USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 817 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 60 SER OG : rot 155:sc= 0.305 USER MOD Set 1.2: A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -85:sc= 0.127 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot -64:sc= 0.505 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HE2:sc= 0.152 K(o=0.15,f=-1.3) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -170:sc= -0.107 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 VAL N :NH3+ -175:sc= 0 (180deg=-0.0207) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 7 SER OG : rot 180:sc= 0 USER MOD Single : B 8 SER OG : rot 161:sc= 0.117 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.320 -29.605 7.450 1.00 0.00 N ATOM 2 CA GLY A 1 -3.499 -28.979 6.778 1.00 0.00 C ATOM 3 C GLY A 1 -3.104 -28.007 5.675 1.00 0.00 C ATOM 4 O GLY A 1 -2.911 -28.428 4.514 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.648 -30.257 8.191 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.760 -30.131 6.749 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.730 -28.863 7.878 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.129 -29.762 6.357 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.098 -28.453 7.522 1.00 0.00 H new ATOM 10 N ALA A 2 -2.981 -26.621 6.076 1.00 0.00 N ATOM 11 CA ALA A 2 -2.598 -25.340 5.223 1.00 0.00 C ATOM 12 C ALA A 2 -3.545 -24.967 4.006 1.00 0.00 C ATOM 13 O ALA A 2 -3.798 -25.820 3.091 1.00 0.00 O ATOM 14 CB ALA A 2 -1.059 -25.226 4.846 1.00 0.00 C ATOM 0 H ALA A 2 -3.155 -26.361 7.047 1.00 0.00 H new ATOM 0 HA ALA A 2 -2.802 -24.557 5.953 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.893 -24.320 4.264 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.463 -25.185 5.758 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -0.763 -26.095 4.258 1.00 0.00 H new ATOM 20 N MET A 3 -4.093 -23.656 4.067 1.00 0.00 N ATOM 21 CA MET A 3 -4.976 -22.983 3.004 1.00 0.00 C ATOM 22 C MET A 3 -4.254 -21.789 2.260 1.00 0.00 C ATOM 23 O MET A 3 -3.456 -21.016 2.885 1.00 0.00 O ATOM 24 CB MET A 3 -6.429 -22.558 3.557 1.00 0.00 C ATOM 25 CG MET A 3 -7.491 -23.687 3.647 1.00 0.00 C ATOM 26 SD MET A 3 -7.266 -24.846 5.034 1.00 0.00 S ATOM 27 CE MET A 3 -8.610 -25.993 4.738 1.00 0.00 C ATOM 0 H MET A 3 -3.924 -23.046 4.867 1.00 0.00 H new ATOM 0 HA MET A 3 -5.148 -23.755 2.254 1.00 0.00 H new ATOM 0 HB2 MET A 3 -6.304 -22.127 4.550 1.00 0.00 H new ATOM 0 HB3 MET A 3 -6.822 -21.770 2.915 1.00 0.00 H new ATOM 0 HG2 MET A 3 -8.478 -23.231 3.730 1.00 0.00 H new ATOM 0 HG3 MET A 3 -7.479 -24.252 2.715 1.00 0.00 H new ATOM 0 HE1 MET A 3 -8.605 -26.765 5.507 1.00 0.00 H new ATOM 0 HE2 MET A 3 -9.559 -25.457 4.767 1.00 0.00 H new ATOM 0 HE3 MET A 3 -8.485 -26.456 3.759 1.00 0.00 H new ATOM 37 N GLU A 4 -4.578 -21.670 0.880 1.00 0.00 N ATOM 38 CA GLU A 4 -4.000 -20.648 -0.133 1.00 0.00 C ATOM 39 C GLU A 4 -4.792 -19.243 -0.178 1.00 0.00 C ATOM 40 O GLU A 4 -5.912 -19.120 0.388 1.00 0.00 O ATOM 41 CB GLU A 4 -3.807 -21.283 -1.606 1.00 0.00 C ATOM 42 CG GLU A 4 -2.711 -22.407 -1.769 1.00 0.00 C ATOM 43 CD GLU A 4 -2.584 -22.977 -3.202 1.00 0.00 C ATOM 44 OE1 GLU A 4 -1.770 -22.437 -3.999 1.00 0.00 O ATOM 45 OE2 GLU A 4 -3.277 -23.984 -3.514 1.00 0.00 O ATOM 0 H GLU A 4 -5.257 -22.293 0.443 1.00 0.00 H new ATOM 0 HA GLU A 4 -3.008 -20.406 0.249 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -4.764 -21.696 -1.924 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.565 -20.473 -2.294 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -1.746 -22.002 -1.466 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -2.942 -23.224 -1.086 1.00 0.00 H new ATOM 52 N MET A 5 -4.111 -18.197 -0.837 1.00 0.00 N ATOM 53 CA MET A 5 -4.542 -16.742 -1.016 1.00 0.00 C ATOM 54 C MET A 5 -5.068 -16.371 -2.511 1.00 0.00 C ATOM 55 O MET A 5 -4.716 -17.060 -3.514 1.00 0.00 O ATOM 56 CB MET A 5 -3.406 -15.708 -0.417 1.00 0.00 C ATOM 57 CG MET A 5 -1.921 -15.779 -0.997 1.00 0.00 C ATOM 58 SD MET A 5 -0.663 -14.725 -0.147 1.00 0.00 S ATOM 59 CE MET A 5 -0.194 -15.654 1.350 1.00 0.00 C ATOM 0 H MET A 5 -3.205 -18.367 -1.274 1.00 0.00 H new ATOM 0 HA MET A 5 -5.438 -16.608 -0.410 1.00 0.00 H new ATOM 0 HB2 MET A 5 -3.771 -14.692 -0.568 1.00 0.00 H new ATOM 0 HB3 MET A 5 -3.348 -15.869 0.660 1.00 0.00 H new ATOM 0 HG2 MET A 5 -1.585 -16.815 -0.954 1.00 0.00 H new ATOM 0 HG3 MET A 5 -1.950 -15.497 -2.049 1.00 0.00 H new ATOM 0 HE1 MET A 5 0.552 -15.090 1.909 1.00 0.00 H new ATOM 0 HE2 MET A 5 -1.075 -15.808 1.974 1.00 0.00 H new ATOM 0 HE3 MET A 5 0.221 -16.620 1.063 1.00 0.00 H new ATOM 69 N GLU A 6 -5.894 -15.235 -2.566 1.00 0.00 N ATOM 70 CA GLU A 6 -6.572 -14.593 -3.799 1.00 0.00 C ATOM 71 C GLU A 6 -6.283 -13.031 -3.871 1.00 0.00 C ATOM 72 O GLU A 6 -6.699 -12.255 -2.963 1.00 0.00 O ATOM 73 CB GLU A 6 -8.158 -15.018 -4.042 1.00 0.00 C ATOM 74 CG GLU A 6 -9.233 -14.805 -2.871 1.00 0.00 C ATOM 75 CD GLU A 6 -10.678 -15.193 -3.258 1.00 0.00 C ATOM 76 OE1 GLU A 6 -11.067 -16.373 -3.046 1.00 0.00 O ATOM 77 OE2 GLU A 6 -11.430 -14.307 -3.747 1.00 0.00 O ATOM 0 H GLU A 6 -6.116 -14.718 -1.715 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.090 -15.040 -4.669 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -8.512 -14.465 -4.912 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -8.173 -16.075 -4.308 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -8.931 -15.393 -2.004 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -9.219 -13.758 -2.567 1.00 0.00 H new ATOM 84 N TYR A 7 -5.571 -12.613 -5.005 1.00 0.00 N ATOM 85 CA TYR A 7 -4.978 -11.195 -5.257 1.00 0.00 C ATOM 86 C TYR A 7 -5.918 -10.243 -6.109 1.00 0.00 C ATOM 87 O TYR A 7 -6.657 -10.731 -7.034 1.00 0.00 O ATOM 88 CB TYR A 7 -3.524 -11.312 -5.951 1.00 0.00 C ATOM 89 CG TYR A 7 -2.346 -12.068 -5.196 1.00 0.00 C