0.446) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.239 K(o=-0.24,f=-1.5!) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.914 K(o=-0.91,f=-0.25) USER MOD Single : A 48 TYR OH : rot 11:sc= 1.26 USER MOD Single : B 1 MET CE :methyl 177:sc= -0.493 (180deg=-0.54) USER MOD Single : B 1 MET N :NH3+ 131:sc= 0.0342 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 120:sc= 0.375 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 SER OG : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= -0.283 K(o=-0.28,f=-0.95) USER MOD Single : B 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 LYS NZ :NH3+ -165:sc= -0.0307 (180deg=-0.276) USER MOD Single : B 43 HIS : no HE2:sc= -1.27 X(o=-1.3,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.258 -2.060 -6.175 1.00 0.00 N ATOM 2 CA MET A 1 22.277 -1.397 -7.058 1.00 0.00 C ATOM 3 C MET A 1 22.945 -0.338 -7.924 1.00 0.00 C ATOM 4 O MET A 1 23.924 0.275 -7.506 1.00 0.00 O ATOM 5 CB MET A 1 21.101 -0.818 -6.259 1.00 0.00 C ATOM 6 CG MET A 1 21.522 -0.074 -4.996 1.00 0.00 C ATOM 7 SD MET A 1 20.152 0.448 -3.931 1.00 0.00 S ATOM 8 CE MET A 1 19.470 1.794 -4.925 1.00 0.00 C ATOM 0 H1 MET A 1 22.759 -2.527 -5.391 1.00 0.00 H new ATOM 0 H2 MET A 1 23.790 -2.769 -6.718 1.00 0.00 H new ATOM 0 H3 MET A 1 23.916 -1.351 -5.793 1.00 0.00 H new ATOM 0 HA MET A 1 21.868 -2.155 -7.726 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.538 -0.139 -6.899 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.426 -1.629 -5.984 1.00 0.00 H new ATOM 0 HG2 MET A 1 22.189 -0.715 -4.419 1.00 0.00 H new ATOM 0 HG3 MET A 1 22.096 0.807 -5.284 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.380 2.690 -4.311 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.132 1.996 -5.767 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.486 1.509 -5.297 1.00 0.00 H new ATOM 20 N LEU A 2 22.409 -0.129 -9.131 1.00 0.00 N ATOM 21 CA LEU A 2 22.909 0.853 -10.081 1.00 0.00 C ATOM 22 C LEU A 2 21.989 2.074 -10.054 1.00 0.00 C ATOM 23 O LEU A 2 20.870 2.022 -10.563 1.00 0.00 O ATOM 24 CB LEU A 2 22.956 0.235 -11.487 1.00 0.00 C ATOM 25 CG LEU A 2 24.034 0.838 -12.400 1.00 0.00 C ATOM 26 CD1 LEU A 2 23.627 0.740 -13.859 1.00 0.00 C ATOM 27 CD2 LEU A 2 24.379 2.293 -12.118 1.00 0.00 C ATOM 0 H LEU A 2 21.602 -0.650 -9.475 1.00 0.00 H new ATOM 0 HA LEU A 2 23.919 1.161 -9.811 1.00 0.00 H new ATOM 0 HB2 LEU A 2 23.130 -0.837 -11.396 1.00 0.00 H new ATOM 0 HB3 LEU A 2 21.982 0.360 -11.960 1.00 0.00 H new ATOM 0 HG LEU A 2 24.921 0.243 -12.183 1.00 0.00 H new ATOM 0 HD11 LEU A 2 24.407 1.174 -14.484 1.00 0.00 H new ATOM 0 HD12 LEU A 2 23.487 -0.307 -14.128 1.00 0.00 H new ATOM 0 HD13 LEU A 2 22.694 1.283 -14.014 1.00 0.00 H new ATOM 0 HD21 LEU A 2 25.149 2.626 -12.814 1.00 0.00 H new ATOM 0 HD22 LEU A 2 23.488 2.909 -12.241 1.00 0.00 H new ATOM 0 HD23 LEU A 2 24.748 2.388 -11.097 1.00 0.00 H new ATOM 39 N ILE A 3 22.458 3.173 -9.461 1.00 0.00 N ATOM 40 CA ILE A 3 21.681 4.394 -9.343 1.00 0.00 C ATOM 41 C ILE A 3 21.904 5.255 -10.582 1.00 0.00 C ATOM 42 O ILE A 3 23.007 5.301 -11.123 1.00 0.00 O ATOM 43 CB ILE A 3 22.086 5.146 -8.066 1.00 0.00 C ATOM 44 CG1 ILE A 3 21.684 4.358 -6.811 1.00 0.00 C ATOM 45 CG2 ILE A 3 21.388 6.507 -8.022 1.00 0.00 C ATOM 46 CD1 ILE A 3 22.699 3.278 -6.446 1.00 0.00 C ATOM 0 H ILE A 3 23.390 3.235 -9.050 1.00 0.00 H new ATOM 0 HA ILE A 3 20.620 4.155 -9.273 1.00 0.00 H new ATOM 0 HB ILE A 3 23.169 5.271 -8.082 1.00 0.00 H new ATOM 0 HG12 ILE A 3 21.575 5.047 -5.973 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.710 3.896 -6.973 1.00 0.00 H new ATOM 0 HG21 ILE A 3 21.679 7.036 -7.114 1.00 0.00 H new ATOM 0 HG22 ILE A 3 21.680 7.094 -8.893 1.00 0.00 H new ATOM 0 HG23 ILE A 3 20.308 6.362 -8.027 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.365 2.752 -5.552 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.790 2.571 -7.270 1.00 0.00 H new ATOM 0 HD13 ILE A 3 23.668 3.739 -6.255 1.00 0.00 H new ATOM 58 N LEU A 4 20.847 5.938 -11.027 1.00 0.00 N ATOM 59 CA LEU A 4 20.883 6.823 -12.179 1.00 0.00 C ATOM 60 C LEU A 4 19.977 8.024 -11.918 1.00 0.00 C ATOM 61 O LEU A 4 19.165 8.014 -10.993 1.00 0.00 O ATOM 62 CB LEU A 4 20.390 6.064 -13.421 1.00 0.00 C ATOM 63 CG LEU A 4 21.333 4.940 -13.865 1.00 0.00 C ATOM 64 CD1 LEU A 4 20.645 4.077 -14.918 1.00 0.00 C ATOM 65 CD2 LEU A 4 22.609 5.502 -14.488 1.00 0.00 C ATOM 0 H LEU A 4 19.929 5.886 -10.585 1.00 0.00 H new ATOM 0 HA LEU A 4 21.903 7.167 -12.348 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.407 5.642 -13.212 1.00 0.00 H new ATOM 0 HB3 LEU A 4 20.266 6.769 -14.243 1.00 0.00 H new ATOM 0 HG LEU A 4 21.585 4.354 -12.981 1.00 0.00 H new ATOM 0 HD11 LEU A 4 21.318 3.279 -15.231 1.00 0.00 H new ATOM 0 HD12 LEU A 4 19.739 3.642 -14.497 1.00 0.00 H new ATOM 0 HD13 LEU A 4 20.386 4.692 -15.780 1.00 0.00 H new ATOM 0 HD21 LEU A 4 23.257 4.681 -14.793 1.00 0.00 H new ATOM 0 HD22 LEU A 4 22.353 6.105 -15.359 1.00 0.00 H new ATOM 0 HD23 LEU A 4 23.128 6.122 -13.757 1.00 0.00 H new ATOM 77 N THR A 5 20.119 9.067 -12.741 1.00 0.00 N ATOM 78 CA THR A 5 19.253 10.237 -12.677 1.00 0.00 C ATOM 79 C THR A 5 18.554 10.393 -14.022 1.00 0.00 C ATOM 80 O THR A 5 19.179 10.217 -15.066 1.00 0.00 O ATOM 81 CB THR A 5 20.080 11.473 -12.312 1.00 0.00 C ATOM 82 OG1 THR A 5 20.687 11.275 -11.055 1.00 0.00 O ATOM 83 CG2 THR A 5 19.208 12.722 -12.224 1.00 0.00 C ATOM 0 H THR A 5 20.835 9.120 -13.465 1.00 0.00 H new ATOM 0 HA THR A 5 18.494 10.117 -11.904 1.00 0.00 H new ATOM 0 HB THR A 5 20.828 11.615 -13.092 1.00 0.00 H new ATOM 0 HG1 THR A 5 21.218 12.064 -10.820 1.00 0.00 H new ATOM 0 HG21 THR A 5 19.827 13.580 -11.963 1.00 0.00 H new ATOM 0 HG22 THR A 5 18.729 12.900 -13.187 1.00 0.00 H new ATOM 0 HG23 THR A 5 18.445 12.580 -11.459 1.00 0.00 H new ATOM 91 N ARG A 6 17.260 10.720 -14.009 1.00 0.00 N ATOM 92 CA ARG A 6 16.461 10.825 -15.223 1.00 0.00 C ATOM 93 C ARG A 6 15.529 12.026 -15.135 1.00 0.00 C ATOM 94 O ARG A 6 15.437 12.666 -14.090 1.00 0.00 O ATOM 95 CB ARG A 6 15.640 9.541 -15.392 1.00 0.00 C ATOM 96 CG ARG A 6 16.505 8.322 -15.732 1.00 0.00 C ATOM 97 CD ARG A 6 16.580 8.057 -17.238 1.00 0.00 C ATOM 98 NE ARG A 6 17.084 9.200 -18.010 1.00 0.00 N ATOM 99 CZ ARG A 6 18.370 9.481 -18.236 1.00 0.00 C ATOM 100 NH1 ARG A 6 19.340 8.768 -17.671 1.00 0.00 N ATOM 101 NH2 ARG A 6 18.686 10.490 -19.041 1.00 0.00 N ATOM 0 H ARG A 6 16.740 10.919 -13.154 1.00 0.00 H new ATOM 0 HA ARG A 6 17.120 10.958 -16.081 1.00 0.00 H new ATOM 0 HB2 ARG A 6 15.089 9.344 -14.472 1.00 0.00 H new ATOM 0 HB3 ARG A 6 14.902 9.688 -16.181 1.00 0.00 H new ATOM 0 HG2 ARG A 6 17.512 8.475 -15.343 1.00 0.00 H new ATOM 0 HG3 ARG A 6 16.100 7.442 -15.231 1.00 0.00 H new ATOM 0 HD2 ARG A 6 17.225 7.196 -17.416 1.00 0.00 H new ATOM 0 HD3 ARG A 6 15.587 7.792 -17.602 1.00 0.00 H new ATOM 0 HE ARG A 6 16.392 9.834 -18.408 1.00 0.00 H new ATOM 0 HH11 ARG A 6 19.108 7.991 -17.053 1.00 0.00 H new ATOM 0 HH12 ARG A 6 20.316 8.998 -17.856 1.00 0.00 H new ATOM 0 HH21 ARG A 6 17.949 11.042 -19.480 1.00 0.00 H new ATOM 0 HH22 ARG A 6 19.665 10.712 -19.220 1.00 0.00 H new ATOM 115 N LYS A 7 14.838 12.327 -16.236 1.00 0.00 N ATOM 116 CA LYS A 7 13.837 13.384 -16.300 1.00 0.00 C ATOM 117 C LYS A 7 12.488 12.766 -16.645 1.00 0.00 C ATOM 118 O LYS A 7 12.417 11.632 -17.113 1.00 0.00 O ATOM 119 CB LYS A 7 14.217 14.439 -17.349 1.00 0.00 C ATOM 120 CG LYS A 7 15.230 15.475 -16.852 1.00 0.00 C ATOM 121 CD LYS A 7 16.652 14.922 -16.724 1.00 0.00 C ATOM 122 CE LYS A 7 17.615 16.038 -16.313 1.00 0.00 C ATOM 123 NZ LYS A 7 17.689 17.098 -17.337 1.00 0.00 N ATOM 0 H LYS A 7 14.963 11.833 -17.120 1.00 0.00 H new ATOM 0 HA LYS A 7 13.782 13.881 -15.331 1.00 0.00 H new ATOM 0 HB2 LYS A 7 14.628 13.935 -18.224 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.314 14.956 -17.673 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.238 16.322 -17.538 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.906 15.853 -15.882 1.00 0.00 H new ATOM 0 HD2 LYS A 7 16.674 14.121 -15.985 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.969 14.489 -17.673 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.290 16.469 -15.366 1.00 0.00 H new ATOM 0 HE3 LYS A 7 18.608 15.620 -16.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.556 17.656 -17.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.704 16.666 -18.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 16.860 17.720 -17.253 1.00 0.00 H new ATOM 137 N VAL A 8 11.412 13.518 -16.412 1.00 0.00 N ATOM 138 CA VAL A 8 10.060 13.093 -16.744 1.00 0.00 C ATOM 139 C VAL A 8 9.965 12.862 -18.252 1.00 0.00 C ATOM 140 O VAL A 8 10.152 13.789 -19.037 1.00 0.00 O ATOM 141 CB VAL A 8 9.085 14.183 -16.292 1.00 0.00 C ATOM 142 CG1 VAL A 8 7.669 13.878 -16.769 1.00 0.00 C ATOM 143 CG2 VAL A 8 9.099 14.279 -14.766 1.00 0.00 C ATOM 0 H VAL A 8 11.459 14.443 -15.985 1.00 0.00 H new ATOM 0 HA VAL A 8 9.809 12.161 -16.238 1.00 0.00 H new ATOM 0 HB VAL A 8 9.400 15.131 -16.727 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.995 14.667 -16.435 1.00 0.00 H new ATOM 0 HG12 VAL A 8 7.655 13.825 -17.858 1.00 0.00 H new ATOM 0 HG13 VAL A 8 7.343 12.924 -16.355 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.405 15.055 -14.444 1.00 0.00 H new ATOM 0 HG22 VAL A 8 8.798 13.323 -14.338 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.104 14.528 -14.426 1.00 0.00 H new ATOM 153 N GLY A 9 9.670 11.621 -18.650 1.00 0.00 N ATOM 154 CA GLY A 9 9.533 11.230 -20.047 1.00 0.00 C ATOM 155 C GLY A 9 10.718 10.397 -20.534 1.00 0.00 C ATOM 156 O GLY A 9 10.671 9.852 -21.637 1.00 0.00 O ATOM 0 H GLY A 9 9.518 10.852 -17.997 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.613 10.659 -20.174 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.441 12.123 -20.665 1.00 0.00 H new ATOM 160 N GLU A 10 11.777 10.293 -19.726 1.00 0.00 N ATOM 161 CA GLU A 10 12.941 9.475 -20.040 1.00 0.00 C ATOM 162 C GLU A 10 12.656 8.006 -19.722 1.00 0.00 C ATOM 163 O GLU A 10 11.562 7.666 -19.270 1.00 0.00 O ATOM 164 CB GLU A 10 14.135 9.948 -19.209 1.00 0.00 C ATOM 165 CG GLU A 10 14.551 11.383 -19.535 1.00 0.00 C ATOM 166 CD GLU A 10 15.310 11.459 -20.854 1.00 0.00 C ATOM 167 OE1 GLU A 10 16.547 11.272 -20.801 1.00 0.00 O ATOM 168 OE2 GLU A 10 14.657 11.698 -21.893 1.00 0.00 O ATOM 0 H GLU A 10 11.846 10.779 -18.832 1.00 0.00 H new ATOM 0 HA GLU A 10 13.166 9.573 -21.102 1.00 0.00 H new ATOM 0 HB2 GLU A 10 13.886 9.878 -18.150 1.00 0.00 H new ATOM 0 HB3 GLU A 10 14.980 9.281 -19.382 1.00 0.00 H new ATOM 0 HG2 GLU A 10 13.666 12.017 -19.587 1.00 0.00 H new ATOM 0 HG3 GLU A 10 15.176 11.773 -18.732 1.00 0.00 H new ATOM 175 N SER A 11 13.641 7.132 -19.958 1.00 0.00 N ATOM 176 CA SER A 11 13.504 5.710 -19.668 1.00 0.00 C ATOM 177 C SER A 11 14.824 5.092 -19.207 1.00 0.00 C ATOM 178 O SER A 11 15.885 5.708 -19.292 1.00 0.00 O ATOM 179 CB SER A 11 13.023 4.974 -20.920 1.00 0.00 C ATOM 180 OG SER A 11 11.767 5.466 -21.337 1.00 0.00 O ATOM 0 H SER A 11 14.545 7.392 -20.352 1.00 0.00 H new ATOM 0 HA SER A 11 12.779 5.608 -18.861 1.00 0.00 H new ATOM 0 HB2 SER A 11 13.751 5.096 -21.722 1.00 0.00 H new ATOM 0 HB3 SER A 11 12.951 3.906 -20.715 1.00 0.00 H new ATOM 0 HG SER A 11 11.477 4.984 -22.140 1.00 0.00 H new ATOM 186 N ILE A 12 14.728 3.854 -18.717 1.00 0.00 N ATOM 187 CA ILE A 12 15.838 3.001 -18.315 1.00 0.00 C ATOM 188 C ILE A 12 15.650 1.671 -19.044 1.00 0.00 C ATOM 189 O ILE A 12 14.561 1.405 -19.548 1.00 0.00 O ATOM 190 CB ILE A 12 15.811 2.823 -16.787 1.00 0.00 C ATOM 191 CG1 ILE A 12 15.986 4.153 -16.042 1.00 0.00 C ATOM 192 CG2 ILE A 12 16.861 1.820 -16.299 1.00 0.00 C ATOM 193 CD1 ILE A 12 17.359 4.778 -16.279 1.00 0.00 C ATOM 0 H ILE A 12 13.824 3.400 -18.585 1.00 0.00 H new ATOM 0 HA ILE A 12 16.806 3.430 -18.573 1.00 0.00 H new ATOM 0 HB ILE A 12 14.822 2.426 -16.558 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.212 4.850 -16.363 1.00 0.00 H new ATOM 0 HG13 ILE A 12 15.844 3.989 -14.974 1.00 0.00 H new ATOM 0 HG21 ILE A 12 16.802 1.730 -15.214 1.00 0.00 H new ATOM 0 HG22 ILE A 12 16.675 0.848 -16.755 1.00 0.00 H new ATOM 0 HG23 ILE A 12 17.855 2.168 -16.580 1.00 0.00 H new ATOM 0 HD11 ILE A 12 17.431 5.717 -15.730 1.00 0.00 H new ATOM 0 HD12 ILE A 12 18.134 4.095 -15.933 1.00 0.00 H new ATOM 0 HD13 ILE A 12 17.493 4.969 -17.344 1.00 0.00 H new ATOM 205 N ASN A 13 16.683 0.828 -19.113 1.00 0.00 N ATOM 206 CA ASN A 13 16.560 -0.449 -19.794 1.00 0.00 C ATOM 207 C ASN A 13 17.263 -1.555 -19.011 1.00 0.00 C ATOM 208 O ASN A 13 18.315 -1.322 -18.419 1.00 0.00 O ATOM 209 CB ASN A 13 17.136 -0.312 -21.204 1.00 0.00 C ATOM 210 CG ASN A 13 16.529 -1.356 -22.125 1.00 0.00 C ATOM 211 OD1 ASN A 13 17.135 -2.386 -22.408 1.00 0.00 O ATOM 212 ND2 ASN A 13 15.315 -1.080 -22.592 1.00 0.00 N ATOM 0 H ASN A 13 17.602 1.010 -18.708 1.00 0.00 H new ATOM 0 HA ASN A 13 15.508 -0.728 -19.862 1.00 0.00 H new ATOM 0 HB2 ASN A 13 16.933 0.686 -21.591 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.219 -0.429 -21.175 1.00 0.00 H new ATOM 0 HD21 ASN A 13 14.846 -1.738 -23.215 1.00 0.00 H new ATOM 0 HD22 ASN A 13 14.852 -0.210 -22.328 1.00 0.00 H new ATOM 219 N ILE A 14 16.680 -2.760 -19.008 1.00 0.00 N ATOM 220 CA ILE A 14 17.215 -3.900 -18.277 1.00 0.00 C ATOM 221 C ILE A 14 16.965 -5.181 -19.071 1.00 0.00 C ATOM 222 O ILE A 14 15.969 -5.287 -19.785 1.00 0.00 O ATOM 223 CB ILE A 14 16.540 -4.008 -16.897 1.00 0.00 C ATOM 224 CG1 ILE A 14 16.551 -2.666 -16.149 1.00 0.00 C ATOM 225 CG2 ILE A 14 17.260 -5.072 -16.059 1.00 0.00 C ATOM 226 CD1 ILE A 14 15.748 -2.734 -14.850 1.00 0.00 C ATOM 0 H ILE A 14 15.820 -2.966 -19.517 1.00 0.00 H new ATOM 0 HA ILE A 14 18.287 -3.761 -18.138 1.00 0.00 H new ATOM 0 HB ILE A 14 15.499 -4.292 -17.053 1.00 0.00 H new ATOM 0 HG12 ILE A 14 17.580 -2.382 -15.926 1.00 0.00 H new ATOM 0 HG13 ILE A 14 16.138 -1.888 -16.791 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.783 -5.150 -15.082 1.00 0.00 H new ATOM 0 HG22 ILE A 14 17.204 -6.035 -16.567 1.00 0.00 H new ATOM 0 HG23 ILE A 14 18.305 -4.789 -15.931 1.00 0.00 H new ATOM 0 HD11 ILE A 14 15.781 -1.765 -14.351 1.00 0.00 H new ATOM 0 HD12 ILE A 14 14.713 -2.992 -15.075 1.00 0.00 H new ATOM 0 HD13 ILE A 14 16.177 -3.493 -14.196 1.00 0.00 H new ATOM 238 N GLY A 15 17.869 -6.158 -18.946 1.00 0.00 N ATOM 239 CA GLY A 15 17.703 -7.485 -19.526 1.00 0.00 C ATOM 240 C GLY A 15 17.542 -7.492 -21.048 1.00 0.00 C ATOM 241 O GLY A 15 17.232 -8.537 -21.616 1.00 0.00 O ATOM 0 H GLY A 15 18.743 -6.044 -18.433 1.00 0.00 H new ATOM 0 HA2 GLY A 15 18.567 -8.095 -19.261 1.00 0.00 H new ATOM 0 HA3 GLY A 15 16.829 -7.958 -19.078 1.00 0.00 H new ATOM 245 N ASP A 16 17.745 -6.344 -21.706 1.00 0.00 N ATOM 246 CA ASP A 16 17.604 -6.174 -23.150 1.00 0.00 C ATOM 247 C ASP A 16 16.172 -6.411 -23.656 1.00 0.00 C ATOM 248 O ASP A 16 15.935 -6.366 -24.862 1.00 0.00 O ATOM 249 CB ASP A 16 18.639 -7.049 -23.870 1.00 0.00 C ATOM 250 CG ASP A 16 18.760 -6.699 -25.352 1.00 0.00 C ATOM 251 OD1 ASP A 16 19.072 -5.522 -25.642 1.00 0.00 O ATOM 252 OD2 ASP A 16 18.541 -7.608 -26.182 1.00 0.00 O ATOM 0 H ASP A 16 18.020 -5.485 -21.230 1.00 0.00 H new ATOM 0 HA ASP A 16 17.804 -5.129 -23.386 1.00 0.00 H new ATOM 0 HB2 ASP A 16 19.610 -6.929 -23.390 1.00 0.00 H new ATOM 0 HB3 ASP A 16 18.360 -8.098 -23.768 1.00 0.00 H new ATOM 257 N ASP A 17 15.211 -6.663 -22.758 1.00 0.00 N ATOM 258 CA ASP A 17 13.812 -6.873 -23.127 1.00 0.00 C ATOM 259 C ASP A 17 12.864 -6.072 -22.235 1.00 0.00 C ATOM 260 O ASP A 17 11.648 -6.143 -22.417 1.00 0.00 O ATOM 261 CB ASP A 17 13.443 -8.356 -23.029 1.00 0.00 C ATOM 262 CG ASP A 17 14.297 -9.237 -23.936 1.00 0.00 C ATOM 263 OD1 ASP A 17 14.179 -9.080 -25.173 1.00 0.00 O ATOM 264 OD2 ASP A 17 15.062 -10.063 -23.391 1.00 0.00 O ATOM 0 H ASP A 17 15.386 -6.726 -21.755 1.00 0.00 H new ATOM 0 HA ASP A 17 13.703 -6.529 -24.156 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.556 -8.687 -21.997 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.393 -8.483 -23.291 1.00 0.00 H new ATOM 269 N ILE A 18 13.399 -5.311 -21.275 1.00 0.00 N ATOM 270 CA ILE A 18 12.587 -4.564 -20.327 1.00 0.00 C ATOM 271 C ILE A 18 12.980 -3.092 -20.363 1.00 0.00 C ATOM 272 O ILE A 18 14.162 -2.765 -20.428 1.00 0.00 O ATOM 273 CB ILE A 18 12.761 -5.152 -18.920 1.00 0.00 C ATOM 274 CG1 ILE A 18 12.371 -6.636 -18.920 1.00 0.00 C ATOM 275 CG2 ILE A 18 11.905 -4.370 -17.919 1.00 0.00 C ATOM 276 CD1 ILE A 18 12.685 -7.300 -17.579 1.00 0.00 C ATOM 0 H ILE A 18 14.404 -5.200 -21.139 1.00 0.00 H new ATOM 0 HA ILE A 18 11.535 -4.642 -20.600 1.00 0.00 H new ATOM 0 HB ILE A 18 13.806 -5.069 -18.623 1.00 0.00 H new ATOM 0 HG12 ILE A 18 11.307 -6.733 -19.134 1.00 0.00 H new ATOM 0 HG13 ILE A 18 12.905 -7.153 -19.717 1.00 0.00 H new ATOM 0 HG21 ILE A 18 12.033 -4.793 -16.922 1.00 0.00 H new ATOM 0 HG22 ILE A 18 12.216 -3.325 -17.913 1.00 0.00 H new ATOM 0 HG23 ILE A 18 10.856 -4.435 -18.208 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.395 -8.350 -17.616 1.00 0.00 H new ATOM 0 HD12 ILE A 18 13.754 -7.225 -17.377 1.00 0.00 H new ATOM 0 HD13 ILE A 18 12.130 -6.799 -16.786 1.00 0.00 H new ATOM 288 N THR A 19 11.981 -2.208 -20.322 1.00 0.00 N ATOM 289 CA THR A 19 12.190 -0.768 -20.347 1.00 0.00 C ATOM 290 C THR A 19 11.374 -0.128 -19.234 1.00 0.00 C ATOM 291 O THR A 19 10.208 -0.468 -19.049 1.00 0.00 O ATOM 292 CB THR A 19 11.781 -0.202 -21.712 1.00 0.00 C ATOM 293 OG1 THR A 19 12.401 -0.930 -22.748 1.00 0.00 O ATOM 294 CG2 THR A 19 12.191 1.262 -21.840 1.00 0.00 C ATOM 0 H THR A 19 10.999 -2.478 -20.270 1.00 0.00 H new ATOM 0 HA THR A 19 13.245 -0.545 -20.189 1.00 0.00 H new ATOM 0 HB THR A 19 10.697 -0.284 -21.792 1.00 0.00 H new ATOM 0 HG1 THR A 19 12.131 -0.560 -23.615 1.00 0.00 H new ATOM 0 HG21 THR A 19 11.890 1.640 -22.817 1.00 0.00 H new ATOM 0 HG22 THR A 19 11.704 1.846 -21.059 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.273 1.347 -21.736 1.00 0.00 H new ATOM 302 N ILE A 20 11.982 0.797 -18.492 1.00 0.00 N ATOM 303 CA ILE A 20 11.341 1.414 -17.336 1.00 0.00 C ATOM 304 C ILE A 20 11.228 2.922 -17.546 1.00 0.00 C ATOM 305 O ILE A 20 12.171 3.666 -17.278 1.00 0.00 O ATOM 306 CB ILE A 20 12.112 1.086 -16.047 1.00 0.00 C ATOM 307 CG1 ILE A 20 12.494 -0.398 -15.928 1.00 0.00 C ATOM 308 CG2 ILE A 20 11.283 1.521 -14.837 1.00 0.00 C ATOM 309 CD1 ILE A 20 11.286 -1.331 -15.855 1.00 0.00 C ATOM 0 H ILE A 20 12.926 1.137 -18.675 1.00 0.00 H new ATOM 0 HA ILE A 20 10.336 1.006 -17.230 1.00 0.00 H new ATOM 0 HB ILE A 20 13.051 1.639 -16.082 1.00 0.00 H new ATOM 0 HG12 ILE A 20 13.108 -0.677 -16.784 1.00 0.00 H new ATOM 0 HG13 ILE A 20 13.106 -0.538 -15.037 1.00 0.00 H new ATOM 0 HG21 ILE A 20 11.827 1.290 -13.921 1.00 0.00 H new ATOM 0 HG22 ILE A 20 11.099 2.594 -14.889 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.331 0.989 -14.838 1.00 0.00 H new ATOM 0 HD11 ILE A 20 11.628 -2.363 -15.772 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.683 -1.077 -14.983 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.685 -1.219 -16.757 1.00 0.00 H new ATOM 321 N THR A 21 10.069 3.372 -18.028 1.00 0.00 N ATOM 322 CA THR A 21 9.807 4.783 -18.280 1.00 0.00 C ATOM 323 C THR A 21 9.487 5.501 -16.967 1.00 0.00 C ATOM 324 O THR A 21 9.131 4.861 -15.978 1.00 0.00 O ATOM 325 CB THR A 21 8.622 4.903 -19.247 1.00 0.00 C ATOM 326 OG1 THR A 21 8.780 3.983 -20.306 1.00 0.00 O ATOM 327 CG2 THR A 21 8.526 6.299 -19.859 1.00 0.00 C ATOM 0 H THR A 21 9.284 2.762 -18.255 1.00 0.00 H new ATOM 0 HA THR A 21 10.690 5.246 -18.721 1.00 0.00 H new ATOM 0 HB THR A 21 7.717 4.700 -18.674 1.00 0.00 H new ATOM 0 HG1 THR A 21 8.022 4.060 -20.922 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.674 6.341 -20.537 1.00 0.00 H new ATOM 0 HG22 THR A 21 8.395 7.036 -19.066 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.440 6.518 -20.411 1.00 0.00 H new ATOM 335 N ILE A 22 9.613 6.831 -16.953 1.00 0.00 N ATOM 336 CA ILE A 22 9.252 7.671 -15.820 1.00 0.00 C ATOM 337 C ILE A 22 8.230 8.688 -16.323 1.00 0.00 C ATOM 338 O ILE A 22 8.585 9.719 -16.892 1.00 0.00 O ATOM 339 CB ILE A 22 10.511 8.286 -15.182 1.00 0.00 C ATOM 340 CG1 ILE A 22 10.182 9.430 -14.217 1.00 0.00 C ATOM 341 CG2 ILE A 22 11.497 8.808 -16.230 1.00 0.00 C ATOM 342 CD1 ILE A 22 9.290 8.959 -13.072 1.00 0.00 C ATOM 0 H ILE A 22 9.976 7.359 -17.747 1.00 0.00 H new ATOM 0 HA ILE A 22 8.790 7.102 -15.013 1.00 0.00 H new ATOM 0 HB ILE A 22 10.972 7.470 -14.625 1.00 0.00 H new ATOM 0 HG12 ILE A 22 11.106 9.843 -13.813 1.00 0.00 H new ATOM 0 HG13 ILE A 22 9.684 10.233 -14.760 1.00 0.00 H new ATOM 0 HG21 ILE A 22 12.368 9.232 -15.731 1.00 0.00 H new ATOM 0 HG22 ILE A 22 11.812 7.987 -16.874 1.00 0.00 H new ATOM 0 HG23 ILE A 22 11.014 9.577 -16.833 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.078 9.797 -12.408 1.00 0.00 H new ATOM 0 HD12 ILE A 22 8.355 8.570 -13.475 1.00 0.00 H new ATOM 0 HD13 ILE A 22 9.799 8.174 -12.514 1.00 0.00 H new ATOM 354 N LEU A 23 6.945 8.390 -16.110 1.00 0.00 N ATOM 355 CA LEU A 23 5.857 9.155 -16.696 1.00 0.00 C ATOM 356 C LEU A 23 5.696 10.508 -16.016 1.00 0.00 C ATOM 357 O LEU A 23 5.175 11.440 -16.627 1.00 0.00 O ATOM 358 CB LEU A 23 4.546 8.372 -16.581 1.00 0.00 C ATOM 359 CG LEU A 23 4.669 6.913 -17.031 1.00 0.00 C ATOM 360 CD1 LEU A 23 3.276 6.290 -17.028 1.00 0.00 C ATOM 361 CD2 LEU A 23 5.250 6.795 -18.438 1.00 0.00 C ATOM 0 H LEU A 23 6.637 7.612 -15.527 1.00 0.00 H new ATOM 0 HA LEU A 23 6.099 9.324 -17.745 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.205 8.398 -15.546 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.782 8.867 -17.181 1.00 0.00 H new ATOM 0 HG LEU A 23 5.342 6.400 -16.344 1.00 0.00 H new ATOM 0 HD11 LEU A 23 3.342 5.250 -17.346 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.859 6.336 -16.022 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.631 6.839 -17.714 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.319 5.743 -18.716 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.602 7.315 -19.144 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.244 7.242 -18.460 1.00 0.00 H new ATOM 373 N GLY A 24 6.135 10.626 -14.758 1.00 0.00 N ATOM 374 CA GLY A 24 6.084 11.911 -14.079 1.00 0.00 C ATOM 375 C GLY A 24 6.171 11.793 -12.564 1.00 0.00 C ATOM 376 O GLY A 24 6.386 10.711 -12.019 1.00 0.00 O ATOM 0 H GLY A 24 6.521 9.861 -14.205 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.903 12.536 -14.436 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.157 12.418 -14.345 1.00 0.00 H new ATOM 380 N VAL A 25 5.998 12.934 -11.891 1.00 0.00 N ATOM 381 CA VAL A 25 6.078 13.045 -10.443 1.00 0.00 C ATOM 382 C VAL A 25 4.813 13.715 -9.914 1.00 0.00 C ATOM 383 O VAL A 25 4.176 14.497 -10.617 1.00 0.00 O ATOM 384 CB VAL A 25 7.350 13.824 -10.072 1.00 0.00 C ATOM 385 CG1 VAL A 25 7.342 15.232 -10.673 1.00 0.00 C ATOM 386 CG2 VAL A 25 7.519 13.943 -8.559 1.00 0.00 C ATOM 0 H VAL A 25 5.795 13.821 -12.352 1.00 0.00 H new ATOM 0 HA VAL A 25 6.142 12.060 -9.981 1.00 0.00 H new ATOM 0 HB VAL A 25 8.184 13.257 -10.484 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.256 15.754 -10.390 1.00 0.00 H new ATOM 0 HG12 VAL A 25 7.285 15.164 -11.759 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.479 15.783 -10.298 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.429 14.500 -8.337 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.661 14.467 -8.137 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.587 12.947 -8.121 1.00 0.00 H new ATOM 396 N SER A 26 4.454 13.404 -8.666 1.00 0.00 N ATOM 397 CA SER A 26 3.278 13.947 -8.003 1.00 0.00 C ATOM 398 C SER A 26 3.594 14.145 -6.523 1.00 0.00 C ATOM 399 O SER A 26 3.157 13.364 -5.678 1.00 0.00 O ATOM 400 CB SER A 26 2.087 13.003 -8.184 1.00 0.00 C ATOM 401 OG SER A 26 1.788 12.847 -9.556 1.00 0.00 O ATOM 0 H SER A 26 4.985 12.757 -8.083 1.00 0.00 H new ATOM 0 HA SER A 26 3.013 14.908 -8.445 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.313 12.033 -7.742 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.218 13.398 -7.658 1.00 0.00 H new ATOM 0 HG SER A 26 1.026 12.240 -9.658 1.00 0.00 H new ATOM 407 N GLY A 27 4.355 15.197 -6.217 1.00 0.00 N ATOM 408 CA GLY A 27 4.787 15.498 -4.864 1.00 0.00 C ATOM 409 C GLY A 27 5.623 14.357 -4.297 1.00 0.00 C ATOM 410 O GLY A 27 6.699 14.058 -4.813 1.00 0.00 O ATOM 0 H GLY A 27 4.688 15.866 -6.912 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.370 16.419 -4.860 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.918 15.668 -4.229 1.00 0.00 H new ATOM 414 N GLN A 28 5.129 13.722 -3.232 1.00 0.00 N ATOM 415 CA GLN A 28 5.814 12.618 -2.578 1.00 0.00 C ATOM 416 C GLN A 28 5.721 11.325 -3.397 1.00 0.00 C ATOM 417 O GLN A 28 6.285 10.308 -3.000 1.00 0.00 O ATOM 418 CB GLN A 28 5.197 12.422 -1.188 1.00 0.00 C ATOM 419 CG GLN A 28 6.139 11.691 -0.228 1.00 0.00 C ATOM 420 CD GLN A 28 7.382 12.518 0.073 1.00 0.00 C ATOM 421 OE1 GLN A 28 8.495 12.122 -0.258 1.00 0.00 O ATOM 422 NE2 GLN A 28 7.203 13.675 0.705 1.00 0.00 N ATOM 0 H GLN A 28 4.237 13.965 -2.801 1.00 0.00 H new ATOM 0 HA GLN A 28 6.874 12.859 -2.490 1.00 0.00 H new ATOM 0 HB2 GLN A 28 4.938 13.394 -0.768 1.00 0.00 H new ATOM 0 HB3 GLN A 28 4.269 11.858 -1.282 1.00 0.00 H new ATOM 0 HG2 GLN A 28 5.614 11.471 0.701 1.00 0.00 H new ATOM 0 HG3 GLN A 28 6.433 10.735 -0.662 1.00 0.00 H new ATOM 0 HE21 GLN A 28 6.263 13.974 0.966 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.006 14.263 0.929 1.00 0.00 H new ATOM 431 N GLN A 29 5.020 11.348 -4.537 1.00 0.00 N ATOM 432 CA GLN A 29 4.821 10.155 -5.347 1.00 0.00 C ATOM 433 C GLN A 29 5.470 10.298 -6.721 1.00 0.00 C ATOM 434 O GLN A 29 5.814 11.401 -7.143 1.00 0.00 O ATOM 435 CB GLN A 29 3.328 9.857 -5.489 1.00 0.00 C ATOM 436 CG GLN A 29 2.585 9.986 -4.158 1.00 0.00 C ATOM 437 CD GLN A 29 1.157 9.483 -4.289 1.00 0.00 C ATOM 438 OE1 GLN A 29 0.757 8.539 -3.614 1.00 0.00 O ATOM 439 NE2 GLN A 29 0.379 10.112 -5.159 1.00 0.00 N ATOM 0 H GLN A 29 4.582 12.188 -4.915 1.00 0.00 H new ATOM 0 HA GLN A 29 5.303 9.320 -4.839 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.890 10.541 -6.216 1.00 0.00 H new ATOM 0 HB3 GLN A 29 3.196 8.848 -5.881 1.00 0.00 H new ATOM 0 HG2 GLN A 29 3.107 9.418 -3.388 1.00 0.00 H new ATOM 0 HG3 GLN A 29 2.581 11.028 -3.838 1.00 0.00 H new ATOM 0 HE21 GLN A 29 0.748 10.893 -5.702 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -0.589 9.815 -5.285 1.00 0.00 H new ATOM 448 N VAL A 30 5.637 9.169 -7.419 1.00 0.00 N ATOM 449 CA VAL A 30 6.296 9.104 -8.716 1.00 0.00 C ATOM 450 C VAL A 30 5.634 8.034 -9.582 1.00 0.00 C ATOM 451 O VAL A 30 5.550 6.876 -9.178 1.00 0.00 O ATOM 452 CB VAL A 30 7.779 8.771 -8.515 1.00 0.00 C ATOM 453 CG1 VAL A 30 8.483 8.667 -9.866 1.00 0.00 C ATOM 454 CG2 VAL A 30 8.476 9.862 -7.702 1.00 0.00 C ATOM 0 H VAL A 30 5.310 8.262 -7.087 1.00 0.00 H new ATOM 0 HA VAL A 30 6.206 10.067 -9.218 1.00 0.00 H new ATOM 0 HB VAL A 30 7.834 7.822 -7.982 1.00 0.00 H new ATOM 0 HG11 VAL A 30 9.536 8.430 -9.711 1.00 0.00 H new ATOM 0 HG12 VAL A 30 8.018 7.880 -10.459 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.399 9.617 -10.394 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.527 9.604 -7.572 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.398 10.813 -8.228 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.000 9.948 -6.725 1.00 0.00 H new ATOM 464 N ARG A 31 5.166 8.420 -10.775 1.00 0.00 N ATOM 465 CA ARG A 31 4.522 7.494 -11.697 1.00 0.00 C ATOM 466 C ARG A 31 5.541 6.907 -12.667 1.00 0.00 C ATOM 467 O ARG A 31 6.024 7.595 -13.565 1.00 0.00 O ATOM 468 CB ARG A 31 3.373 8.182 -12.436 1.00 0.00 C ATOM 469 CG ARG A 31 2.632 7.161 -13.298 1.00 0.00 C ATOM 470 CD ARG A 31 1.273 7.708 -13.735 1.00 0.00 C ATOM 471 NE ARG A 31 0.361 7.762 -12.585 1.00 0.00 N ATOM 472 CZ ARG A 31 -0.966 7.905 -12.633 1.00 0.00 C ATOM 473 NH1 ARG A 31 -1.616 8.032 -13.788 1.00 0.00 N ATOM 474 NH2 ARG A 31 -1.657 7.921 -11.496 1.00 0.00 N ATOM 0 H ARG A 31 5.225 9.378 -11.121 1.00 0.00 H new ATOM 0 HA ARG A 31 4.099 6.669 -11.124 1.00 0.00 H new ATOM 0 HB2 ARG A 31 2.687 8.635 -11.720 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.760 8.987 -13.060 1.00 0.00 H new ATOM 0 HG2 ARG A 31 3.230 6.916 -14.176 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.494 6.236 -12.738 1.00 0.00 H new ATOM 0 HD2 ARG A 31 1.393 8.704 -14.162 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.851 7.075 -14.515 1.00 0.00 H new ATOM 0 HE ARG A 31 0.782 7.683 -11.659 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.100 8.022 -14.668 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.630 8.140 -13.793 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.173 7.825 -10.603 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.671 8.030 -11.517 1.00 0.00 H new ATOM 488 N ILE A 32 5.852 5.624 -12.465 1.00 0.00 N ATOM 489 CA ILE A 32 6.780 4.846 -13.275 1.00 0.00 C ATOM 490 C ILE A 32 5.974 3.950 -14.222 1.00 0.00 C ATOM 491 O ILE A 32 4.806 3.667 -13.962 1.00 0.00 O ATOM 492 CB ILE A 32 7.676 4.023 -12.332 1.00 0.00 C ATOM 493 CG1 ILE A 32 8.442 4.979 -11.402 1.00 0.00 C ATOM 494 CG2 ILE A 32 8.668 3.154 -13.111 1.00 0.00 C ATOM 495 CD1 ILE A 32 9.257 4.234 -10.345 1.00 0.00 C ATOM 0 H ILE A 32 5.446 5.082 -11.702 1.00 0.00 H new ATOM 0 HA ILE A 32 7.418 5.489 -13.880 1.00 0.00 H new ATOM 0 HB ILE A 32 7.039 3.358 -11.749 1.00 0.00 H new ATOM 0 HG12 ILE A 32 9.108 5.604 -11.997 1.00 0.00 H new ATOM 0 HG13 ILE A 32 7.735 5.646 -10.909 1.00 0.00 H new ATOM 0 HG21 ILE A 32 9.283 2.588 -12.412 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.121 2.464 -13.754 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.307 3.791 -13.723 1.00 0.00 H new ATOM 0 HD11 ILE A 32 9.779 4.954 -9.714 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.590 3.629 -9.731 1.00 0.00 H new ATOM 0 HD13 ILE A 32 9.984 3.587 -10.836 1.00 0.00 H new ATOM 507 N GLY A 33 6.590 3.502 -15.320 1.00 0.00 N ATOM 508 CA GLY A 33 5.939 2.652 -16.306 1.00 0.00 C ATOM 509 C GLY A 33 6.840 1.485 -16.696 1.00 0.00 C ATOM 510 O GLY A 33 7.802 1.668 -17.440 1.00 0.00 O ATOM 0 H GLY A 33 7.560 3.723 -15.546 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.000 2.273 -15.902 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.692 3.238 -17.191 1.00 0.00 H new ATOM 514 N ILE A 34 6.530 0.285 -16.196 1.00 0.00 N ATOM 515 CA ILE A 34 7.308 -0.912 -16.478 1.00 0.00 C ATOM 516 C ILE A 34 6.843 -1.533 -17.794 1.00 0.00 C ATOM 517 O ILE A 34 5.669 -1.867 -17.944 1.00 0.00 O ATOM 518 CB ILE A 34 7.162 -1.929 -15.335 1.00 0.00 C ATOM 519 CG1 ILE A 34 7.702 -1.405 -13.996 1.00 0.00 C ATOM 520 CG2 ILE A 34 7.961 -3.185 -15.702 1.00 0.00 C ATOM 521 CD1 ILE A 34 6.716 -0.494 -13.261 1.00 0.00 C ATOM 0 H ILE A 34 5.730 0.122 -15.584 1.00 0.00 H new ATOM 0 HA ILE A 34 8.359 -0.636 -16.564 1.00 0.00 H new ATOM 0 HB ILE A 34 6.098 -2.131 -15.213 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.950 -2.252 -13.356 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.628 -0.858 -14.174 1.00 0.00 H new ATOM 0 HG21 ILE A 34 7.870 -3.920 -14.903 1.00 0.00 H new ATOM 0 HG22 ILE A 34 7.571 -3.606 -16.629 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.010 -2.922 -15.836 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.160 -0.159 -12.323 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.486 0.371 -13.883 