ATOM 90 CD1 TYR A 7 -2.215 -13.482 -5.205 1.00 0.00 C ATOM 91 CD2 TYR A 7 -1.371 -11.346 -4.531 1.00 0.00 C ATOM 92 CE1 TYR A 7 -1.158 -14.111 -4.575 1.00 0.00 C ATOM 93 CE2 TYR A 7 -0.303 -11.983 -3.894 1.00 0.00 C ATOM 94 CZ TYR A 7 -0.202 -13.359 -3.927 1.00 0.00 C ATOM 95 OH TYR A 7 0.853 -13.983 -3.300 1.00 0.00 O ATOM 0 H TYR A 7 -5.386 -13.249 -5.781 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.889 -10.729 -4.276 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.662 -11.804 -6.914 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -3.180 -10.299 -6.158 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -2.957 -14.078 -5.715 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -1.437 -10.268 -4.504 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.081 -15.188 -4.590 1.00 0.00 H new ATOM 0 HE2 TYR A 7 0.443 -11.399 -3.376 1.00 0.00 H new ATOM 0 HH TYR A 7 0.584 -14.253 -2.397 1.00 0.00 H new ATOM 105 N GLU A 8 -5.869 -8.842 -5.758 1.00 0.00 N ATOM 106 CA GLU A 8 -6.740 -7.744 -6.403 1.00 0.00 C ATOM 107 C GLU A 8 -5.839 -6.515 -6.928 1.00 0.00 C ATOM 108 O GLU A 8 -4.918 -6.025 -6.202 1.00 0.00 O ATOM 109 CB GLU A 8 -7.922 -7.284 -5.371 1.00 0.00 C ATOM 110 CG GLU A 8 -9.239 -6.647 -5.992 1.00 0.00 C ATOM 111 CD GLU A 8 -10.314 -6.254 -4.952 1.00 0.00 C ATOM 112 OE1 GLU A 8 -10.290 -5.091 -4.466 1.00 0.00 O ATOM 113 OE2 GLU A 8 -11.199 -7.101 -4.649 1.00 0.00 O ATOM 0 H GLU A 8 -5.239 -8.480 -5.042 1.00 0.00 H new ATOM 0 HA GLU A 8 -7.230 -8.150 -7.288 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.215 -8.156 -4.786 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -7.496 -6.562 -4.674 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.964 -5.761 -6.564 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.674 -7.357 -6.695 1.00 0.00 H new ATOM 120 N GLU A 9 -6.143 -6.077 -8.249 1.00 0.00 N ATOM 121 CA GLU A 9 -5.534 -4.869 -8.977 1.00 0.00 C ATOM 122 C GLU A 9 -6.564 -3.645 -9.102 1.00 0.00 C ATOM 123 O GLU A 9 -7.633 -3.770 -9.795 1.00 0.00 O ATOM 124 CB GLU A 9 -4.765 -5.261 -10.379 1.00 0.00 C ATOM 125 CG GLU A 9 -5.560 -6.025 -11.553 1.00 0.00 C ATOM 126 CD GLU A 9 -4.713 -6.326 -12.808 1.00 0.00 C ATOM 127 OE1 GLU A 9 -4.683 -5.475 -13.737 1.00 0.00 O ATOM 128 OE2 GLU A 9 -4.106 -7.428 -12.875 1.00 0.00 O ATOM 0 H GLU A 9 -6.825 -6.568 -8.827 1.00 0.00 H new ATOM 0 HA GLU A 9 -4.732 -4.502 -8.337 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.374 -4.336 -10.803 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -3.907 -5.879 -10.115 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -5.950 -6.964 -11.159 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -6.419 -5.421 -11.846 1.00 0.00 H new ATOM 135 N ILE A 10 -6.218 -2.491 -8.366 1.00 0.00 N ATOM 136 CA ILE A 10 -7.072 -1.192 -8.270 1.00 0.00 C ATOM 137 C ILE A 10 -6.301 0.058 -9.005 1.00 0.00 C ATOM 138 O ILE A 10 -5.047 0.168 -8.943 1.00 0.00 O ATOM 139 CB ILE A 10 -7.510 -0.838 -6.643 1.00 0.00 C ATOM 140 CG1 ILE A 10 -8.226 -2.093 -5.902 1.00 0.00 C ATOM 141 CG2 ILE A 10 -8.500 0.447 -6.506 1.00 0.00 C ATOM 142 CD1 ILE A 10 -7.894 -2.271 -4.384 1.00 0.00 C ATOM 0 H ILE A 10 -5.353 -2.432 -7.829 1.00 0.00 H new ATOM 0 HA ILE A 10 -8.008 -1.355 -8.804 1.00 0.00 H new ATOM 0 HB ILE A 10 -6.560 -0.612 -6.159 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -9.305 -1.984 -6.008 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -7.945 -3.007 -6.425 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -8.736 0.614 -5.455 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -8.008 1.331 -6.912 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -9.420 0.258 -7.059 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -8.427 -3.139 -3.994 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -6.821 -2.419 -4.261 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -8.203 -1.380 -3.837 1.00 0.00 H new ATOM 154 N THR A 11 -7.165 0.958 -9.691 1.00 0.00 N ATOM 155 CA THR A 11 -6.791 2.323 -10.292 1.00 0.00 C ATOM 156 C THR A 11 -7.447 3.539 -9.531 1.00 0.00 C ATOM 157 O THR A 11 -8.711 3.617 -9.366 1.00 0.00 O ATOM 158 CB THR A 11 -6.978 2.493 -11.891 1.00 0.00 C ATOM 159 OG1 THR A 11 -7.953 1.600 -12.468 1.00 0.00 O ATOM 160 CG2 THR A 11 -5.641 2.454 -12.650 1.00 0.00 C ATOM 0 H THR A 11 -8.150 0.737 -9.835 1.00 0.00 H new ATOM 0 HA THR A 11 -5.713 2.339 -10.133 1.00 0.00 H new ATOM 0 HB THR A 11 -7.391 3.494 -12.017 1.00 0.00 H new ATOM 0 HG1 THR A 11 -8.013 1.761 -13.433 1.00 0.00 H new ATOM 0 HG21 THR A 11 -5.825 2.572 -13.718 1.00 0.00 H new ATOM 0 HG22 THR A 11 -5.000 3.264 -12.300 1.00 0.00 H new ATOM 0 HG23 THR A 11 -5.149 1.498 -12.471 1.00 0.00 H new ATOM 168 N LEU A 12 -6.503 4.456 -9.038 1.00 0.00 N ATOM 169 CA LEU A 12 -6.771 5.788 -8.345 1.00 0.00 C ATOM 170 C LEU A 12 -6.178 7.006 -9.131 1.00 0.00 C ATOM 171 O LEU A 12 -5.168 6.857 -9.870 1.00 0.00 O ATOM 172 CB LEU A 12 -6.202 5.801 -6.774 1.00 0.00 C ATOM 173 CG LEU A 12 -7.110 5.405 -5.486 1.00 0.00 C ATOM 174 CD1 LEU A 12 -8.396 6.249 -5.268 1.00 0.00 C ATOM 175 CD2 LEU A 12 -7.378 3.903 -5.326 1.00 0.00 C ATOM 0 H LEU A 12 -5.503 4.272 -9.120 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.856 5.894 -8.326 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -5.338 5.137 -6.756 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.833 6.810 -6.590 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.448 5.692 -4.669 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -8.919 5.893 -4.380 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.125 7.296 -5.134 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.047 6.151 -6.136 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -7.991 3.735 -4.441 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.902 3.531 -6.206 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.431 