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.799 -1.044 -13.052 1.00 0.00 H new ATOM 533 N ASN A 35 7.763 -1.688 -18.749 1.00 0.00 N ATOM 534 CA ASN A 35 7.482 -2.299 -20.040 1.00 0.00 C ATOM 535 C ASN A 35 8.236 -3.621 -20.145 1.00 0.00 C ATOM 536 O ASN A 35 9.449 -3.631 -20.343 1.00 0.00 O ATOM 537 CB ASN A 35 7.899 -1.374 -21.187 1.00 0.00 C ATOM 538 CG ASN A 35 7.297 0.017 -21.092 1.00 0.00 C ATOM 539 OD1 ASN A 35 6.300 0.310 -21.745 1.00 0.00 O ATOM 540 ND2 ASN A 35 7.899 0.881 -20.281 1.00 0.00 N ATOM 0 H ASN A 35 8.732 -1.388 -18.642 1.00 0.00 H new ATOM 0 HA ASN A 35 6.409 -2.475 -20.117 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.986 -1.291 -21.200 1.00 0.00 H new ATOM 0 HB3 ASN A 35 7.603 -1.826 -22.134 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.534 1.828 -20.184 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.726 0.597 -19.756 1.00 0.00 H new ATOM 547 N ALA A 36 7.514 -4.732 -20.013 1.00 0.00 N ATOM 548 CA ALA A 36 8.074 -6.071 -20.104 1.00 0.00 C ATOM 549 C ALA A 36 7.045 -6.994 -20.758 1.00 0.00 C ATOM 550 O ALA A 36 5.845 -6.728 -20.678 1.00 0.00 O ATOM 551 CB ALA A 36 8.404 -6.548 -18.692 1.00 0.00 C ATOM 0 H ALA A 36 6.509 -4.723 -19.837 1.00 0.00 H new ATOM 0 HA ALA A 36 8.982 -6.076 -20.708 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.826 -7.552 -18.736 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.127 -5.870 -18.239 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.495 -6.563 -18.091 1.00 0.00 H new ATOM 557 N PRO A 37 7.490 -8.079 -21.405 1.00 0.00 N ATOM 558 CA PRO A 37 6.600 -9.046 -22.019 1.00 0.00 C ATOM 559 C PRO A 37 5.928 -9.892 -20.943 1.00 0.00 C ATOM 560 O PRO A 37 6.375 -9.923 -19.797 1.00 0.00 O ATOM 561 CB PRO A 37 7.508 -9.893 -22.911 1.00 0.00 C ATOM 562 CG PRO A 37 8.842 -9.863 -22.165 1.00 0.00 C ATOM 563 CD PRO A 37 8.880 -8.448 -21.591 1.00 0.00 C ATOM 0 HA PRO A 37 5.796 -8.582 -22.591 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.130 -10.909 -23.023 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.596 -9.473 -23.913 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.883 -10.619 -21.380 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.683 -10.051 -22.833 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.425 -8.420 -20.648 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.383 -7.760 -22.271 1.00 0.00 H new ATOM 571 N LYS A 38 4.847 -10.589 -21.303 1.00 0.00 N ATOM 572 CA LYS A 38 4.134 -11.454 -20.369 1.00 0.00 C ATOM 573 C LYS A 38 4.955 -12.705 -20.046 1.00 0.00 C ATOM 574 O LYS A 38 4.521 -13.539 -19.254 1.00 0.00 O ATOM 575 CB LYS A 38 2.760 -11.821 -20.938 1.00 0.00 C ATOM 576 CG LYS A 38 1.714 -10.733 -20.661 1.00 0.00 C ATOM 577 CD LYS A 38 2.015 -9.407 -21.360 1.00 0.00 C ATOM 578 CE LYS A 38 0.859 -8.443 -21.094 1.00 0.00 C ATOM 579 NZ LYS A 38 1.084 -7.134 -21.733 1.00 0.00 N ATOM 0 H LYS A 38 4.447 -10.568 -22.241 1.00 0.00 H new ATOM 0 HA LYS A 38 3.985 -10.913 -19.435 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.843 -11.979 -22.013 1.00 0.00 H new ATOM 0 HB3 LYS A 38 2.427 -12.763 -20.503 1.00 0.00 H new ATOM 0 HG2 LYS A 38 0.736 -11.090 -20.982 1.00 0.00 H new ATOM 0 HG3 LYS A 38 1.654 -10.563 -19.586 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.950 -8.988 -20.989 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.138 -9.564 -22.432 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.069 -8.876 -21.467 1.00 0.00 H new ATOM 0 HE3 LYS A 38 0.738 -8.308 -20.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.280 -6.506 -21.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.957 -6.710 -21.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.175 -7.261 -22.761 1.00 0.00 H new ATOM 593 N ASP A 39 6.139 -12.842 -20.653 1.00 0.00 N ATOM 594 CA ASP A 39 7.060 -13.933 -20.368 1.00 0.00 C ATOM 595 C ASP A 39 7.722 -13.738 -19.003 1.00 0.00 C ATOM 596 O ASP A 39 8.398 -14.638 -18.508 1.00 0.00 O ATOM 597 CB ASP A 39 8.129 -13.985 -21.460 1.00 0.00 C ATOM 598 CG ASP A 39 7.530 -14.399 -22.802 1.00 0.00 C ATOM 599 OD1 ASP A 39 7.312 -15.618 -22.982 1.00 0.00 O ATOM 600 OD2 ASP A 39 7.296 -13.494 -23.633 1.00 0.00 O ATOM 0 H ASP A 39 6.482 -12.191 -21.360 1.00 0.00 H new ATOM 0 HA ASP A 39 6.504 -14.871 -20.349 1.00 0.00 H new ATOM 0 HB2 ASP A 39 8.602 -13.008 -21.556 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.910 -14.690 -21.175 1.00 0.00 H new ATOM 605 N VAL A 40 7.528 -12.562 -18.396 1.00 0.00 N ATOM 606 CA VAL A 40 8.064 -12.228 -17.083 1.00 0.00 C ATOM 607 C VAL A 40 6.981 -11.543 -16.256 1.00 0.00 C ATOM 608 O VAL A 40 5.911 -11.214 -16.771 1.00 0.00 O ATOM 609 CB VAL A 40 9.304 -11.333 -17.221 1.00 0.00 C ATOM 610 CG1 VAL A 40 10.375 -12.020 -18.067 1.00 0.00 C ATOM 611 CG2 VAL A 40 8.969 -10.007 -17.898 1.00 0.00 C ATOM 0 H VAL A 40 6.985 -11.807 -18.815 1.00 0.00 H new ATOM 0 HA VAL A 40 8.371 -13.141 -16.573 1.00 0.00 H new ATOM 0 HB VAL A 40 9.668 -11.151 -16.210 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.245 -11.369 -18.152 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.668 -12.957 -17.593 1.00 0.00 H new ATOM 0 HG13 VAL A 40 9.977 -12.226 -19.061 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.871 -9.401 -17.978 1.00 0.00 H new ATOM 0 HG22 VAL A 40 8.571 -10.198 -18.895 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.225 -9.474 -17.306 1.00 0.00 H new ATOM 621 N ALA A 41 7.250 -11.326 -14.966 1.00 0.00 N ATOM 622 CA ALA A 41 6.275 -10.725 -14.072 1.00 0.00 C ATOM 623 C ALA A 41 6.775 -9.386 -13.540 1.00 0.00 C ATOM 624 O ALA A 41 7.972 -9.103 -13.567 1.00 0.00 O ATOM 625 CB ALA A 41 5.979 -11.698 -12.932 1.00 0.00 C ATOM 0 H ALA A 41 8.138 -11.560 -14.523 1.00 0.00 H new ATOM 0 HA ALA A 41 5.354 -10.528 -14.621 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.248 -11.255 -12.256 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.580 -12.626 -13.340 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.898 -11.908 -12.385 1.00 0.00 H new ATOM 631 N VAL A 42 5.840 -8.567 -13.055 1.00 0.00 N ATOM 632 CA VAL A 42 6.117 -7.258 -12.484 1.00 0.00 C ATOM 633 C VAL A 42 5.072 -6.954 -11.416 1.00 0.00 C ATOM 634 O VAL A 42 3.880 -6.871 -11.701 1.00 0.00 O ATOM 635 CB VAL A 42 6.155 -6.180 -13.582 1.00 0.00 C ATOM 636 CG1 VAL A 42 5.144 -6.446 -14.694 1.00 0.00 C ATOM 637 CG2 VAL A 42 5.893 -4.788 -13.010 1.00 0.00 C ATOM 0 H VAL A 42 4.848 -8.806 -13.051 1.00 0.00 H new ATOM 0 HA VAL A 42 7.101 -7.258 -12.015 1.00 0.00 H new ATOM 0 HB VAL A 42 7.160 -6.223 -14.002 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.211 -5.657 -15.443 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.360 -7.408 -15.159 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.138 -6.463 -14.275 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.927 -4.052 -13.813 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.910 -4.767 -12.540 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.655 -4.550 -12.268 1.00 0.00 H new ATOM 647 N HIS A 43 5.534 -6.788 -10.175 1.00 0.00 N ATOM 648 CA HIS A 43 4.682 -6.460 -9.040 1.00 0.00 C ATOM 649 C HIS A 43 5.402 -5.498 -8.099 1.00 0.00 C ATOM 650 O HIS A 43 6.625 -5.390 -8.134 1.00 0.00 O ATOM 651 CB HIS A 43 4.305 -7.740 -8.285 1.00 0.00 C ATOM 652 CG HIS A 43 3.493 -8.714 -9.099 1.00 0.00 C ATOM 653 ND1 HIS A 43 2.133 -8.914 -9.005 1.00 0.00 N ATOM 654 CD2 HIS A 43 3.973 -9.559 -10.063 1.00 0.00 C ATOM 655 CE1 HIS A 43 1.802 -9.852 -9.912 1.00 0.00 C ATOM 656 NE2 HIS A 43 2.888 -10.277 -10.578 1.00 0.00 N ATOM 0 H HIS A 43 6.520 -6.879 -9.932 1.00 0.00 H new ATOM 0 HA HIS A 43 3.776 -5.980 -9.409 1.00 0.00 H new ATOM 0 HB2 HIS A 43 5.217 -8.234 -7.950 1.00 0.00 H new ATOM 0 HB3 HIS A 43 3.742 -7.470 -7.392 1.00 0.00 H new ATOM 0 HD2 HIS A 43 5.004 -9.654 -10.371 1.00 0.00 H new ATOM 0 HE1 HIS A 43 0.799 -10.214 -10.081 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.916 -10.983 -11.313 1.00 0.00 H new ATOM 664 N ARG A 44 4.644 -4.795 -7.254 1.00 0.00 N ATOM 665 CA ARG A 44 5.208 -3.909 -6.244 1.00 0.00 C ATOM 666 C ARG A 44 5.650 -4.722 -5.029 1.00 0.00 C ATOM 667 O ARG A 44 5.303 -5.893 -4.908 1.00 0.00 O ATOM 668 CB ARG A 44 4.172 -2.848 -5.865 1.00 0.00 C ATOM 669 CG ARG A 44 2.933 -3.509 -5.264 1.00 0.00 C ATOM 670 CD ARG A 44 1.862 -2.488 -4.910 1.00 0.00 C ATOM 671 NE ARG A 44 1.121 -2.044 -6.089 1.00 0.00 N ATOM 672 CZ ARG A 44 0.197 -1.082 -6.060 1.00 0.00 C ATOM 673 NH1 ARG A 44 -0.090 -0.440 -4.929 1.00 0.00 N ATOM 674 NH2 ARG A 44 -0.442 -0.765 -7.179 1.00 0.00 N ATOM 0 H ARG A 44 3.624 -4.827 -7.254 1.00 0.00 H new ATOM 0 HA ARG A 44 6.087 -3.401 -6.641 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.603 -2.148 -5.149 1.00 0.00 H new ATOM 0 HB3 ARG A 44 3.893 -2.271 -6.747 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.527 -4.231 -5.972 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.215 -4.064 -4.370 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.170 -2.923 -4.189 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.326 -1.628 -4.428 1.00 0.00 H new ATOM 0 HE ARG A 44 1.321 -2.494 -6.982 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.399 -0.681 -4.067 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.799 0.293 -4.925 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.224 -1.255 -8.047 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.151 -0.032 -7.171 1.00 0.00 H new ATOM 688 N GLU A 45 6.414 -4.114 -4.120 1.00 0.00 N ATOM 689 CA GLU A 45 6.928 -4.831 -2.958 1.00 0.00 C ATOM 690 C GLU A 45 5.815 -5.250 -1.993 1.00 0.00 C ATOM 691 O GLU A 45 5.961 -6.237 -1.275 1.00 0.00 O ATOM 692 CB GLU A 45 7.965 -3.966 -2.236 1.00 0.00 C ATOM 693 CG GLU A 45 7.327 -2.726 -1.605 1.00 0.00 C ATOM 694 CD GLU A 45 8.372 -1.834 -0.941 1.00 0.00 C ATOM 695 OE1 GLU A 45 9.187 -2.373 -0.157 1.00 0.00 O ATOM 696 OE2 GLU A 45 8.346 -0.616 -1.222 1.00 0.00 O ATOM 0 H GLU A 45 6.688 -3.133 -4.167 1.00 0.00 H new ATOM 0 HA GLU A 45 7.398 -5.747 -3.315 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.456 -4.556 -1.462 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.737 -3.659 -2.941 1.00 0.00 H new ATOM 0 HG2 GLU A 45 6.797 -2.159 -2.370 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.587 -3.033 -0.866 1.00 0.00 H new ATOM 703 N GLU A 46 4.704 -4.507 -1.969 1.00 0.00 N ATOM 704 CA GLU A 46 3.578 -4.783 -1.082 1.00 0.00 C ATOM 705 C GLU A 46 2.665 -5.874 -1.647 1.00 0.00 C ATOM 706 O GLU A 