3.374 -5.217 1.00 0.00 H new ATOM 187 N GLU A 13 -6.894 8.229 -8.994 1.00 0.00 N ATOM 188 CA GLU A 13 -6.399 9.590 -9.454 1.00 0.00 C ATOM 189 C GLU A 13 -5.846 10.449 -8.244 1.00 0.00 C ATOM 190 O GLU A 13 -6.555 10.610 -7.202 1.00 0.00 O ATOM 191 CB GLU A 13 -7.393 10.388 -10.499 1.00 0.00 C ATOM 192 CG GLU A 13 -8.884 10.770 -10.134 1.00 0.00 C ATOM 193 CD GLU A 13 -9.945 9.621 -10.141 1.00 0.00 C ATOM 194 OE1 GLU A 13 -10.559 9.375 -11.211 1.00 0.00 O ATOM 195 OE2 GLU A 13 -10.164 8.999 -9.070 1.00 0.00 O ATOM 0 H GLU A 13 -7.818 8.271 -8.563 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.540 9.396 -10.096 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -6.888 11.318 -10.760 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -7.439 9.785 -11.406 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -8.883 11.221 -9.142 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -9.215 11.538 -10.833 1.00 0.00 H new ATOM 202 N ARG A 14 -4.544 11.020 -8.440 1.00 0.00 N ATOM 203 CA ARG A 14 -3.645 11.731 -7.396 1.00 0.00 C ATOM 204 C ARG A 14 -4.325 13.041 -6.767 1.00 0.00 C ATOM 205 O ARG A 14 -4.547 14.086 -7.470 1.00 0.00 O ATOM 206 CB ARG A 14 -2.156 11.964 -8.029 1.00 0.00 C ATOM 207 CG ARG A 14 -0.862 11.974 -7.056 1.00 0.00 C ATOM 208 CD ARG A 14 -0.532 13.323 -6.290 1.00 0.00 C ATOM 209 NE ARG A 14 0.028 14.438 -7.190 1.00 0.00 N ATOM 210 CZ ARG A 14 0.684 15.644 -6.835 1.00 0.00 C ATOM 211 NH1 ARG A 14 0.942 16.032 -5.543 1.00 0.00 N ATOM 212 NH2 ARG A 14 1.080 16.451 -7.812 1.00 0.00 N ATOM 0 H ARG A 14 -4.096 10.989 -9.356 1.00 0.00 H new ATOM 0 HA ARG A 14 -3.525 11.082 -6.529 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -1.995 11.187 -8.777 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.173 12.917 -8.558 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -0.995 11.189 -6.312 1.00 0.00 H new ATOM 0 HG3 ARG A 14 0.009 11.704 -7.653 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -1.439 13.684 -5.805 1.00 0.00 H new ATOM 0 HD3 ARG A 14 0.189 13.112 -5.500 1.00 0.00 H new ATOM 0 HE ARG A 14 -0.090 14.287 -8.192 1.00 0.00 H new ATOM 0 HH11 ARG A 14 0.656 15.437 -4.765 1.00 0.00 H new ATOM 0 HH12 ARG A 14 1.419 16.915 -5.361 1.00 0.00 H new ATOM 0 HH21 ARG A 14 0.909 16.196 -8.785 1.00 0.00 H new ATOM 0 HH22 ARG A 14 1.555 17.326 -7.590 1.00 0.00 H new ATOM 226 N GLY A 15 -4.687 12.870 -5.405 1.00 0.00 N ATOM 227 CA GLY A 15 -5.490 13.870 -4.555 1.00 0.00 C ATOM 228 C GLY A 15 -4.801 15.209 -4.127 1.00 0.00 C ATOM 229 O GLY A 15 -3.558 15.255 -3.916 1.00 0.00 O ATOM 0 H GLY A 15 -4.426 12.035 -4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -6.394 14.125 -5.108 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -5.806 13.355 -3.648 1.00 0.00 H new ATOM 233 N ASN A 16 -5.694 16.306 -3.998 1.00 0.00 N ATOM 234 CA ASN A 16 -5.353 17.763 -3.529 1.00 0.00 C ATOM 235 C ASN A 16 -5.206 17.915 -1.931 1.00 0.00 C ATOM 236 O ASN A 16 -4.438 18.805 -1.449 1.00 0.00 O ATOM 237 CB ASN A 16 -6.381 18.846 -4.133 1.00 0.00 C ATOM 238 CG ASN A 16 -6.264 19.118 -5.666 1.00 0.00 C ATOM 239 OD1 ASN A 16 -6.905 18.442 -6.480 1.00 0.00 O ATOM 240 ND2 ASN A 16 -5.467 20.127 -6.045 1.00 0.00 N ATOM 0 H ASN A 16 -6.685 16.204 -4.219 1.00 0.00 H new ATOM 0 HA ASN A 16 -4.365 17.973 -3.939 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -7.397 18.512 -3.920 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -6.237 19.788 -3.605 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -5.374 20.359 -7.034 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.954 20.662 -5.345 1.00 0.00 H new ATOM 247 N SER A 17 -5.955 16.971 -1.141 1.00 0.00 N ATOM 248 CA SER A 17 -5.874 16.765 0.380 1.00 0.00 C ATOM 249 C SER A 17 -4.772 15.650 0.804 1.00 0.00 C ATOM 250 O SER A 17 -4.271 15.682 1.979 1.00 0.00 O ATOM 251 CB SER A 17 -7.300 16.417 0.972 1.00 0.00 C ATOM 252 OG SER A 17 -8.220 17.499 0.829 1.00 0.00 O ATOM 0 H SER A 17 -6.630 16.340 -1.573 1.00 0.00 H new ATOM 0 HA SER A 17 -5.538 17.708 0.813 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.696 15.536 0.467 1.00 0.00 H new ATOM 0 HB3 SER A 17 -7.202 16.163 2.027 1.00 0.00 H new ATOM 0 HG SER A 17 -9.088 17.242 1.205 1.00 0.00 H new ATOM 258 N GLY A 18 -4.382 14.692 -0.222 1.00 0.00 N ATOM 259 CA GLY A 18 -3.281 13.672 -0.096 1.00 0.00 C ATOM 260 C GLY A 18 -3.778 12.229 -0.057 1.00 0.00 C ATOM 261 O GLY A 18 -3.431 11.481 0.882 1.00 0.00 O ATOM 0 H GLY A 18 -4.850 14.651 -1.127 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -2.594 13.787 -0.935 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -2.713 13.875 0.812 1.00 0.00 H new ATOM 265 N LEU A 19 -4.622 11.833 -1.166 1.00 0.00 N ATOM 266 CA LEU A 19 -5.310 10.466 -1.448 1.00 0.00 C ATOM 267 C LEU A 19 -6.447 9.936 -0.474 1.00 0.00 C ATOM 268 O LEU A 19 -7.479 9.436 -0.975 1.00 0.00 O ATOM 269 CB LEU A 19 -4.308 9.273 -2.009 1.00 0.00 C ATOM 270 CG LEU A 19 -3.932 9.066 -3.531 1.00 0.00 C ATOM 271 CD1 LEU A 19 -5.067 8.876 -4.529 1.00 0.00 C ATOM 272 CD2 LEU A 19 -2.806 9.932 -4.024 1.00 0.00 C ATOM 0 H LEU A 19 -4.836 12.502 -1.905 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.922 10.791 -2.290 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.364 9.396 -1.478 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.742 8.331 -1.674 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.526 8.055 -3.495 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.654 8.746 -5.529 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -5.646 7.993 -4.258 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.715 9.753 -4.515 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.619 9.721 -5.077 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.076 10.982 -3.907 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.906 9.722 -3.446 1.00 0.00 H new ATOM 284 N GLY A 20 -6.208 10.042 0.907 1.00 0.00 N ATOM 285 CA GLY A 20 -7.177 9.623 2.007 1.00 0.00 C ATOM 286 C GLY A 20 -6.803 8.329 2.788 1.00 0.00 C ATOM 287 O GLY A 20 -7.722 7.638 3.292 1.00 0.00 O ATOM 0 H GLY A 20 -5.336 10.421 1.277 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -7.262 10.443 2.720 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -8.162 9.484 1.562 1.00 0.00 H new ATOM 291 N PHE A 21 -5.403 8.005 2.874 1.00 0.00 N ATOM 292 CA PHE A 21 -4.733 6.848 3.612 1.00 0.00 C ATOM 293 C PHE A 21 -3.196 7.250 3.937 1.00 0.00 C ATOM 294 O PHE A 21 -2.685 8.284 3.376 1.00 0.00 O ATOM 295 CB PHE A 21 -4.859 5.403 2.755 1.00 0.00 C ATOM 296 CG PHE A 21 -4.065 5.172 1.374 1.00 0.00 C ATOM 297 CD1 PHE A 21 -4.443 5.811 0.173 1.00 0.00 C ATOM 298 CD2 PHE A 21 -2.987 4.284 1.329 1.00 0.00 C ATOM 299 CE1 PHE A 21 -3.769 5.575 -1.017 1.00 0.00 C ATOM 300 CE2 PHE A 21 -2.305 4.049 0.137 1.00 0.00 C ATOM 301 CZ PHE A 21 -2.697 4.694 -1.032 1.00 0.00 C ATOM 0 H PHE A 21 -4.711 8.586 2.401 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.250 6.672 4.555 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.555 4.605 3.433 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.917 5.253 2.541 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.275 6.499 0.181 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -2.679 3.773 2.229 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.077 6.073 -1.925 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -1.470 3.364 0.120 1.00 0.00 H new ATOM 0 HZ PHE A 21 -2.165 4.508 -1.954 1.00 0.00 H new ATOM 311 N SER A 22 -2.469 6.443 4.884 1.00 0.00 N ATOM 312 CA SER A 22 -0.954 6.536 5.121 1.00 0.00 C ATOM 313 C SER A 22 -0.279 5.100 5.133 1.00 0.00 C ATOM 314 O SER A 22 -0.911 4.101 5.625 1.00 0.00 O ATOM 315 CB SER A 22 -0.580 7.380 6.397 1.00 0.00 C ATOM 316 OG SER A 22 -0.984 8.741 6.302 1.00 0.00 O ATOM 0 H SER A 22 -2.923 5.743 5.471 1.00 0.00 H new ATOM 0 HA SER A 22 -0.541 7.084 4.274 1.00 0.00 H new ATOM 0 HB2 SER A 22 -1.046 6.929 7.273 1.00 0.00 H new ATOM 0 HB3 SER A 22 0.498 7.337 6.551 1.00 0.00 H new ATOM 0 HG SER A 22 -0.503 9.174 5.566 1.00 0.00 H new ATOM 322 N ILE A 23 1.053 5.009 4.587 1.00 0.00 N ATOM 323 CA ILE A 23 1.872 3.680 4.396 1.00 0.00 C ATOM 324 C ILE A 23 3.244 3.494 5.119 1.00 0.00 C ATOM 325 O ILE A 23 4.188 4.298 4.944 1.00 0.00 O ATOM 326 CB ILE A 23 1.830 2.966 2.929 1.00 0.00 C ATOM 327 CG1 ILE A 23 1.855 3.893 1.584 1.00 0.00 C ATOM 328 CG2 ILE A 23 0.620 2.098 2.939 1.00 0.00 C ATOM 329 CD1 ILE A 23 3.158 4.679 1.168 1.00 0.00 C ATOM 0 H ILE A 23 1.568 5.834 4.278 1.00 0.00 H new ATOM 0 HA ILE A 23 1.203 3.098 5.030 1.00 0.00 H new ATOM 0 HB ILE A 23 2.782 2.445 2.827 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.589 3.249 0.746 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.057 4.628 1.687 1.00 0.00 H new ATOM 0 HG21 ILE A 23 0.531 1.587 1.980 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.708 1.360 3.737 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.266 2.711 3.107 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.970 5.234 0.249 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.433 5.374 1.962 1.00 0.00 H new ATOM 0 HD13 ILE A 23 3.973 3.973 1.006 1.00 0.00 H new ATOM 341 N ALA A 24 3.311 2.297 5.917 1.00 0.00 N ATOM 342 CA ALA A 24 4.478 1.895 6.804 1.00 0.00 C ATOM 343 C ALA A 24 5.307 0.691 6.216 1.00 0.00 C ATOM 344 O ALA A 24 4.756 -0.436 5.988 1.00 0.00 O ATOM 345 CB ALA A 24 4.002 1.635 8.265 1.00 0.00 C ATOM 0 H ALA A 24 2.550 1.618 5.938 1.00 0.00 H new ATOM 0 HA ALA A 24 5.169 2.737 6.828 1.00 0.00 H new ATOM 0 HB1 ALA A 24 4.855 1.349 8.880 1.00 0.00 H new ATOM 0 HB2 ALA A 24 3.552 2.542 8.668 1.00 0.00 H new ATOM 0 HB3 ALA A 24 3.265 0.832 8.270 1.00 0.00 H new ATOM 351 N GLY A 25 6.638 0.996 5.961 1.00 0.00 N ATOM 352 CA GLY A 25 7.650 0.058 5.357 1.00 0.00 C ATOM 353 C GLY A 25 9.054 0.670 5.210 1.00 0.00 C ATOM 354 O GLY A 25 9.201 1.921 5.255 1.00 0.00 O ATOM 0 H GLY A 25 7.032 1.912 6.175 1.00 0.00 H new ATOM 0 HA2 GLY A 25 7.717 -0.837 5.976 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.297 -0.259 4.375 1.00 0.00 H new ATOM 358 N GLY A 26 10.085 -0.256 5.045 1.00 0.00 N ATOM 359 CA GLY A 26 11.558 0.129 4.990 1.00 0.00 C ATOM 360 C GLY A 26 12.582 -1.021 4.928 1.00 0.00 C ATOM 361 O GLY A 26 12.324 -2.123 5.472 1.00 0.00 O ATOM 0 H GLY A 26 9.922 -1.258 4.950 1.00 0.00 H new ATOM 0 HA2 GLY A 26 11.709 0.764 4.117 1.00 0.00 H new ATOM 0 HA3 GLY A 26 11.782 0.735 5.868 1.00 0.00 H new ATOM 365 N THR A 27 13.795 -0.700 4.276 1.00 0.00 N ATOM 366 CA THR A 27 15.093 -1.578 4.253 1.00 0.00 C ATOM 367 C THR A 27 16.186 -1.130 5.317 1.00 0.00 C ATOM 368 O THR A 27 16.824 -2.017 5.962 1.00 0.00 O ATOM 369 CB THR A 27 15.767 -1.822 2.803 1.00 0.00 C ATOM 370 OG1 THR A 27 15.860 -0.627 2.005 1.00 0.00 O ATOM 371 CG2 THR A 27 15.117 -2.982 2.031 1.00 0.00 C ATOM 0 H THR A 27 13.907 0.168 3.753 1.00 0.00 H new ATOM 0 HA THR A 27 14.704 -2.551 4.552 1.00 0.00 H new ATOM 0 HB THR A 27 16.793 -2.122 3.015 1.00 0.00 H new ATOM 0 HG1 THR A 27 16.276 -0.840 1.144 1.00 0.00 H new ATOM 0 HG21 THR A 27 15.610 -3.099 1.066 1.00 0.00 H new ATOM 0 HG22 THR A 27 15.219 -3.903 2.604 1.00 0.00 H new ATOM 0 HG23 THR A 27 14.060 -2.768 1.874 1.00 0.00 H new ATOM 379 N ASP A 28 16.354 0.279 5.491 1.00 0.00 N ATOM 380 CA ASP A 28 17.272 0.963 6.514 1.00 0.00 C ATOM 381 C ASP A 28 16.475 1.500 7.805 1.00 0.00 C ATOM 382 O ASP A 28 17.009 1.400 8.949 1.00 0.00 O ATOM 383 CB ASP A 28 18.194 2.113 5.863 1.00 0.00 C ATOM 384 CG ASP A 28 19.324 1.617 4.918 1.00 0.00 C ATOM 385 OD1 ASP A 28 20.450 1.364 5.410 1.00 0.00 O ATOM 386 OD2 ASP A 28 19.073 1.503 3.693 1.00 0.00 O ATOM 0 H ASP A 28 15.848 0.952 4.916 1.00 0.00 H new ATOM 0 HA ASP A 28 17.948 