46 1.678 -6.246 -1.016 1.00 0.00 O ATOM 707 CB GLU A 46 2.760 -3.504 -0.893 1.00 0.00 C ATOM 708 CG GLU A 46 3.603 -2.379 -0.294 1.00 0.00 C ATOM 709 CD GLU A 46 2.753 -1.130 -0.071 1.00 0.00 C ATOM 710 OE1 GLU A 46 2.368 -0.506 -1.085 1.00 0.00 O ATOM 711 OE2 GLU A 46 2.496 -0.810 1.112 1.00 0.00 O ATOM 0 H GLU A 46 4.563 -3.694 -2.569 1.00 0.00 H new ATOM 0 HA GLU A 46 3.979 -5.131 -0.130 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.356 -3.185 -1.854 1.00 0.00 H new ATOM 0 HB3 GLU A 46 1.910 -3.708 -0.242 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.035 -2.705 0.652 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.434 -2.146 -0.960 1.00 0.00 H new ATOM 718 N ILE A 47 2.996 -6.385 -2.836 1.00 0.00 N ATOM 719 CA ILE A 47 2.153 -7.307 -3.583 1.00 0.00 C ATOM 720 C ILE A 47 2.964 -8.518 -4.041 1.00 0.00 C ATOM 721 O ILE A 47 2.401 -9.591 -4.251 1.00 0.00 O ATOM 722 CB ILE A 47 1.576 -6.517 -4.761 1.00 0.00 C ATOM 723 CG1 ILE A 47 0.558 -5.474 -4.279 1.00 0.00 C ATOM 724 CG2 ILE A 47 0.936 -7.363 -5.851 1.00 0.00 C ATOM 725 CD1 ILE A 47 -0.765 -6.082 -3.818 1.00 0.00 C ATOM 0 H ILE A 47 3.872 -6.163 -3.309 1.00 0.00 H new ATOM 0 HA ILE A 47 1.343 -7.701 -2.969 1.00 0.00 H new ATOM 0 HB ILE A 47 2.444 -6.035 -5.211 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.993 -4.906 -3.457 1.00 0.00 H new ATOM 0 HG13 ILE A 47 0.363 -4.768 -5.086 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.557 -6.714 -6.640 1.00 0.00 H new ATOM 0 HG22 ILE A 47 1.679 -8.044 -6.266 1.00 0.00 H new ATOM 0 HG23 ILE A 47 0.112 -7.939 -5.428 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -1.436 -5.288 -3.491 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.222 -6.627 -4.644 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.582 -6.766 -2.989 1.00 0.00 H new ATOM 737 N TYR A 48 4.281 -8.362 -4.196 1.00 0.00 N ATOM 738 CA TYR A 48 5.165 -9.482 -4.464 1.00 0.00 C ATOM 739 C TYR A 48 5.243 -10.363 -3.221 1.00 0.00 C ATOM 740 O TYR A 48 5.220 -11.588 -3.318 1.00 0.00 O ATOM 741 CB TYR A 48 6.549 -8.950 -4.835 1.00 0.00 C ATOM 742 CG TYR A 48 7.582 -10.042 -4.980 1.00 0.00 C ATOM 743 CD1 TYR A 48 7.522 -10.923 -6.069 1.00 0.00 C ATOM 744 CD2 TYR A 48 8.597 -10.173 -4.020 1.00 0.00 C ATOM 745 CE1 TYR A 48 8.477 -11.942 -6.199 1.00 0.00 C ATOM 746 CE2 TYR A 48 9.554 -11.187 -4.143 1.00 0.00 C ATOM 747 CZ TYR A 48 9.500 -12.076 -5.236 1.00 0.00 C ATOM 748 OH TYR A 48 10.436 -13.060 -5.362 1.00 0.00 O ATOM 0 H TYR A 48 4.755 -7.460 -4.139 1.00 0.00 H new ATOM 0 HA TYR A 48 4.784 -10.077 -5.294 1.00 0.00 H new ATOM 0 HB2 TYR A 48 6.480 -8.396 -5.771 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.878 -8.245 -4.071 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.741 -10.817 -6.807 1.00 0.00 H new ATOM 0 HD2 TYR A 48 8.640 -9.490 -3.184 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.430 -12.624 -7.035 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.333 -11.288 -3.402 1.00 0.00 H new ATOM 0 HH TYR A 48 10.364 -13.469 -6.250 1.00 0.00 H new ATOM 846 N MET B 1 2.213 -1.814 -21.206 1.00 0.00 N ATOM 847 CA MET B 1 2.962 -1.250 -20.067 1.00 0.00 C ATOM 848 C MET B 1 2.160 -1.397 -18.782 1.00 0.00 C ATOM 849 O MET B 1 0.936 -1.299 -18.811 1.00 0.00 O ATOM 850 CB MET B 1 3.293 0.221 -20.337 1.00 0.00 C ATOM 851 CG MET B 1 4.119 0.834 -19.204 1.00 0.00 C ATOM 852 SD MET B 1 5.031 2.340 -19.642 1.00 0.00 S ATOM 853 CE MET B 1 3.760 3.234 -20.565 1.00 0.00 C ATOM 0 H1 MET B 1 2.206 -1.130 -21.989 1.00 0.00 H new ATOM 0 H2 MET B 1 2.669 -2.695 -21.519 1.00 0.00 H new ATOM 0 H3 MET B 1 1.236 -2.015 -20.913 1.00 0.00 H new ATOM 0 HA MET B 1 3.896 -1.799 -19.948 1.00 0.00 H new ATOM 0 HB2 MET B 1 3.843 0.304 -21.274 1.00 0.00 H new ATOM 0 HB3 MET B 1 2.368 0.785 -20.459 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.453 1.061 -18.372 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.830 0.088 -18.849 1.00 0.00 H new ATOM 0 HE1 MET B 1 4.144 4.210 -20.861 1.00 0.00 H new ATOM 0 HE2 MET B 1 3.489 2.666 -21.455 1.00 0.00 H new ATOM 0 HE3 MET B 1 2.879 3.366 -19.937 1.00 0.00 H new ATOM 865 N LEU B 2 2.845 -1.630 -17.657 1.00 0.00 N ATOM 866 CA LEU B 2 2.208 -1.709 -16.352 1.00 0.00 C ATOM 867 C LEU B 2 2.601 -0.475 -15.546 1.00 0.00 C ATOM 868 O LEU B 2 3.677 -0.427 -14.949 1.00 0.00 O ATOM 869 CB LEU B 2 2.619 -3.000 -15.629 1.00 0.00 C ATOM 870 CG LEU B 2 1.568 -3.511 -14.631 1.00 0.00 C ATOM 871 CD1 LEU B 2 2.231 -4.241 -13.472 1.00 0.00 C ATOM 872 CD2 LEU B 2 0.665 -2.441 -14.035 1.00 0.00 C ATOM 0 H LEU B 2 3.855 -1.768 -17.633 1.00 0.00 H new ATOM 0 HA LEU B 2 1.124 -1.734 -16.467 1.00 0.00 H new ATOM 0 HB2 LEU B 2 2.811 -3.776 -16.370 1.00 0.00 H new ATOM 0 HB3 LEU B 2 3.556 -2.827 -15.100 1.00 0.00 H new ATOM 0 HG LEU B 2 0.942 -4.172 -15.230 1.00 0.00 H new ATOM 0 HD11 LEU B 2 1.467 -4.593 -12.779 1.00 0.00 H new ATOM 0 HD12 LEU B 2 2.795 -5.092 -13.853 1.00 0.00 H new ATOM 0 HD13 LEU B 2 2.906 -3.561 -12.952 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -0.040 -2.903 -13.345 1.00 0.00 H new ATOM 0 HD22 LEU B 2 1.271 -1.710 -13.499 1.00 0.00 H new ATOM 0 HD23 LEU B 2 0.116 -1.942 -14.834 1.00 0.00 H new ATOM 884 N ILE B 3 1.726 0.530 -15.529 1.00 0.00 N ATOM 885 CA ILE B 3 1.986 1.778 -14.838 1.00 0.00 C ATOM 886 C ILE B 3 1.673 1.615 -13.353 1.00 0.00 C ATOM 887 O ILE B 3 0.723 0.925 -12.988 1.00 0.00 O ATOM 888 CB ILE B 3 1.136 2.894 -15.459 1.00 0.00 C ATOM 889 CG1 ILE B 3 1.546 3.173 -16.913 1.00 0.00 C ATOM 890 CG2 ILE B 3 1.328 4.193 -14.672 1.00 0.00 C ATOM 891 CD1 ILE B 3 0.886 2.230 -17.916 1.00 0.00 C ATOM 0 H ILE B 3 0.820 0.495 -15.996 1.00 0.00 H new ATOM 0 HA ILE B 3 3.037 2.047 -14.941 1.00 0.00 H new ATOM 0 HB ILE B 3 0.098 2.562 -15.429 1.00 0.00 H new ATOM 0 HG12 ILE B 3 1.287 4.201 -17.166 1.00 0.00 H new ATOM 0 HG13 ILE B 3 2.629 3.087 -17.001 1.00 0.00 H new ATOM 0 HG21 ILE B 3 0.722 4.982 -15.118 1.00 0.00 H new ATOM 0 HG22 ILE B 3 1.021 4.040 -13.637 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.378 4.483 -14.700 1.00 0.00 H new ATOM 0 HD11 ILE B 3 1.218 2.481 -18.924 1.00 0.00 H new ATOM 0 HD12 ILE B 3 1.166 1.202 -17.687 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -0.197 2.334 -17.854 1.00 0.00 H new ATOM 903 N LEU B 4 2.477 2.256 -12.502 1.00 0.00 N ATOM 904 CA LEU B 4 2.273 2.300 -11.061 1.00 0.00 C ATOM 905 C LEU B 4 2.681 3.685 -10.566 1.00 0.00 C ATOM 906 O LEU B 4 3.389 4.405 -11.268 1.00 0.00 O ATOM 907 CB LEU B 4 3.132 1.232 -10.369 1.00 0.00 C ATOM 908 CG LEU B 4 2.742 -0.206 -10.724 1.00 0.00 C ATOM 909 CD1 LEU B 4 3.745 -1.168 -10.094 1.00 0.00 C ATOM 910 CD2 LEU B 4 1.366 -0.569 -10.170 1.00 0.00 C ATOM 0 H LEU B 4 3.305 2.769 -12.807 1.00 0.00 H new ATOM 0 HA LEU B 4 1.226 2.103 -10.829 1.00 0.00 H new ATOM 0 HB2 LEU B 4 4.177 1.391 -10.637 1.00 0.00 H new ATOM 0 HB3 LEU B 4 3.056 1.362 -9.290 1.00 0.00 H new ATOM 0 HG LEU B 4 2.730 -0.282 -11.811 1.00 0.00 H new ATOM 0 HD11 LEU B 4 3.472 -2.193 -10.344 1.00 0.00 H new ATOM 0 HD12 LEU B 4 4.743 -0.955 -10.477 1.00 0.00 H new ATOM 0 HD13 LEU B 4 3.737 -1.044 -9.011 1.00 0.00 H new ATOM 0 HD21 LEU B 4 1.124 -1.596 -10.442 1.00 0.00 H new ATOM 0 HD22 LEU B 4 1.374 -0.473 -9.084 1.00 0.00 H new ATOM 0 HD23 LEU B 4 0.617 0.103 -10.588 1.00 0.00 H new ATOM 922 N THR B 5 2.244 4.066 -9.364 1.00 0.00 N ATOM 923 CA THR B 5 2.614 5.348 -8.778 1.00 0.00 C ATOM 924 C THR B 5 3.226 5.115 -7.404 1.00 0.00 C ATOM 925 O THR B 5 2.541 5.190 -6.384 1.00 0.00 O ATOM 926 CB THR B 5 1.411 6.296 -8.731 1.00 0.00 C ATOM 927 OG1 THR B 5 0.873 6.449 -10.025 1.00 0.00 O ATOM 928 CG2 THR B 5 1.831 7.676 -8.238 1.00 0.00 C ATOM 0 H THR B 5 1.631 3.499 -8.778 1.00 0.00 H new ATOM 0 HA THR B 5 3.363 5.835 -9.403 1.00 0.00 H new ATOM 0 HB THR B 5 0.674 5.867 -8.052 1.00 0.00 H new ATOM 0 HG1 THR B 5 -0.059 6.146 -10.030 1.00 0.00 H new ATOM 0 HG21 THR B 5 0.962 8.333 -8.212 1.00 0.00 H new ATOM 0 HG22 THR B 5 2.252 7.592 -7.236 1.00 0.00 H new ATOM 0 HG23 THR B 5 2.580 8.091 -8.913 1.00 0.00 H new ATOM 936 N ARG B 6 4.532 4.830 -7.381 1.00 0.00 N ATOM 937 CA ARG B 6 5.268 4.570 -6.154 1.00 0.00 C ATOM 938 C ARG B 6 5.470 5.860 -5.367 1.00 0.00 C ATOM 939 O ARG B 6 5.088 6.939 -5.817 1.00 0.00 O ATOM 940 CB ARG B 6 6.622 3.941 -6.504 1.00 0.00 C ATOM 941 CG ARG B 6 6.475 2.482 -6.945 1.00 0.00 C ATOM 942 CD ARG B 6 6.506 1.527 -5.745 1.00 0.00 C ATOM 943 NE ARG B 6 5.436 1.801 -4.781 1.00 0.00 N ATOM 944 CZ ARG B 6 4.165 1.408 -4.889 1.00 0.00 C ATOM 945 NH1 ARG B 6 3.749 0.690 -5.930 1.00 0.00 N ATOM 946 NH2 ARG B 6 3.305 1.745 -3.935 1.00 0.00 N ATOM 0 H ARG B 6 5.106 4.774 -8.222 1.00 0.00 H new ATOM 0 HA ARG B 6 4.697 3.881 -5.531 1.00 0.00 H new ATOM 0 HB2 ARG B 6 7.094 4.516 -7.301 1.00 0.00 H new ATOM 0 HB3 ARG B 6 7.282 3.994 -5.638 1.00 0.00 H new ATOM 0 HG2 ARG B 6 5.537 2.357 -7.487 1.00 0.00 H new ATOM 0 HG3 ARG B 6 7.279 2.227 -7.636 1.00 0.00 H new ATOM 0 HD2 ARG B 6 6.417 0.500 -6.100 1.00 0.00 H new ATOM 0 HD3 ARG B 6 7.471 1.609 -5.245 1.00 0.00 H new ATOM 0 HE ARG B 6 5.686 2.341 -3.952 1.00 0.00 H new ATOM 0 HH11 ARG B 6 4.406 0.430 -6.665 1.00 0.00 H new ATOM 0 HH12 ARG B 6 2.773 0.400 -5.992 1.00 0.00 H new ATOM 0 HH21 ARG B 6 3.620 2.296 -3.136 1.00 0.00 H new ATOM 0 HH22 ARG B 6 2.330 1.453 -4.001 1.00 0.00 H new ATOM 960 N LYS B 7 6.078 5.740 -4.185 1.00 0.00 N ATOM 961 CA LYS B 7 6.376 6.874 -3.324 1.00 0.00 C ATOM 962 C LYS B 7 7.851 6.825 -2.943 1.00 0.00 C ATOM 963 O LYS B 7 8.465 5.762 -2.997 1.00 0.00 O ATOM 964 CB LYS B 7 5.465 6.840 -2.092 1.00 0.00 C ATOM 965 CG LYS B 7 4.005 6.622 -2.507 1.00 0.00 C ATOM 966 CD LYS B 7 3.055 6.649 -1.309 1.00 0.00 C ATOM 967 CE LYS B 7 2.894 8.068 -0.769 1.00 0.00 C ATOM 968 NZ LYS B 7 1.933 8.097 0.349 1.00 0.00 N ATOM 0 H LYS B 7 6.377 4.844 -3.800 1.00 0.00 H new ATOM 0 HA LYS B 7 6.186 7.813 -3.844 1.00 0.00 H new ATOM 0 HB2 LYS B 7 5.781 6.041 -1.421 1.00 0.00 H new ATOM 0 HB3 LYS B 7 5.556 7.775 -1.540 1.00 0.00 H new ATOM 0 HG2 LYS B 7 3.712 7.394 -3.219 1.00 0.00 H new ATOM 0 HG3 LYS B 7 3.914 5.664 -3.020 1.00 0.00 H new ATOM 0 HD2 LYS B 7 2.082 6.256 -1.603 1.00 0.00 H new ATOM 0 HD3 LYS B 7 3.437 5.998 -0.523 1.00 0.00 H new ATOM 0 HE2 LYS B 7 3.860 8.446 -0.434 1.00 0.00 H new ATOM 0 HE3 LYS B 7 2.552 8.728 -1.566 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 1.839 9.071 0.701 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 1.007 7.757 0.020 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 