0.182 6.862 1.00 0.00 H new ATOM 0 HB2 ASP A 28 17.552 2.795 5.305 1.00 0.00 H new ATOM 0 HB3 ASP A 28 18.647 2.690 6.669 1.00 0.00 H new ATOM 391 N ASN A 29 15.153 2.042 7.568 1.00 0.00 N ATOM 392 CA ASN A 29 14.175 2.576 8.610 1.00 0.00 C ATOM 393 C ASN A 29 12.997 1.473 8.954 1.00 0.00 C ATOM 394 O ASN A 29 12.148 1.206 8.049 1.00 0.00 O ATOM 395 CB ASN A 29 13.574 4.033 8.232 1.00 0.00 C ATOM 396 CG ASN A 29 14.580 5.222 8.289 1.00 0.00 C ATOM 397 OD1 ASN A 29 15.254 5.532 7.300 1.00 0.00 O ATOM 398 ND2 ASN A 29 14.650 5.902 9.443 1.00 0.00 N ATOM 0 H ASN A 29 14.771 2.103 6.624 1.00 0.00 H new ATOM 0 HA ASN A 29 14.748 2.730 9.524 1.00 0.00 H new ATOM 0 HB2 ASN A 29 13.158 3.983 7.226 1.00 0.00 H new ATOM 0 HB3 ASN A 29 12.747 4.250 8.908 1.00 0.00 H new ATOM 0 HD21 ASN A 29 15.275 6.704 9.525 1.00 0.00 H new ATOM 0 HD22 ASN A 29 14.079 5.617 10.238 1.00 0.00 H new ATOM 405 N PRO A 30 12.934 0.750 10.314 1.00 0.00 N ATOM 406 CA PRO A 30 11.874 -0.346 10.664 1.00 0.00 C ATOM 407 C PRO A 30 10.330 0.117 10.872 1.00 0.00 C ATOM 408 O PRO A 30 10.053 1.318 11.177 1.00 0.00 O ATOM 409 CB PRO A 30 12.443 -1.018 11.980 1.00 0.00 C ATOM 410 CG PRO A 30 13.750 -0.335 12.345 1.00 0.00 C ATOM 411 CD PRO A 30 13.883 0.931 11.529 1.00 0.00 C ATOM 0 HA PRO A 30 11.772 -1.004 9.801 1.00 0.00 H new ATOM 0 HB2 PRO A 30 11.725 -0.922 12.795 1.00 0.00 H new ATOM 0 HB3 PRO A 30 12.604 -2.084 11.821 1.00 0.00 H new ATOM 0 HG2 PRO A 30 13.769 -0.102 13.410 1.00 0.00 H new ATOM 0 HG3 PRO A 30 14.591 -1.000 12.149 1.00 0.00 H new ATOM 0 HD2 PRO A 30 13.605 1.806 12.116 1.00 0.00 H new ATOM 0 HD3 PRO A 30 14.912 1.080 11.203 1.00 0.00 H new ATOM 419 N HIS A 31 9.368 -0.912 10.642 1.00 0.00 N ATOM 420 CA HIS A 31 7.889 -0.866 10.951 1.00 0.00 C ATOM 421 C HIS A 31 7.540 -1.682 12.301 1.00 0.00 C ATOM 422 O HIS A 31 7.023 -1.059 13.241 1.00 0.00 O ATOM 423 CB HIS A 31 6.983 -1.284 9.620 1.00 0.00 C ATOM 424 CG HIS A 31 5.429 -1.635 9.789 1.00 0.00 C ATOM 425 ND1 HIS A 31 4.513 -0.876 10.513 1.00 0.00 N ATOM 426 CD2 HIS A 31 4.738 -2.702 9.382 1.00 0.00 C ATOM 427 CE1 HIS A 31 3.335 -1.484 10.528 1.00 0.00 C ATOM 428 NE2 HIS A 31 3.448 -2.591 9.848 1.00 0.00 N ATOM 0 H HIS A 31 9.640 -1.803 10.226 1.00 0.00 H new ATOM 0 HA HIS A 31 7.604 0.163 11.172 1.00 0.00 H new ATOM 0 HB2 HIS A 31 7.054 -0.462 8.908 1.00 0.00 H new ATOM 0 HB3 HIS A 31 7.463 -2.148 9.159 1.00 0.00 H new ATOM 0 HD1 HIS A 31 4.718 0.015 10.965 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.126 -3.516 8.787 1.00 0.00 H new ATOM 0 HE1 HIS A 31 2.441 -1.126 11.017 1.00 0.00 H new ATOM 437 N ILE A 32 7.927 -3.046 12.350 1.00 0.00 N ATOM 438 CA ILE A 32 7.517 -4.068 13.382 1.00 0.00 C ATOM 439 C ILE A 32 8.646 -4.365 14.552 1.00 0.00 C ATOM 440 O ILE A 32 8.271 -4.791 15.687 1.00 0.00 O ATOM 441 CB ILE A 32 6.915 -5.436 12.548 1.00 0.00 C ATOM 442 CG1 ILE A 32 5.866 -6.279 13.326 1.00 0.00 C ATOM 443 CG2 ILE A 32 7.956 -6.395 11.832 1.00 0.00 C ATOM 444 CD1 ILE A 32 4.404 -5.763 13.259 1.00 0.00 C ATOM 0 H ILE A 32 8.546 -3.445 11.645 1.00 0.00 H new ATOM 0 HA ILE A 32 6.714 -3.666 13.999 1.00 0.00 H new ATOM 0 HB ILE A 32 6.411 -4.910 11.737 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.890 -7.299 12.942 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.168 -6.325 14.372 1.00 0.00 H new ATOM 0 HG21 ILE A 32 7.423 -7.214 11.348 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.514 -5.832 11.083 1.00 0.00 H new ATOM 0 HG23 ILE A 32 8.647 -6.799 12.572 1.00 0.00 H new ATOM 0 HD11 ILE A 32 3.758 -6.425 13.835 1.00 0.00 H new ATOM 0 HD12 ILE A 32 4.354 -4.756 13.673 1.00 0.00 H new ATOM 0 HD13 ILE A 32 4.072 -5.745 12.221 1.00 0.00 H new ATOM 456 N GLY A 33 9.957 -4.084 14.185 1.00 0.00 N ATOM 457 CA GLY A 33 11.188 -4.357 14.996 1.00 0.00 C ATOM 458 C GLY A 33 12.495 -4.048 14.246 1.00 0.00 C ATOM 459 O GLY A 33 13.237 -3.135 14.671 1.00 0.00 O ATOM 0 H GLY A 33 10.177 -3.649 13.289 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.152 -3.762 15.909 1.00 0.00 H new ATOM 0 HA3 GLY A 33 11.190 -5.404 15.298 1.00 0.00 H new ATOM 463 N ASP A 34 12.787 -4.872 13.100 1.00 0.00 N ATOM 464 CA ASP A 34 14.047 -4.805 12.152 1.00 0.00 C ATOM 465 C ASP A 34 13.795 -5.348 10.606 1.00 0.00 C ATOM 466 O ASP A 34 14.770 -5.378 9.775 1.00 0.00 O ATOM 467 CB ASP A 34 15.398 -5.475 12.859 1.00 0.00 C ATOM 468 CG ASP A 34 15.331 -6.985 13.307 1.00 0.00 C ATOM 469 OD1 ASP A 34 15.674 -7.866 12.486 1.00 0.00 O ATOM 470 OD2 ASP A 34 14.945 -7.247 14.468 1.00 0.00 O ATOM 0 H ASP A 34 12.143 -5.608 12.811 1.00 0.00 H new ATOM 0 HA ASP A 34 14.239 -3.740 12.024 1.00 0.00 H new ATOM 0 HB2 ASP A 34 16.227 -5.372 12.159 1.00 0.00 H new ATOM 0 HB3 ASP A 34 15.646 -4.878 13.736 1.00 0.00 H new ATOM 475 N ASP A 35 12.445 -5.649 10.221 1.00 0.00 N ATOM 476 CA ASP A 35 11.998 -6.397 8.937 1.00 0.00 C ATOM 477 C ASP A 35 11.852 -5.512 7.547 1.00 0.00 C ATOM 478 O ASP A 35 11.432 -4.322 7.642 1.00 0.00 O ATOM 479 CB ASP A 35 10.697 -7.247 9.209 1.00 0.00 C ATOM 480 CG ASP A 35 10.908 -8.582 9.980 1.00 0.00 C ATOM 481 OD1 ASP A 35 10.849 -8.567 11.236 1.00 0.00 O ATOM 482 OD2 ASP A 35 11.110 -9.630 9.319 1.00 0.00 O ATOM 0 H ASP A 35 11.652 -5.374 10.801 1.00 0.00 H new ATOM 0 HA ASP A 35 12.846 -7.046 8.720 1.00 0.00 H new ATOM 0 HB2 ASP A 35 9.995 -6.632 9.772 1.00 0.00 H new ATOM 0 HB3 ASP A 35 10.227 -7.473 8.252 1.00 0.00 H new ATOM 487 N PRO A 36 12.238 -6.126 6.159 1.00 0.00 N ATOM 488 CA PRO A 36 12.139 -5.368 4.791 1.00 0.00 C ATOM 489 C PRO A 36 10.661 -5.081 4.121 1.00 0.00 C ATOM 490 O PRO A 36 10.559 -4.190 3.223 1.00 0.00 O ATOM 491 CB PRO A 36 13.040 -6.248 3.826 1.00 0.00 C ATOM 492 CG PRO A 36 13.791 -7.211 4.707 1.00 0.00 C ATOM 493 CD PRO A 36 12.872 -7.515 5.856 1.00 0.00 C ATOM 0 HA PRO A 36 12.456 -4.339 4.960 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.426 -6.783 3.101 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.729 -5.622 3.259 1.00 0.00 H new ATOM 0 HG2 PRO A 36 14.050 -8.119 4.162 1.00 0.00 H new ATOM 0 HG3 PRO A 36 14.725 -6.773 5.058 1.00 0.00 H new ATOM 0 HD2 PRO A 36 12.118 -8.255 5.587 1.00 0.00 H new ATOM 0 HD3 PRO A 36 13.414 -7.910 6.715 1.00 0.00 H new ATOM 501 N SER A 37 9.537 -5.819 4.632 1.00 0.00 N ATOM 502 CA SER A 37 8.073 -5.803 4.074 1.00 0.00 C ATOM 503 C SER A 37 7.183 -4.503 4.437 1.00 0.00 C ATOM 504 O SER A 37 7.239 -4.001 5.603 1.00 0.00 O ATOM 505 CB SER A 37 7.323 -7.174 4.408 1.00 0.00 C ATOM 506 OG SER A 37 7.268 -7.472 5.818 1.00 0.00 O ATOM 0 H SER A 37 9.631 -6.436 5.439 1.00 0.00 H new ATOM 0 HA SER A 37 8.190 -5.715 2.994 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.307 -7.128 4.015 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.828 -7.990 3.892 1.00 0.00 H new ATOM 0 HG SER A 37 6.796 -8.320 5.955 1.00 0.00 H new ATOM 512 N ILE A 38 6.373 -3.980 3.360 1.00 0.00 N ATOM 513 CA ILE A 38 5.442 -2.741 3.437 1.00 0.00 C ATOM 514 C ILE A 38 3.888 -3.222 3.650 1.00 0.00 C ATOM 515 O ILE A 38 3.373 -4.092 2.886 1.00 0.00 O ATOM 516 CB ILE A 38 5.607 -1.635 2.102 1.00 0.00 C ATOM 517 CG1 ILE A 38 7.080 -1.465 1.296 1.00 0.00 C ATOM 518 CG2 ILE A 38 5.006 -0.191 2.352 1.00 0.00 C ATOM 519 CD1 ILE A 38 8.485 -1.582 2.006 1.00 0.00 C ATOM 0 H ILE A 38 6.363 -4.415 2.437 1.00 0.00 H new ATOM 0 HA ILE A 38 5.761 -2.164 4.305 1.00 0.00 H new ATOM 0 HB ILE A 38 4.993 -2.216 1.414 1.00 0.00 H new ATOM 0 HG12 ILE A 38 7.079 -2.206 0.497 1.00 0.00 H new ATOM 0 HG13 ILE A 38 7.058 -0.484 0.822 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.157 0.424 1.465 1.00 0.00 H new ATOM 0 HG22 ILE A 38 3.939 -0.272 2.560 1.00 0.00 H new ATOM 0 HG23 ILE A 38 5.508 0.270 3.203 1.00 0.00 H new ATOM 0 HD11 ILE A 38 9.277 -1.434 1.272 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.564 -0.822 2.784 1.00 0.00 H new ATOM 0 HD13 ILE A 38 8.585 -2.571 2.453 1.00 0.00 H new ATOM 531 N PHE A 39 3.209 -2.583 4.724 1.00 0.00 N ATOM 532 CA PHE A 39 1.762 -2.824 5.222 1.00 0.00 C ATOM 533 C PHE A 39 0.972 -1.432 5.438 1.00 0.00 C ATOM 534 O PHE A 39 1.629 -0.316 5.627 1.00 0.00 O ATOM 535 CB PHE A 39 1.718 -3.652 6.659 1.00 0.00 C ATOM 536 CG PHE A 39 2.216 -5.156 6.787 1.00 0.00 C ATOM 537 CD1 PHE A 39 1.434 -6.249 6.367 1.00 0.00 C ATOM 538 CD2 PHE A 39 3.426 -5.446 7.416 1.00 0.00 C ATOM 539 CE1 PHE A 39 1.863 -7.559 6.566 1.00 0.00 C ATOM 540 CE2 PHE A 39 3.857 -6.748 7.612 1.00 0.00 C ATOM 541 CZ PHE A 39 3.074 -7.804 7.188 1.00 0.00 C ATOM 0 H PHE A 39 3.676 -1.865 5.278 1.00 0.00 H new ATOM 0 HA PHE A 39 1.282 -3.418 4.444 1.00 0.00 H new ATOM 0 HB2 PHE A 39 2.297 -3.068 7.374 1.00 0.00 H new ATOM 0 HB3 PHE A 39 0.682 -3.635 6.998 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.486 -6.069 5.883 1.00 0.00 H new ATOM 0 HD2 PHE A 39 4.046 -4.631 7.761 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.250 -8.384 6.235 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.804 -6.937 8.096 1.00 0.00 H new ATOM 0 HZ PHE A 39 3.407 -8.820 7.342 1.00 0.00 H new ATOM 551 N ILE A 40 -0.488 -1.508 5.388 1.00 0.00 N ATOM 552 CA ILE A 40 -1.472 -0.377 5.792 1.00 0.00 C ATOM 553 C ILE A 40 -1.717 -0.420 7.392 1.00 0.00 C ATOM 554 O ILE A 40 -1.782 -1.525 8.024 1.00 0.00 O ATOM 555 CB ILE A 40 -2.980 -0.414 4.998 1.00 0.00 C ATOM 556 CG1 ILE A 40 -3.052 -1.067 3.487 1.00 0.00 C ATOM 557 CG2 ILE A 40 -3.783 0.983 5.042 1.00 0.00 C ATOM 558 CD1 ILE A 40 -2.221 -0.442 2.337 1.00 0.00 C ATOM 0 H ILE A 40 -0.971 -2.348 5.070 1.00 0.00 H new ATOM 0 HA ILE A 40 -0.992 0.550 5.479 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.489 -1.144 5.627 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.757 -2.113 3.570 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.097 -1.055 3.177 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -4.731 0.875 4.515 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -3.974 1.260 6.079 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -3.188 1.760 4.562 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.393 -1.002 1.418 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.523 0.595 2.192 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.162 -0.479 2.592 1.00 0.00 H new ATOM 570 N THR A 41 -1.874 0.840 7.957 1.00 0.00 N ATOM 571 CA THR A 41 -2.078 1.190 9.461 1.00 0.00 C ATOM 572 C THR A 41 -3.013 2.442 9.689 1.00 0.00 C ATOM 573 O THR A 41 -3.720 2.488 10.752 1.00 0.00 O ATOM 574 CB THR A 41 -0.722 1.293 10.374 1.00 0.00 C ATOM 575 OG1 THR A 41 0.352 1.911 9.672 1.00 0.00 O ATOM 576 CG2 THR A 41 -0.264 -0.064 10.940 1.00 0.00 C ATOM 0 H THR A 41 -1.864 1.678 7.376 1.00 0.00 H new ATOM 0 HA THR A 41 -2.593 0.304 9.832 1.00 0.00 H new ATOM 0 HB THR A 41 -0.999 1.924 11.219 1.00 0.00 H new ATOM 0 HG1 THR A 41 1.180 1.812 10.187 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.639 0.076 11.535 1.00 0.00 H new ATOM 0 HG22 THR A 41 -1.051 -0.481 11.568 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.055 -0.749 10.118 1.00 0.00 H new ATOM 584 N LYS A 42 -3.051 3.461 8.640 1.00 0.00 N ATOM 585 CA LYS A 42 -3.915 4.684 8.674 1.00 0.00 C ATOM 586 C LYS A 42 -4.899 4.783 7.440 1.00 0.00 C ATOM 587 O LYS A 42 -4.477 4.655 6.251 1.00 0.00 O ATOM 588 CB LYS A 42 -2.998 6.037 8.987 1.00 0.00 C ATOM 589 CG LYS A 42 -3.583 7.562 9.007 1.00 0.00 C ATOM 590 CD LYS A 42 -4.788 7.816 9.928 1.00 0.00 C ATOM 591 CE LYS A 42 -5.048 9.292 10.089 1.00 0.00 C ATOM 592 NZ LYS A 42 -6.217 9.567 10.971 1.00 0.00 N ATOM 0 H LYS A 42 -2.477 3.401 7.799 1.00 0.00 H new ATOM 0 HA LYS A 42 -4.605 4.603 9.514 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -2.543 5.875 9.964 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -2.191 6.032 8.254 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.778 8.234 9.304 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.866 7.834 7.990 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.673 7.331 9.516 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -4.604 7.368 10.904 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.162 9.772 10.504 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -5.222 9.737 9.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -6.357 10.594 11.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -7.069 9.133 10.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -6.042 9.166 11.915 1.00 0.00 H new ATOM 606 N ILE A 43 -6.244 4.973 7.827 1.00 0.00 N ATOM 607 CA ILE A 43 -7.417 5.277 6.937 1.00 0.00 C ATOM 608 C ILE A 43 -8.149 6.594 7.505 1.00 0.00 C ATOM 609 O ILE A 43 -8.542 6.651 8.715 1.00 0.00 O ATOM 610 CB ILE A 43 -8.481 3.914 6.691 1.00 0.00 C ATOM 611 CG1 ILE A 43 -7.784 2.578 5.998 1.00 0.00 C ATOM 612 CG2 ILE A 43 -9.919 4.198 6.032 1.00 0.00 C ATOM 613 CD1 ILE A 43 -7.023 2.696 4.594 1.00 0.00 C ATOM 0 H ILE A 43 -6.522 4.911 8.807 1.00 0.00 H new ATOM 0 HA ILE A 43 -7.061 5.484 5.928 1.00 0.00 H new ATOM 0 HB ILE A 43 -8.686 3.683 7.736 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -7.071 2.177 6.718 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -8.569 1.831 5.877 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -10.469 3.261 5.941 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -10.479 4.887 6.664 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.786 4.638 5.044 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -6.636 1.718 4.306 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -7.718 3.050 3.832 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -6.196 3.400 4.686 1.00 0.00 H new ATOM 625 N ILE A 44 -8.302 7.620 6.559 1.00 0.00 N ATOM 626 CA ILE A 44 -9.094 8.934 6.726 1.00 0.00 C ATOM 627 C ILE A 44 -10.732 8.670 6.456 1.00 0.00 C ATOM 628 O ILE A 44 -11.061 8.097 5.383 1.00 0.00 O ATOM 629 CB ILE A 44 -8.379 10.225 5.802 1.00 0.00 C ATOM 630 CG1 ILE A 44 -6.931 10.713 6.308 1.00 0.00 C ATOM 631 CG2 ILE A 44 -9.236 11.532 5.608 1.00 0.00 C ATOM 632 CD1 ILE A 44 -5.733 9.794 6.083 1.00 0.00 C ATOM 0 H ILE A 44 -7.868 7.555 5.638 1.00 0.00 H new ATOM 0 HA ILE A 44 -9.029 9.279 7.758 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.306 9.706 4.846 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -6.714 11.665 5.824 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.002 10.909 7.378 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.672 12.252 5.015 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -10.164 11.285 5.093 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -9.466 11.964 6.582 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -4.833 10.265 6.479 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -5.901 8.846 6.594 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -5.608 9.614 5.015 1.00 0.00 H new ATOM 644 N PRO A 45 -11.787 9.118 7.486 1.00 0.00 N ATOM 645 CA PRO A 45 -13.335 8.910 7.317 1.00 0.00 C ATOM 646 C PRO A 45 -14.073 9.661 6.061 1.00 0.00 C ATOM 647 O PRO A 45 -15.171 9.185 5.616 1.00 0.00 O ATOM 648 CB PRO A 45 -13.916 9.383 8.708 1.00 0.00 C ATOM 649 CG PRO A 45 -12.754 9.358 9.665 1.00 0.00 C ATOM 650 CD PRO A 45 -11.552 9.787 8.863 1.00 0.00 C ATOM 0 HA PRO A 45 -13.531 7.869 7.058 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.341 10.384 8.635 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -14.714 8.721 9.044 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -12.924 10.032 10.505 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -12.611 8.361 10.081 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -11.491 10.872 8.778 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -10.622 9.450 9.321 1.00 0.00 H new ATOM 658 N GLY A 46 -13.396 10.794 5.516 1.00 0.00 N ATOM 659 CA GLY A 46 -13.881 11.604 4.346 1.00 0.00 C ATOM 660 C GLY A 46 -12.853 11.834 3.192 1.00 0.00 C ATOM 661 O GLY A 46 -12.856 12.955 2.612 1.00 0.00 O ATOM 0 H GLY A 46 -12.514 11.137 5.897 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -14.759 11.111 3.929 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -14.206 12.577 4.714 1.00 0.00 H new ATOM 665 N GLY A 47 -11.951 10.749 2.870 1.00 0.00 N ATOM 666 CA GLY A 47 -10.982 10.738 1.692 1.00 0.00 C ATOM 667 C GLY A 47 -11.519 10.082 0.360 1.00 0.00 C ATOM 668 O GLY A 47 -12.696 9.619 0.289 1.00 0.00 O ATOM 0 H GLY A 47 -11.905 9.896 3.428 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.692 11.766 1.476 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.078 10.209 1.995 1.00 0.00 H new ATOM 672 N ALA A 48 -10.583 10.066 -0.699 1.00 0.00 N ATOM 673 CA ALA A 48 -10.773 9.564 -2.137 1.00 0.00 C ATOM 674 C ALA A 48 -10.640 7.964 -2.343 1.00 0.00 C ATOM 675 O ALA A 48 -11.400 7.403 -3.153 1.00 0.00 O ATOM 676 CB ALA A 48 -9.851 10.393 -3.112 1.00 0.00 C ATOM 0 H ALA A 48 -9.637 10.421 -0.556 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.818 9.744 -2.390 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -9.987 10.036 -4.133 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -10.120 11.448 -3.058 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -8.808 10.269 -2.820 1.00 0.00 H new ATOM 682 N ALA A 49 -9.640 7.259 -1.567 1.00 0.00 N ATOM 683 CA ALA A 49 -9.384 5.718 -1.549 1.00 0.00 C ATOM 684 C ALA A 49 -10.362 4.839 -0.600 1.00 0.00 C ATOM 685 O ALA A 49 -10.502 3.567 -0.812 1.00 0.00 O ATOM 686 CB ALA A 49 -7.896 5.430 -1.273 1.00 0.00 C ATOM 0 H ALA A 49 -9.003 7.758 -0.947 1.00 0.00 H new ATOM 0 HA ALA A 49 -9.648 5.376 -2.550 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -7.730 4.353 -1.263 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -7.287 5.884 -2.054 