2.274 7.483 1.116 1.00 0.00 H new ATOM 982 N VAL B 8 8.423 7.967 -2.559 1.00 0.00 N ATOM 983 CA VAL B 8 9.840 8.066 -2.236 1.00 0.00 C ATOM 984 C VAL B 8 10.226 7.042 -1.170 1.00 0.00 C ATOM 985 O VAL B 8 9.715 7.075 -0.051 1.00 0.00 O ATOM 986 CB VAL B 8 10.159 9.489 -1.770 1.00 0.00 C ATOM 987 CG1 VAL B 8 11.613 9.590 -1.313 1.00 0.00 C ATOM 988 CG2 VAL B 8 9.925 10.474 -2.915 1.00 0.00 C ATOM 0 H VAL B 8 7.915 8.846 -2.464 1.00 0.00 H new ATOM 0 HA VAL B 8 10.426 7.847 -3.129 1.00 0.00 H new ATOM 0 HB VAL B 8 9.504 9.732 -0.933 1.00 0.00 H new ATOM 0 HG11 VAL B 8 11.822 10.608 -0.985 1.00 0.00 H new ATOM 0 HG12 VAL B 8 11.783 8.901 -0.486 1.00 0.00 H new ATOM 0 HG13 VAL B 8 12.273 9.333 -2.141 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.154 11.485 -2.578 1.00 0.00 H new ATOM 0 HG22 VAL B 8 10.571 10.217 -3.754 1.00 0.00 H new ATOM 0 HG23 VAL B 8 8.883 10.424 -3.231 1.00 0.00 H new ATOM 998 N GLY B 9 11.133 6.131 -1.532 1.00 0.00 N ATOM 999 CA GLY B 9 11.656 5.109 -0.639 1.00 0.00 C ATOM 1000 C GLY B 9 11.023 3.738 -0.875 1.00 0.00 C ATOM 1001 O GLY B 9 11.478 2.751 -0.299 1.00 0.00 O ATOM 0 H GLY B 9 11.528 6.087 -2.472 1.00 0.00 H new ATOM 0 HA2 GLY B 9 12.735 5.034 -0.772 1.00 0.00 H new ATOM 0 HA3 GLY B 9 11.483 5.412 0.394 1.00 0.00 H new ATOM 1005 N GLU B 10 9.981 3.662 -1.709 1.00 0.00 N ATOM 1006 CA GLU B 10 9.341 2.394 -2.031 1.00 0.00 C ATOM 1007 C GLU B 10 10.055 1.712 -3.197 1.00 0.00 C ATOM 1008 O GLU B 10 10.944 2.295 -3.820 1.00 0.00 O ATOM 1009 CB GLU B 10 7.863 2.619 -2.359 1.00 0.00 C ATOM 1010 CG GLU B 10 7.132 3.212 -1.151 1.00 0.00 C ATOM 1011 CD GLU B 10 5.625 3.279 -1.384 1.00 0.00 C ATOM 1012 OE1 GLU B 10 5.221 3.360 -2.565 1.00 0.00 O ATOM 1013 OE2 GLU B 10 4.885 3.249 -0.376 1.00 0.00 O ATOM 0 H GLU B 10 9.566 4.470 -2.172 1.00 0.00 H new ATOM 0 HA GLU B 10 9.409 1.738 -1.163 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.772 3.290 -3.213 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.400 1.675 -2.645 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.338 2.607 -0.268 1.00 0.00 H new ATOM 0 HG3 GLU B 10 7.514 4.212 -0.949 1.00 0.00 H new ATOM 1020 N SER B 11 9.660 0.468 -3.493 1.00 0.00 N ATOM 1021 CA SER B 11 10.310 -0.339 -4.514 1.00 0.00 C ATOM 1022 C SER B 11 9.312 -1.123 -5.364 1.00 0.00 C ATOM 1023 O SER B 11 8.121 -1.182 -5.066 1.00 0.00 O ATOM 1024 CB SER B 11 11.275 -1.314 -3.835 1.00 0.00 C ATOM 1025 OG SER B 11 12.238 -0.613 -3.077 1.00 0.00 O ATOM 0 H SER B 11 8.882 -0.000 -3.029 1.00 0.00 H new ATOM 0 HA SER B 11 10.843 0.337 -5.183 1.00 0.00 H new ATOM 0 HB2 SER B 11 10.719 -1.993 -3.188 1.00 0.00 H new ATOM 0 HB3 SER B 11 11.772 -1.926 -4.588 1.00 0.00 H new ATOM 0 HG SER B 11 12.845 -1.252 -2.649 1.00 0.00 H new ATOM 1031 N ILE B 12 9.832 -1.725 -6.438 1.00 0.00 N ATOM 1032 CA ILE B 12 9.112 -2.579 -7.374 1.00 0.00 C ATOM 1033 C ILE B 12 9.952 -3.838 -7.595 1.00 0.00 C ATOM 1034 O ILE B 12 11.141 -3.847 -7.282 1.00 0.00 O ATOM 1035 CB ILE B 12 8.894 -1.815 -8.693 1.00 0.00 C ATOM 1036 CG1 ILE B 12 7.964 -0.606 -8.522 1.00 0.00 C ATOM 1037 CG2 ILE B 12 8.347 -2.712 -9.808 1.00 0.00 C ATOM 1038 CD1 ILE B 12 6.535 -1.000 -8.147 1.00 0.00 C ATOM 0 H ILE B 12 10.816 -1.622 -6.686 1.00 0.00 H new ATOM 0 HA ILE B 12 8.134 -2.860 -6.985 1.00 0.00 H new ATOM 0 HB ILE B 12 9.883 -1.461 -8.982 1.00 0.00 H new ATOM 0 HG12 ILE B 12 8.368 0.050 -7.751 1.00 0.00 H new ATOM 0 HG13 ILE B 12 7.946 -0.034 -9.450 1.00 0.00 H new ATOM 0 HG21 ILE B 12 8.212 -2.123 -10.715 1.00 0.00 H new ATOM 0 HG22 ILE B 12 9.051 -3.521 -10.002 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.389 -3.131 -9.501 1.00 0.00 H new ATOM 0 HD11 ILE B 12 5.926 -0.102 -8.040 1.00 0.00 H new ATOM 0 HD12 ILE B 12 6.115 -1.633 -8.929 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.544 -1.547 -7.204 1.00 0.00 H new ATOM 1050 N ASN B 13 9.348 -4.900 -8.132 1.00 0.00 N ATOM 1051 CA ASN B 13 10.037 -6.146 -8.425 1.00 0.00 C ATOM 1052 C ASN B 13 9.674 -6.619 -9.826 1.00 0.00 C ATOM 1053 O ASN B 13 8.537 -6.463 -10.266 1.00 0.00 O ATOM 1054 CB ASN B 13 9.656 -7.203 -7.387 1.00 0.00 C ATOM 1055 CG ASN B 13 10.278 -6.897 -6.036 1.00 0.00 C ATOM 1056 OD1 ASN B 13 9.583 -6.563 -5.080 1.00 0.00 O ATOM 1057 ND2 ASN B 13 11.599 -7.012 -5.955 1.00 0.00 N ATOM 0 H ASN B 13 8.358 -4.913 -8.376 1.00 0.00 H new ATOM 0 HA ASN B 13 11.114 -5.984 -8.380 1.00 0.00 H new ATOM 0 HB2 ASN B 13 8.571 -7.246 -7.289 1.00 0.00 H new ATOM 0 HB3 ASN B 13 9.984 -8.185 -7.727 1.00 0.00 H new ATOM 0 HD21 ASN B 13 12.075 -6.820 -5.073 1.00 0.00 H new ATOM 0 HD22 ASN B 13 12.138 -7.292 -6.774 1.00 0.00 H new ATOM 1064 N ILE B 14 10.654 -7.201 -10.523 1.00 0.00 N ATOM 1065 CA ILE B 14 10.471 -7.682 -11.886 1.00 0.00 C ATOM 1066 C ILE B 14 11.282 -8.961 -12.085 1.00 0.00 C ATOM 1067 O ILE B 14 12.310 -9.155 -11.439 1.00 0.00 O ATOM 1068 CB ILE B 14 10.921 -6.601 -12.886 1.00 0.00 C ATOM 1069 CG1 ILE B 14 10.235 -5.255 -12.600 1.00 0.00 C ATOM 1070 CG2 ILE B 14 10.598 -7.048 -14.317 1.00 0.00 C ATOM 1071 CD1 ILE B 14 10.741 -4.142 -13.518 1.00 0.00 C ATOM 0 H ILE B 14 11.593 -7.350 -10.155 1.00 0.00 H new ATOM 0 HA ILE B 14 9.417 -7.898 -12.059 1.00 0.00 H new ATOM 0 HB ILE B 14 11.997 -6.467 -12.775 1.00 0.00 H new ATOM 0 HG12 ILE B 14 9.158 -5.365 -12.725 1.00 0.00 H new ATOM 0 HG13 ILE B 14 10.409 -4.974 -11.561 1.00 0.00 H new ATOM 0 HG21 ILE B 14 10.919 -6.279 -15.020 1.00 0.00 H new ATOM 0 HG22 ILE B 14 11.121 -7.979 -14.534 1.00 0.00 H new ATOM 0 HG23 ILE B 14 9.524 -7.204 -14.416 1.00 0.00 H new ATOM 0 HD11 ILE B 14 10.227 -3.211 -13.278 1.00 0.00 H new ATOM 0 HD12 ILE B 14 11.814 -4.012 -13.375 1.00 0.00 H new ATOM 0 HD13 ILE B 14 10.543 -4.409 -14.556 1.00 0.00 H new ATOM 1083 N GLY B 15 10.821 -9.838 -12.983 1.00 0.00 N ATOM 1084 CA GLY B 15 11.548 -11.037 -13.383 1.00 0.00 C ATOM 1085 C GLY B 15 11.876 -11.990 -12.231 1.00 0.00 C ATOM 1086 O GLY B 15 12.636 -12.933 -12.432 1.00 0.00 O ATOM 0 H GLY B 15 9.923 -9.730 -13.455 1.00 0.00 H new ATOM 0 HA2 GLY B 15 10.958 -11.574 -14.126 1.00 0.00 H new ATOM 0 HA3 GLY B 15 12.478 -10.739 -13.868 1.00 0.00 H new ATOM 1090 N ASP B 16 11.315 -11.754 -11.040 1.00 0.00 N ATOM 1091 CA ASP B 16 11.549 -12.547 -9.836 1.00 0.00 C ATOM 1092 C ASP B 16 13.008 -12.511 -9.355 1.00 0.00 C ATOM 1093 O ASP B 16 13.353 -13.201 -8.398 1.00 0.00 O ATOM 1094 CB ASP B 16 11.032 -13.975 -10.053 1.00 0.00 C ATOM 1095 CG ASP B 16 10.986 -14.779 -8.754 1.00 0.00 C ATOM 1096 OD1 ASP B 16 10.345 -14.293 -7.796 1.00 0.00 O ATOM 1097 OD2 ASP B 16 11.594 -15.873 -8.728 1.00 0.00 O ATOM 0 H ASP B 16 10.667 -10.982 -10.886 1.00 0.00 H new ATOM 0 HA ASP B 16 10.985 -12.092 -9.022 1.00 0.00 H new ATOM 0 HB2 ASP B 16 10.034 -13.935 -10.489 1.00 0.00 H new ATOM 0 HB3 ASP B 16 11.673 -14.486 -10.771 1.00 0.00 H new ATOM 1102 N ASP B 17 13.872 -11.718 -10.003 1.00 0.00 N ATOM 1103 CA ASP B 17 15.274 -11.584 -9.614 1.00 0.00 C ATOM 1104 C ASP B 17 15.737 -10.126 -9.639 1.00 0.00 C ATOM 1105 O ASP B 17 16.904 -9.852 -9.358 1.00 0.00 O ATOM 1106 CB ASP B 17 16.173 -12.401 -10.546 1.00 0.00 C ATOM 1107 CG ASP B 17 15.844 -13.894 -10.521 1.00 0.00 C ATOM 1108 OD1 ASP B 17 16.097 -14.523 -9.469 1.00 0.00 O ATOM 1109 OD2 ASP B 17 15.343 -14.396 -11.551 1.00 0.00 O ATOM 0 H ASP B 17 13.614 -11.153 -10.812 1.00 0.00 H new ATOM 0 HA ASP B 17 15.354 -11.959 -8.594 1.00 0.00 H new ATOM 0 HB2 ASP B 17 16.069 -12.027 -11.565 1.00 0.00 H new ATOM 0 HB3 ASP B 17 17.214 -12.257 -10.258 1.00 0.00 H new ATOM 1114 N ILE B 18 14.840 -9.192 -9.968 1.00 0.00 N ATOM 1115 CA ILE B 18 15.193 -7.787 -10.100 1.00 0.00 C ATOM 1116 C ILE B 18 14.331 -6.946 -9.163 1.00 0.00 C ATOM 1117 O ILE B 18 13.183 -7.292 -8.881 1.00 0.00 O ATOM 1118 CB ILE B 18 15.021 -7.357 -11.567 1.00 0.00 C ATOM 1119 CG1 ILE B 18 15.874 -8.253 -12.479 1.00 0.00 C ATOM 1120 CG2 ILE B 18 15.413 -5.885 -11.746 1.00 0.00 C ATOM 1121 CD1 ILE B 18 15.596 -7.984 -13.958 1.00 0.00 C ATOM 0 H ILE B 18 13.856 -9.393 -10.148 1.00 0.00 H new ATOM 0 HA ILE B 18 16.235 -7.634 -9.818 1.00 0.00 H new ATOM 0 HB ILE B 18 13.973 -7.468 -11.844 1.00 0.00 H new ATOM 0 HG12 ILE B 18 16.930 -8.083 -12.271 1.00 0.00 H new ATOM 0 HG13 ILE B 18 15.669 -9.300 -12.255 1.00 0.00 H new ATOM 0 HG21 ILE B 18 15.285 -5.599 -12.790 1.00 0.00 H new ATOM 0 HG22 ILE B 18 14.778 -5.260 -11.118 1.00 0.00 H new ATOM 0 HG23 ILE B 18 16.455 -5.748 -11.458 1.00 0.00 H new ATOM 0 HD11 ILE B 18 16.218 -8.637 -14.570 1.00 0.00 H new ATOM 0 HD12 ILE B 18 14.545 -8.179 -14.172 1.00 0.00 H new ATOM 0 HD13 ILE B 18 15.826 -6.944 -14.188 1.00 0.00 H new ATOM 1133 N THR B 19 14.895 -5.837 -8.681 1.00 0.00 N ATOM 1134 CA THR B 19 14.202 -4.898 -7.816 1.00 0.00 C ATOM 1135 C THR B 19 14.530 -3.486 -8.275 1.00 0.00 C ATOM 1136 O THR B 19 15.670 -3.204 -8.640 1.00 0.00 O ATOM 1137 CB THR B 19 14.650 -5.105 -6.365 1.00 0.00 C ATOM 1138 OG1 THR B 19 14.472 -6.454 -5.991 1.00 0.00 O ATOM 1139 CG2 THR B 19 13.855 -4.224 -5.404 1.00 0.00 C ATOM 0 H THR B 19 15.857 -5.568 -8.886 1.00 0.00 H new ATOM 0 HA THR B 19 13.125 -5.059 -7.870 1.00 0.00 H new ATOM 0 HB THR B 19 15.703 -4.831 -6.306 1.00 0.00 H new ATOM 0 HG1 THR B 19 14.762 -6.577 -5.063 1.00 0.00 H new ATOM 0 HG21 THR B 19 14.198 -4.396 -4.384 1.00 0.00 H new ATOM 0 HG22 THR B 19 14.003 -3.176 -5.665 1.00 0.00 H new ATOM 0 HG23 THR B 19 12.796 -4.470 -5.477 1.00 0.00 H new ATOM 1147 N ILE B 20 13.537 -2.597 -8.259 1.00 0.00 N ATOM 1148 CA ILE B 20 13.707 -1.207 -8.661 1.00 0.00 C ATOM 1149 C ILE B 20 13.325 -0.334 -7.471 1.00 0.00 C ATOM 1150 O ILE B 20 12.505 -0.749 -6.654 1.00 0.00 O ATOM 1151 CB ILE B 20 12.822 -0.900 -9.878 1.00 0.00 C ATOM 1152 CG1 ILE B 20 12.901 -1.983 -10.963 1.00 0.00 C ATOM 1153 CG2 ILE B 20 13.182 0.461 -10.477 1.00 0.00 C ATOM 1154 CD1 ILE B 20 14.297 -2.147 -11.559 1.00 0.00 C ATOM 0 H ILE B 20 12.588 -2.826 -7.964 1.00 0.00 H new ATOM 0 HA ILE B 20 14.739 -1.008 -8.950 1.00 0.00 H new ATOM 0 HB ILE B 20 11.795 -0.881 -9.514 1.00 0.00 H new ATOM 0 HG12 ILE B 20 12.581 -2.935 -10.539 1.00 0.00 H new ATOM 0 HG13 ILE B 20 12.200 -1.738 -11.761 1.00 0.00 H new ATOM 0 HG21 ILE B 20 12.544 0.660 -11.338 1.00 0.00 H new ATOM 0 HG22 ILE B 20 13.034 1.239 -9.728 1.00 0.00 H new ATOM 0 HG23 ILE B 20 14.225 0.455 -10.792 1.00 0.00 H new ATOM 0 HD11 ILE B 20 14.279 -2.929 -12.319 1.00 0.00 H new ATOM 0 HD12 ILE B 20 14.612 -1.207 -12.013 1.00 0.00 H new ATOM 0 HD13 ILE B 20 14.999 -2.422 -10.772 1.00 0.00 H new ATOM 1166 N THR B 21 13.902 0.865 -7.361 1.00 0.00 N ATOM 1167 CA THR B 21 13.637 1.733 -6.220 1.00 0.00 C ATOM 1168 C THR B 21 13.525 3.184 -6.670 1.00 0.00 C ATOM 1169 O THR B 21 14.149 3.582 -7.652 1.00 0.00 O ATOM 1170 CB THR B 21 14.773 1.587 -5.199 1.00 0.00 C ATOM 1171 OG1 THR B 21 15.017 0.223 -4.924 1.00 0.00 O ATOM 1172 CG2 THR B 21 14.433 2.276 -3.879 1.00 0.00 C ATOM 0 H THR B 21 14.551 1.252 -8.046 1.00 0.00 H new ATOM 0 HA THR B 21 12.692 1.441 -5.761 1.00 0.00 H new ATOM 0 HB THR B 21 15.654 2.055 -5.638 1.00 0.00 H new ATOM 0 HG1 THR B 21 15.745 0.146 -4.272 1.00 0.00 H new ATOM 0 HG21 THR B 21 15.260 2.152 -3.180 1.00 0.00 H new ATOM 0 HG22 THR B 21 14.264 3.338 -4.056 1.00 0.00 H new ATOM 0 HG23 THR B 21 13.532 1.830 -3.457 1.00 0.00 H new ATOM 1180 N ILE B 22 12.727 3.976 -5.947 1.00 0.00 N ATOM 1181 CA ILE B 22 12.605 5.407 -6.183 1.00 0.00 C ATOM 1182 C ILE B 22 13.261 6.131 -5.010 1.00 0.00 C ATOM 1183 O ILE B 22 12.665 6.298 -3.947 1.00 0.00 O ATOM 1184 CB ILE B 22 11.139 5.797 -6.432 1.00 0.00 C ATOM 1185 CG1 ILE B 22 10.952 7.318 -6.441 1.00 0.00 C ATOM 1186 CG2 ILE B 22 10.192 5.186 -5.397 1.00 0.00 C ATOM 1187 CD1 ILE B 22 11.794 7.970 -7.537 1.00 0.00 C ATOM 0 H ILE B 22 12.148 3.635 -5.180 1.00 0.00 H new ATOM 0 HA ILE B 22 13.125 5.709 -7.092 1.00 0.00 H new ATOM 0 HB ILE B 22 10.888 5.396 -7.414 1.00 0.00 H new ATOM 0 HG12 ILE B 22 9.900 7.557 -6.596 1.00 0.00 H new ATOM 0 HG13 ILE B 22 11.232 7.728 -5.471 1.00 0.00 H new ATOM 0 HG21 ILE B 22 9.169 5.491 -5.616 1.00 0.00 H new ATOM 0 HG22 ILE B 22 10.263 4.099 -5.436 1.00 0.00 H new ATOM 0 HG23 ILE B 22 10.469 5.532 -4.401 1.00 0.00 H new ATOM 0 HD11 ILE B 22 11.641 9.049 -7.520 1.00 0.00 H new ATOM 0 HD12 ILE B 22 12.848 7.750 -7.366 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.494 7.577 -8.508 1.00 0.00 H new ATOM 1199 N LEU B 23 14.508 6.560 -5.213 1.00 0.00 N ATOM 1200 CA LEU B 23 15.324 7.115 -4.146 1.00 0.00 C ATOM 1201 C LEU B 23 14.805 8.487 -3.727 1.00 0.00 C ATOM 1202 O LEU B 23 14.952 8.875 -2.569 1.00 0.00 O ATOM 1203 CB LEU B 23 16.777 7.242 -4.611 1.00 0.00 C ATOM 1204 CG LEU B 23 17.250 6.084 -5.494 1.00 0.00 C ATOM 1205 CD1 LEU B 23 18.710 6.323 -5.859 1.00 0.00 C ATOM 1206 CD2 LEU B 23 17.139 4.734 -4.792 1.00 0.00 C ATOM 0 H LEU B 23 14.974 6.530 -6.120 1.00 0.00 H new ATOM 0 HA LEU B 23 15.271 6.442 -3.290 1.00 0.00 H new ATOM 0 HB2 LEU B 23 16.892 8.176 -5.161 1.00 0.00 H new ATOM 0 HB3 LEU B 23 17.424 7.306 -3.736 1.00 0.00 H new ATOM 0 HG LEU B 23 16.612 6.053 -6.377 1.00 0.00 H new ATOM 0 HD11 LEU B 23 19.066 5.508 -6.489 1.00 0.00 H new ATOM 0 HD12 LEU B 23 18.800 7.265 -6.400 1.00 0.00 H new ATOM 0 HD13 LEU B 23 19.310 6.368 -4.950 1.00 0.00 H new ATOM 0 HD21 LEU B 23 17.487 3.947 -5.461 1.00 0.00 H new ATOM 0 HD22 LEU B 23 17.752 4.741 -3.890 1.00 0.00 H new ATOM 0 HD23 LEU B 23 16.099 4.548 -4.523 1.00 0.00 H new ATOM 1218 N GLY B 24 14.197 9.221 -4.665 1.00 0.00 N ATOM 1219 CA GLY B 24 13.594 10.507 -4.355 1.00 0.00 C ATOM 1220 C GLY B 24 13.336 11.346 -5.600 1.00 0.00 C ATOM 1221 O GLY B 24 13.717 10.970 -6.709 1.00 0.00 O ATOM 0 H GLY B 24 14.113 8.941 -5.642 1.00 0.00 H new ATOM 0 HA2 GLY B 24 12.654 10.346 -3.828 1.00 0.00 H new ATOM 0 HA3 GLY B 24 14.248 11.058 -3.679 1.00 0.00 H new ATOM 1225 N VAL B 25 12.682 12.494 -5.401 1.00 0.00 N ATOM 1226 CA VAL B 25 12.349 13.414 -6.478 1.00 0.00 C ATOM 1227 C VAL B 25 13.363 14.553 -6.534 1.00 0.00 C ATOM 1228 O VAL B 25 14.070 14.814 -5.562 1.00 0.00 O ATOM 1229 CB VAL B 25 10.930 13.959 -6.281 1.00 0.00 C ATOM 1230 CG1 VAL B 25 9.922 12.808 -6.276 1.00 0.00 C ATOM 1231 CG2 VAL B 25 10.799 14.736 -4.970 1.00 0.00 C ATOM 0 H VAL B 25 12.370 12.807 -4.482 1.00 0.00 H new ATOM 0 HA VAL B 25 12.386 12.878 -7.427 1.00 0.00 H new ATOM 0 HB VAL B 25 10.725 14.638 -7.109 1.00 0.00 H new ATOM 0 HG11 VAL B 25 8.917 13.205 -6.135 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.972 12.276 -7.226 1.00 0.00 H new ATOM 0 HG13 VAL B 25 10.158 12.121 -5.463 1.00 0.00 H new ATOM 0 HG21 VAL B 25 9.779 15.106 -4.867 1.00 0.00 H new ATOM 0 HG22 VAL B 25 11.033 14.079 -4.133 1.00 0.00 H new ATOM 0 HG23 VAL B 25 11.492 15.578 -4.975 1.00 0.00 H new ATOM 1241 N SER B 26 13.425 15.231 -7.683 1.00 0.00 N ATOM 1242 CA SER B 26 14.342 16.337 -7.926 1.00 0.00 C ATOM 1243 C SER B 26 13.715 17.315 -8.921 1.00 0.00 C ATOM 1244 O SER B 26 14.376 17.782 -9.849 1.00 0.00 O ATOM 1245 CB SER B 26 15.673 15.798 -8.456 1.00 0.00 C ATOM 1246 OG SER B 26 16.279 14.943 -7.509 1.00 0.00 O ATOM 0 H SER B 26 12.827 15.019 -8.482 1.00 0.00 H new ATOM 0 HA SER B 26 14.533 16.867 -6.993 1.00 0.00 H new ATOM 0 HB2 SER B 26 15.507 15.257 -9.388 1.00 0.00 H new ATOM 0 HB3 SER B 26 16.342 16.628 -8.684 1.00 0.00 H new ATOM 0 HG SER B 26 17.127 14.608 -7.867 1.00 0.00 H new ATOM 1252 N GLY B 27 12.430 17.631 -8.735 1.00 0.00 N ATOM 1253 CA GLY B 27 11.720 18.548 -9.614 1.00 0.00 C ATOM 1254 C GLY B 27 11.398 17.874 -10.941 1.00 0.00 C ATOM 1255 O GLY B 27 10.776 16.813 -10.962 1.00 0.00 O ATOM 0 H GLY B 27 11.861 17.258 -7.975 1.00 0.00 H new ATOM 0 HA2 GLY B 27 10.799 18.880 -9.135 1.00 0.00 H new ATOM 0 HA3 GLY B 27 12.327 19.437 -9.789 1.00 0.00 H new ATOM 1259 N GLN B 28 11.820 18.487 -12.052 1.00 0.00 N ATOM 1260 CA GLN B 28 11.599 17.917 -13.373 1.00 0.00 C ATOM 1261 C GLN B 28 12.474 16.676 -13.584 1.00 0.00 C ATOM 1262 O GLN B 28 12.324 15.978 -14.586 1.00 0.00 O ATOM 1263 CB GLN B 28 11.883 18.977 -14.440 1.00 0.00 C ATOM 1264 CG GLN B 28 11.195 18.637 -15.765 1.00 0.00 C ATOM 1265 CD GLN B 28 9.677 18.699 -15.641 1.00 0.00 C ATOM 1266 OE1 GLN B 28 8.999 17.676 -15.694 1.00 0.00 O ATOM 1267 NE2 GLN B 28 9.129 19.901 -15.473 1.00 0.00 N ATOM 0 H GLN B 28 12.316 19.378 -12.056 1.00 0.00 H new ATOM 0 HA GLN B 28 10.559 17.602 -13.456 1.00 0.00 H new ATOM 0 HB2 GLN B 28 11.538 19.950 -14.089 1.00 0.00 H new ATOM 0 HB3 GLN B 28 12.959 19.058 -14.597 1.00 0.00 H new ATOM 0 HG2 GLN B 28 11.526 19.332 -16.537 1.00 0.00 H new ATOM 0 HG3 GLN B 28 11.494 17.639 -16.085 1.00 0.00 H new ATOM 0 HE21 GLN B 28 9.721 20.730 -15.433 1.00 0.00 H new ATOM 0 HE22 GLN B 28 8.117 19.992 -15.384 1.00 0.00 H new ATOM 1276 N GLN B 29 13.391 16.397 -12.648 1.00 0.00 N ATOM 1277 CA GLN B 29 14.228 15.209 -12.712 1.00 0.00 C ATOM 1278 C GLN B 29 14.011 14.340 -11.473 1.00 0.00 C ATOM 1279 O GLN B 29 13.372 14.768 -10.513 1.00 0.00 O ATOM 1280 CB GLN B 29 15.694 15.585 -12.967 1.00 0.00 C ATOM 1281 CG GLN B 29 16.229 16.662 -12.025 1.00 0.00 C ATOM 1282 CD GLN B 29 17.638 17.058 -12.416 1.00 0.00 C ATOM 1283 OE1 GLN B 29 17.860 18.122 -12.984 1.00 0.00 O ATOM 1284 NE2 GLN B 29 18.603 16.197 -12.111 1.00 0.00 N ATOM 0 H GLN B 29 13.567 16.988 -11.835 1.00 0.00 H new ATOM 0 HA GLN B 29 13.933 14.598 -13.565 1.00 0.00 H new ATOM 0 HB2 GLN B 29 16.310 14.691 -12.869 1.00 0.00 H new ATOM 0 HB3 GLN B 29 15.796 15.932 -13.995 1.00 0.00 H new ATOM 0 HG2 GLN B 29 15.578 17.536 -12.055 1.00 0.00 H new ATOM 0 HG3 GLN B 29 16.220 16.293 -10.999 1.00 0.00 H new ATOM 0 HE21 GLN B 29 18.375 15.322 -11.638 1.00 0.00 H new ATOM 0 HE22 GLN B 29 19.571 16.411 -12.350 1.00 0.00 H new ATOM 1293 N VAL B 30 14.543 13.117 -11.498 1.00 0.00 N ATOM 1294 CA VAL B 30 14.265 12.111 -10.481 1.00 0.00 C ATOM 1295 C VAL B 30 15.509 11.260 -10.221 1.00 0.00 C ATOM 1296 O VAL B 30 16.372 11.134 -11.088 1.00 0.00 O ATOM 1297 CB VAL B 30 13.113 11.230 -10.994 1.00 0.00 C ATOM 1298 CG1 VAL B 30 12.685 10.180 -9.971 1.00 0.00 C ATOM 1299 CG2 VAL B 30 11.872 12.063 -11.320 1.00 0.00 C ATOM 0 H VAL B 30 15.180 12.799 -12.228 1.00 0.00 H new ATOM 0 HA VAL B 30 13.987 12.589 -9.542 1.00 0.00 H new ATOM 0 HB VAL B 30 13.501 10.743 -11.889 1.00 0.00 H new ATOM 0 HG11 VAL B 30 11.869 9.584 -10.381 1.00 0.00 H new ATOM 0 HG12 VAL B 30 13.530 9.530 -9.741 1.00 0.00 H new ATOM 0 HG13 VAL B 30 12.350 10.675 -9.060 1.00 0.00 H new ATOM 0 HG21 VAL B 30 11.078 11.408 -11.680 1.00 0.00 H new ATOM 0 HG22 VAL B 30 11.536 12.582 -10.422 1.00 0.00 H new ATOM 0 HG23 VAL B 30 12.117 12.794 -12.091 1.00 0.00 H new ATOM 1309 N ARG B 31 15.594 10.675 -9.020 1.00 0.00 N ATOM 1310 CA ARG B 31 16.654 9.753 -8.630 1.00 0.00 C ATOM 1311 C ARG B 31 16.056 8.363 -8.464 1.00 0.00 C ATOM 1312 O ARG B 31 15.296 8.113 -7.530 1.00 0.00 O ATOM 1313 CB ARG B 31 17.304 10.209 -7.322 1.00 0.00 C ATOM 1314 CG ARG B 31 18.634 10.927 -7.541 1.00 0.00 C ATOM 1315 CD ARG B 31 19.706 9.948 -8.021 1.00 0.00 C ATOM 1316 NE ARG B 31 21.047 10.542 -7.933 1.00 0.00 N ATOM 1317 CZ ARG B 31 21.847 10.446 -6.864 1.00 0.00 C ATOM 1318 NH1 ARG B 31 21.456 9.767 -5.789 1.00 0.00 N ATOM 1319 NH2 ARG B 31 23.044 11.028 -6.861 1.00 0.00 N ATOM 0 H ARG B 31 14.910 10.837 -8.280 1.00 0.00 H new ATOM 0 HA ARG B 31 17.424 9.734 -9.401 1.00 0.00 H new ATOM 0 HB2 ARG B 31 16.620 10.874 -6.794 1.00 0.00 H new ATOM 0 HB3 ARG B 31 17.465 9.343 -6.680 1.00 0.00 H new ATOM 0 HG2 ARG B 31 18.507 11.723 -8.275 1.00 0.00 H new ATOM 0 HG3 ARG B 31 18.955 11.399 -6.612 1.00 0.00 H new ATOM 0 HD2 ARG B 31 19.668 9.040 -7.420 1.00 0.00 H new ATOM 0 HD3 ARG B 31 19.501 9.657 -9.051 1.00 0.00 H new ATOM 0 HE ARG B 31 21.391 11.062 -8.740 1.00 0.00 H new ATOM 0 HH11 ARG B 31 20.542 9.315 -5.776 1.00 0.00 H new ATOM 0 HH12 ARG B 31 22.071 9.698 -4.978 1.00 0.00 H new ATOM 0 HH21 ARG B 31 23.358 11.552 -7.678 1.00 0.00 H new ATOM 0 HH22 ARG B 31 23.647 10.950 -6.042 1.00 0.00 H new ATOM 1333 N ILE B 32 16.414 7.469 -9.387 1.00 0.00 N ATOM 1334 CA ILE B 32 15.910 6.103 -9.442 1.00 0.00 C ATOM 1335 C ILE B 32 17.083 5.134 -9.287 1.00 0.00 C ATOM 1336 O ILE B 32 18.229 5.498 -9.546 1.00 0.00 O ATOM 1337 CB ILE B 32 15.170 5.896 -10.777 1.00 0.00 C ATOM 1338 CG1 ILE B 32 14.112 6.994 -10.966 1.00 0.00 C ATOM 1339 CG2 ILE B 32 14.504 4.516 -10.833 1.00 0.00 C ATOM 1340 CD1 ILE B 32 13.377 6.875 -12.303 1.00 0.00 C ATOM 0 H ILE B 32 17.077 7.683 -10.132 1.00 0.00 H new ATOM 0 HA ILE B 32 15.206 5.914 -8.632 1.00 0.00 H new ATOM 0 HB ILE B 32 15.902 5.954 -11.583 1.00 0.00 H new ATOM 0 HG12 ILE B 32 13.389 6.942 -10.152 1.00 0.00 H new ATOM 0 HG13 ILE B 32 14.592 7.971 -10.904 1.00 0.00 H new ATOM 0 HG21 ILE B 32 13.989 4.399 -11.787 1.00 0.00 H new ATOM 0 HG22 ILE B 32 15.264 3.741 -10.733 1.00 0.00 H new ATOM 0 HG23 ILE B 32 13.785 4.426 -10.019 1.00 0.00 H new ATOM 0 HD11 ILE B 32 12.641 7.675 -12.386 1.00 0.00 H new ATOM 0 HD12 ILE B 32 14.093 6.955 -13.120 1.00 0.00 H new ATOM 0 HD13 ILE B 32 12.872 5.910 -12.356 1.00 0.00 H new ATOM 1352 N GLY B 33 16.803 3.899 -8.866 1.00 0.00 N ATOM 1353 CA GLY B 33 17.824 2.872 -8.732 1.00 0.00 C ATOM 1354 C GLY B 33 17.312 1.532 -9.243 1.00 0.00 C ATOM 1355 O GLY B 33 16.105 1.315 -9.335 1.00 0.00 O ATOM 0 H GLY B 33 15.865 3.589 -8.611 1.00 0.00 H new ATOM 0 HA2 GLY B 33 18.714 3.163 -9.289 1.00 0.00 H new ATOM 0 HA3 GLY B 33 18.118 2.779 -7.687 1.00 0.00 H new ATOM 1359 N ILE B 34 18.242 0.633 -9.574 1.00 0.00 N ATOM 1360 CA ILE B 34 17.943 -0.681 -10.126 1.00 0.00 C ATOM 1361 C ILE B 34 18.814 -1.704 -9.404 1.00 0.00 C ATOM 1362 O ILE B 34 19.939 -1.392 -9.022 1.00 0.00 O ATOM 1363 CB ILE B 34 18.241 -0.690 -11.636 1.00 0.00 C ATOM 1364 CG1 ILE B 34 17.388 0.323 -12.411 1.00 0.00 C ATOM 1365 CG2 ILE B 34 17.971 -2.085 -12.205 1.00 0.00 C ATOM 1366 CD1 ILE B 34 18.076 1.685 -12.528 1.00 0.00 C ATOM 0 H ILE B 34 19.241 0.806 -9.462 1.00 0.00 H new ATOM 0 HA ILE B 34 16.890 -0.926 -9.986 1.00 0.00 H new ATOM 0 HB ILE B 34 19.288 -0.412 -11.754 1.00 0.00 H new ATOM 0 HG12 ILE B 34 17.182 -0.065 -13.408 1.00 0.00 H new ATOM 0 HG13 ILE B 34 16.427 0.445 -11.911 1.00 0.00 H new ATOM 0 HG21 ILE B 34 18.183 -2.089 -13.274 1.00 0.00 H new ATOM 0 HG22 ILE B 34 18.612 -2.812 -11.706 1.00 0.00 H new ATOM 0 HG23 ILE B 34 16.926 -2.349 -12.041 1.00 0.00 H new ATOM 0 HD11 ILE B 34 17.436 2.370 -13.084 1.00 0.00 H new ATOM 0 HD12 ILE B 34 18.258 2.087 -11.532 1.00 0.00 H new ATOM 0 HD13 ILE B 34 19.025 1.570 -13.052 1.00 0.00 H new ATOM 1378 N ASN B 35 18.308 -2.923 -9.212 1.00 0.00 N ATOM 1379 CA ASN B 35 19.054 -3.969 -8.533 1.00 0.00 C ATOM 1380 C ASN B 35 18.803 -5.320 -9.188 1.00 0.00 C ATOM 1381 O ASN B 35 17.705 -5.866 -9.115 1.00 0.00 O ATOM 1382 CB ASN B 35 18.667 -3.990 -7.059 1.00 0.00 C ATOM 1383 CG ASN B 35 19.555 -4.943 -6.276 1.00 0.00 C ATOM 1384 OD1 ASN B 35 20.722 -4.649 -6.033 1.00 0.00 O ATOM 1385 ND2 ASN B 35 19.012 -6.089 -5.877 1.00 0.00 N ATOM 0 H ASN B 35 17.378 -3.206 -9.522 1.00 0.00 H new ATOM 0 HA ASN B 35 20.121 -3.761 -8.613 1.00 0.00 H new ATOM 0 HB2 ASN B 35 18.750 -2.986 -6.643 1.00 0.00 H new ATOM 0 HB3 ASN B 35 17.625 -4.292 -6.957 1.00 0.00 H new ATOM 0 HD21 ASN B 35 19.569 -6.761 -5.349 1.00 0.00 H new ATOM 0 HD22 ASN B 35 18.038 -6.297 -6.099 1.00 0.00 H new ATOM 1392 N ALA B 36 19.846 -5.842 -9.827 1.00 0.00 N ATOM 1393 CA ALA B 36 19.838 -7.116 -10.524 1.00 0.00 C ATOM 1394 C ALA B 36 21.235 -7.728 -10.417 1.00 0.00 C ATOM 1395 O ALA B 36 22.196 -7.007 -10.144 1.00 0.00 O ATOM 1396 CB ALA B 36 19.478 -6.851 -11.987 1.00 0.00 C ATOM 0 H ALA B 36 20.749 -5.370 -9.873 1.00 0.00 H new ATOM 0 HA ALA B 36 19.112 -7.806 -10.093 1.00 0.00 H new ATOM 0 HB1 ALA B 36 19.465 -7.793 -12.535 1.00 0.00 H new ATOM 0 HB2 ALA B 36 18.494 -6.386 -12.041 1.00 0.00 H new ATOM 0 HB3 ALA B 36 20.219 -6.185 -12.429 1.00 0.00 H new ATOM 1402 N PRO B 37 21.377 -9.041 -10.624 1.00 0.00 N ATOM 1403 CA PRO B 37 22.674 -9.689 -10.620 1.00 0.00 C ATOM 1404 C PRO B 37 23.453 -9.281 -11.869 1.00 0.00 C ATOM 1405 O PRO B 37 22.878 -8.778 -12.832 1.00 0.00 O ATOM 1406 CB PRO B 37 22.366 -11.186 -10.606 1.00 0.00 C ATOM 1407 CG PRO B 37 21.021 -11.270 -11.327 1.00 0.00 C ATOM 1408 CD PRO B 37 20.312 -9.996 -10.877 1.00 0.00 C ATOM 0 HA PRO B 37 23.291 -9.410 -9.766 1.00 0.00 H new ATOM 0 HB2 PRO B 37 23.136 -11.761 -11.121 1.00 0.00 H new ATOM 0 HB3 PRO B 37 22.304 -11.575 -9.590 1.00 0.00 H new ATOM 0 HG2 PRO B 37 21.144 -11.303 -12.409 1.00 0.00 H new ATOM 0 HG3 PRO B 37 20.465 -12.163 -11.042 1.00 0.00 H new ATOM 0 HD2 PRO B 37 19.630 -9.632 -11.645 1.00 0.00 H new ATOM 0 HD3 PRO B 37 19.718 -10.171 -9.980 1.00 0.00 H new ATOM 1416 N LYS B 38 24.772 -9.497 -11.863 1.00 0.00 N ATOM 1417 CA LYS B 38 25.607 -9.178 -13.016 1.00 0.00 C ATOM 1418 C LYS B 38 25.341 -10.163 -14.159 1.00 0.00 C ATOM 1419 O LYS B 38 25.937 -10.045 -15.228 1.00 0.00 O ATOM 1420 CB LYS B 38 27.084 -9.163 -12.606 1.00 0.00 C ATOM 1421 CG LYS B 38 27.495 -7.818 -11.991 1.00 0.00 C ATOM 1422 CD LYS B 38 26.713 -7.473 -10.718 1.00 0.00 C ATOM 1423 CE LYS B 38 27.225 -6.171 -10.104 1.00 0.00 C ATOM 1424 NZ LYS B 38 28.617 -6.295 -9.630 1.00 0.00 N ATOM 0 H LYS B 38 25.280 -9.891 -11.071 1.00 0.00 H new ATOM 0 HA LYS B 38 25.353 -8.183 -13.380 1.00 0.00 H new ATOM 0 HB2 LYS B 38 27.269 -9.962 -11.888 1.00 0.00 H new ATOM 0 HB3 LYS B 38 27.705 -9.368 -13.478 1.00 0.00 H new ATOM 0 HG2 LYS B 38 28.560 -7.841 -11.761 1.00 0.00 H new ATOM 0 HG3 LYS B 38 27.345 -7.028 -12.727 1.00 0.00 H new ATOM 0 HD2 LYS B 38 25.653 -7.378 -10.952 1.00 0.00 H new ATOM 0 HD3 LYS B 38 26.809 -8.284 -9.996 1.00 0.00 H new ATOM 0 HE2 LYS B 38 27.163 -5.372 -10.843 1.00 0.00 H new ATOM 0 HE3 LYS B 38 26.582 -5.885 -9.271 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 28.843 -5.496 -9.003 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 28.728 -7.187 -9.108 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 29.263 -6.289 -10.445 1.00 0.00 H new ATOM 1438 N ASP B 39 24.449 -11.134 -13.938 1.00 0.00 N ATOM 1439 CA ASP B 39 24.005 -12.066 -14.966 1.00 0.00 C ATOM 1440 C ASP B 39 23.189 -11.347 -16.039 1.00 0.00 C ATOM 1441 O ASP B 39 22.964 -11.893 -17.119 1.00 0.00 O ATOM 1442 CB ASP B 39 23.137 -13.142 -14.312 1.00 0.00 C ATOM 1443 CG ASP B 39 22.816 -14.278 -15.282 1.00 0.00 C ATOM 1444 OD1 ASP B 39 23.778 -14.928 -15.748 1.00 0.00 O ATOM 1445 OD2 ASP B 39 21.611 -14.488 -15.549 1.00 0.00 O ATOM 0 H ASP B 39 24.014 -11.292 -13.029 1.00 0.00 H new ATOM 0 HA ASP B 39 24.880 -12.512 -15.439 1.00 0.00 H new ATOM 0 HB2 ASP B 39 23.652 -13.544 -13.439 1.00 0.00 H new ATOM 0 HB3 ASP B 39 22.209 -12.694 -13.957 1.00 0.00 H new ATOM 1450 N VAL B 40 22.747 -10.121 -15.740 1.00 0.00 N ATOM 1451 CA VAL B 40 21.944 -9.317 -16.649 1.00 0.00 C ATOM 1452 C VAL B 40 22.519 -7.906 -16.730 1.00 0.00 C ATOM 1453 O VAL B 40 23.406 -7.545 -15.955 1.00 0.00 O ATOM 1454 CB VAL B 40 20.477 -9.302 -16.197 1.00 0.00 C ATOM 1455 CG1 VAL B 40 19.956 -10.731 -16.028 1.00 0.00 C ATOM 1456 CG2 VAL B 40 20.299 -8.575 -14.864 1.00 0.00 C ATOM 0 H VAL B 40 22.942 -9.661 -14.851 1.00 0.00 H new ATOM 0 HA VAL B 40 21.975 -9.757 -17.646 1.00 0.00 H new ATOM 0 HB VAL B 40 19.917 -8.776 -16.970 1.00 0.00 H new ATOM 0 HG11 VAL B 40 18.915 -10.703 -15.707 1.00 0.00 H new ATOM 0 HG12 VAL B 40 20.029 -11.260 -16.978 1.00 0.00 H new ATOM 0 HG13 VAL B 40 20.553 -11.250 -15.278 1.00 0.00 H new ATOM 0 HG21 VAL B 40 19.247 -8.587 -14.581 1.00 0.00 H new ATOM 0 HG22 VAL B 40 20.888 -9.075 -14.095 1.00 0.00 H new ATOM 0 HG23 VAL B 40 20.636 -7.543 -14.965 1.00 0.00 H new ATOM 1466 N ALA B 41 22.013 -7.103 -17.668 1.00 0.00 N ATOM 1467 CA ALA B 41 22.518 -5.760 -17.882 1.00 0.00 C ATOM 1468 C ALA B 41 21.465 -4.719 -17.517 1.00 0.00 C ATOM 1469 O ALA B 41 20.267 -4.998 -17.539 1.00 0.00 O ATOM 1470 CB ALA B 41 22.942 -5.621 -19.342 1.00 0.00 C ATOM 0 H ALA B 41 21.250 -7.368 -18.291 1.00 0.00 H new ATOM 0 HA ALA B 41 23.380 -5.588 -17.237 1.00 0.00 H new ATOM 0 HB1 ALA B 41 23.324 -4.615 -19.516 1.00 0.00 H new ATOM 0 HB2 ALA B 41 23.722 -6.349 -19.565 1.00 0.00 H new ATOM 0 HB3 ALA B 41 22.083 -5.800 -19.989 1.00 0.00 H new ATOM 1476 N VAL B 42 21.927 -3.513 -17.181 1.00 0.00 N ATOM 1477 CA VAL B 42 21.082 -2.369 -16.866 1.00 0.00 C ATOM 1478 C VAL B 42 21.785 -1.103 -17.344 1.00 0.00 C ATOM 1479 O VAL B 42 22.906 -0.809 -16.934 1.00 0.00 O ATOM 1480 CB VAL B 42 20.741 -2.320 -15.369 1.00 0.00 C ATOM 1481 CG1 VAL B 42 21.907 -2.763 -14.489 1.00 0.00 C ATOM 1482 CG2 VAL B 42 20.316 -0.912 -14.947 1.00 0.00 C ATOM 0 H VAL B 42 22.924 -3.304 -17.120 1.00 0.00 H new ATOM 0 HA VAL B 42 20.127 -2.458 -17.384 1.00 0.00 H new ATOM 0 HB VAL B 42 19.915 -3.017 -15.226 1.00 0.00 H new ATOM 0 HG11 VAL B 42 21.613 -2.709 -13.441 1.00 0.00 H new ATOM 0 HG12 VAL B 42 22.181 -3.788 -14.737 1.00 0.00 H new ATOM 0 HG13 VAL B 42 22.761 -2.108 -14.660 1.00 0.00 H new ATOM 0 HG21 VAL B 42 20.081 -0.907 -13.883 1.00 0.00 H new ATOM 0 HG22 VAL B 42 21.129 -0.213 -15.142 1.00 0.00 H new ATOM 0 HG23 VAL B 42 19.435 -0.612 -15.515 1.00 0.00 H new ATOM 1492 N HIS B 43 21.108 -0.356 -18.218 1.00 0.00 N ATOM 1493 CA HIS B 43 21.631 0.865 -18.808 1.00 0.00 C ATOM 1494 C HIS B 43 20.518 1.902 -18.955 1.00 0.00 C ATOM 1495 O HIS B 43 19.363 1.624 -18.635 1.00 0.00 O ATOM 1496 CB HIS B 43 22.267 0.542 -20.166 1.00 0.00 C ATOM 1497 CG HIS B 43 23.404 -0.441 -20.056 1.00 0.00 C ATOM 1498 ND1 HIS B 43 24.747 -0.134 -20.011 1.00 0.00 N ATOM 1499 CD2 HIS B 43 23.288 -1.803 -19.979 1.00 0.00 C ATOM 1500 CE1 HIS B 43 25.418 -1.290 -19.860 1.00 0.00 C ATOM 1501 NE2 HIS B 43 24.575 -2.335 -19.853 1.00 0.00 N ATOM 0 H HIS B 43 20.168 -0.591 -18.537 1.00 0.00 H new ATOM 0 HA HIS B 43 22.395 1.287 -18.155 1.00 0.00 H new ATOM 0 HB2 HIS B 43 21.505 0.137 -20.832 1.00 0.00 H new ATOM 0 HB3 HIS B 43 22.631 1.463 -20.621 1.00 0.00 H new ATOM 0 HD1 HIS B 43 25.156 0.798 -20.080 1.00 0.00 H new ATOM 0 HD2 HIS B 43 22.367 -2.366 -20.010 1.00 0.00 H new ATOM 0 HE1 HIS B 43 26.490 -1.367 -19.758 1.00 0.00 H new ATOM 1509 N ARG B 44 20.865 3.098 -19.439 1.00 0.00 N ATOM 1510 CA ARG B 44 19.902 4.173 -19.642 1.00 0.00 C ATOM 1511 C ARG B 44 19.855 4.588 -21.109 1.00 0.00 C ATOM 1512 O ARG B 44 20.742 4.242 -21.881 1.00 0.00 O ATOM 1513 CB ARG B 44 20.149 5.323 -18.652 1.00 0.00 C ATOM 1514 CG ARG B 44 21.589 5.531 -18.174 1.00 0.00 C ATOM 1515 CD ARG B 44 22.485 6.105 -19.263 1.00 0.00 C ATOM 1516 NE ARG B 44 22.464 7.568 -19.250 1.00 0.00 N ATOM 1517 CZ ARG B 44 23.330 8.344 -18.591 1.00 0.00 C ATOM 1518 NH1 ARG B 44 24.297 7.814 -17.848 1.00 0.00 N ATOM 1519 NH2 ARG B 44 23.228 9.667 -18.676 1.00 0.00 N ATOM 0 H ARG B 44 21.820 3.343 -19.699 1.00 0.00 H new ATOM 0 HA ARG B 44 18.898 3.814 -19.415 1.00 0.00 H new ATOM 0 HB2 ARG B 44 19.809 6.249 -19.116 1.00 0.00 H new ATOM 0 HB3 ARG B 44 19.522 5.157 -17.776 1.00 0.00 H new ATOM 0 HG2 ARG B 44 21.590 6.202 -17.315 1.00 0.00 H new ATOM 0 HG3 ARG B 44 21.998 4.579 -17.835 1.00 0.00 H new ATOM 0 HD2 ARG B 44 23.506 5.752 -19.120 1.00 0.00 H new ATOM 0 HD3 ARG B 44 22.156 5.743 -20.237 1.00 0.00 H new ATOM 0 HE ARG B 44 21.731 8.032 -19.786 1.00 0.00 H new ATOM 0 HH11 ARG B 44 24.386 6.801 -17.774 1.00 0.00 H new ATOM 0 HH12 ARG B 44 24.949 8.421 -17.352 1.00 0.00 H new ATOM 0 HH21 ARG B 44 22.491 10.086 -19.243 1.00 0.00 H new ATOM 0 HH22 ARG B 44 23.887 10.263 -18.175 1.00 0.00 H new