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -7.617 5.849 -0.306 1.00 0.00 H new ATOM 692 N ALA A 50 -11.053 5.567 0.436 1.00 0.00 N ATOM 693 CA ALA A 50 -12.063 5.016 1.446 1.00 0.00 C ATOM 694 C ALA A 50 -13.583 5.046 0.917 1.00 0.00 C ATOM 695 O ALA A 50 -14.321 4.040 1.121 1.00 0.00 O ATOM 696 CB ALA A 50 -11.904 5.749 2.827 1.00 0.00 C ATOM 0 H ALA A 50 -10.898 6.567 0.567 1.00 0.00 H new ATOM 0 HA ALA A 50 -11.834 3.959 1.583 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.628 5.348 3.537 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -10.895 5.591 3.209 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.079 6.817 2.694 1.00 0.00 H new ATOM 702 N GLN A 51 -14.011 6.237 0.206 1.00 0.00 N ATOM 703 CA GLN A 51 -15.387 6.483 -0.438 1.00 0.00 C ATOM 704 C GLN A 51 -15.485 6.019 -1.973 1.00 0.00 C ATOM 705 O GLN A 51 -16.389 5.198 -2.293 1.00 0.00 O ATOM 706 CB GLN A 51 -15.914 7.998 -0.248 1.00 0.00 C ATOM 707 CG GLN A 51 -16.093 8.502 1.232 1.00 0.00 C ATOM 708 CD GLN A 51 -16.896 9.824 1.394 1.00 0.00 C ATOM 709 OE1 GLN A 51 -18.131 9.810 1.526 1.00 0.00 O ATOM 710 NE2 GLN A 51 -16.190 10.971 1.433 1.00 0.00 N ATOM 0 H GLN A 51 -13.385 7.033 0.083 1.00 0.00 H new ATOM 0 HA GLN A 51 -16.061 5.832 0.120 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -15.217 8.667 -0.754 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -16.873 8.092 -0.758 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -16.592 7.721 1.806 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -15.106 8.640 1.673 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -15.176 10.950 1.321 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -16.669 11.860 1.574 1.00 0.00 H new ATOM 719 N ASP A 52 -14.514 6.563 -2.913 1.00 0.00 N ATOM 720 CA ASP A 52 -14.454 6.285 -4.426 1.00 0.00 C ATOM 721 C ASP A 52 -13.531 5.039 -4.902 1.00 0.00 C ATOM 722 O ASP A 52 -13.826 4.433 -5.984 1.00 0.00 O ATOM 723 CB ASP A 52 -14.089 7.617 -5.216 1.00 0.00 C ATOM 724 CG ASP A 52 -15.247 8.637 -5.402 1.00 0.00 C ATOM 725 OD1 ASP A 52 -15.412 9.523 -4.527 1.00 0.00 O ATOM 726 OD2 ASP A 52 -15.965 8.549 -6.428 1.00 0.00 O ATOM 0 H ASP A 52 -13.774 7.196 -2.609 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.461 5.954 -4.682 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.273 8.115 -4.692 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.713 7.340 -6.201 1.00 0.00 H new ATOM 731 N GLY A 53 -12.461 4.638 -4.027 1.00 0.00 N ATOM 732 CA GLY A 53 -11.393 3.575 -4.339 1.00 0.00 C ATOM 733 C GLY A 53 -11.710 2.094 -3.951 1.00 0.00 C ATOM 734 O GLY A 53 -11.425 1.191 -4.760 1.00 0.00 O ATOM 0 H GLY A 53 -12.339 5.053 -3.103 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.191 3.606 -5.410 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.472 3.865 -3.833 1.00 0.00 H new ATOM 738 N ARG A 54 -12.318 1.861 -2.659 1.00 0.00 N ATOM 739 CA ARG A 54 -12.771 0.494 -1.956 1.00 0.00 C ATOM 740 C ARG A 54 -11.658 -0.243 -1.040 1.00 0.00 C ATOM 741 O ARG A 54 -11.892 -1.392 -0.500 1.00 0.00 O ATOM 742 CB ARG A 54 -13.648 -0.527 -2.872 1.00 0.00 C ATOM 743 CG ARG A 54 -15.115 -0.112 -3.103 1.00 0.00 C ATOM 744 CD ARG A 54 -15.890 -1.165 -3.894 1.00 0.00 C ATOM 745 NE ARG A 54 -17.353 -0.785 -4.071 1.00 0.00 N ATOM 746 CZ ARG A 54 -18.455 -1.573 -4.504 1.00 0.00 C ATOM 747 NH1 ARG A 54 -18.370 -2.899 -4.848 1.00 0.00 N ATOM 748 NH2 ARG A 54 -19.646 -0.992 -4.574 1.00 0.00 N ATOM 0 H ARG A 54 -12.516 2.654 -2.049 1.00 0.00 H new ATOM 0 HA ARG A 54 -13.490 0.876 -1.231 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -13.160 -0.630 -3.841 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -13.636 -1.511 -2.403 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -15.602 0.050 -2.141 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -15.143 0.837 -3.638 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -15.429 -1.295 -4.873 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -15.824 -2.124 -3.381 1.00 0.00 H new ATOM 0 HE ARG A 54 -17.578 0.184 -3.844 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -17.473 -3.381 -4.801 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -19.204 -3.402 -5.150 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -19.750 -0.009 -4.321 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -20.458 -1.528 -4.881 1.00 0.00 H new ATOM 762 N LEU A 55 -10.476 0.523 -0.758 1.00 0.00 N ATOM 763 CA LEU A 55 -9.292 0.089 0.078 1.00 0.00 C ATOM 764 C LEU A 55 -9.478 0.352 1.667 1.00 0.00 C ATOM 765 O LEU A 55 -9.790 1.493 2.123 1.00 0.00 O ATOM 766 CB LEU A 55 -7.929 0.705 -0.591 1.00 0.00 C ATOM 767 CG LEU A 55 -6.530 0.681 0.158 1.00 0.00 C ATOM 768 CD1 LEU A 55 -5.455 0.001 -0.662 1.00 0.00 C ATOM 769 CD2 LEU A 55 -6.140 2.109 0.472 1.00 0.00 C ATOM 0 H LEU A 55 -10.356 1.466 -1.128 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.206 -0.997 0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.785 0.187 -1.539 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.140 1.748 -0.826 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.628 0.101 1.076 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.516 0.009 -0.109 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.749 -1.029 -0.864 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.325 0.533 -1.605 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.180 2.119 0.988 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.060 2.676 -0.455 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.899 2.562 1.110 1.00 0.00 H new ATOM 781 N ARG A 56 -9.290 -0.810 2.420 1.00 0.00 N ATOM 782 CA ARG A 56 -9.248 -0.966 3.944 1.00 0.00 C ATOM 783 C ARG A 56 -7.767 -1.358 4.449 1.00 0.00 C ATOM 784 O ARG A 56 -6.925 -1.890 3.652 1.00 0.00 O ATOM 785 CB ARG A 56 -10.343 -2.051 4.449 1.00 0.00 C ATOM 786 CG ARG A 56 -11.802 -1.623 4.465 1.00 0.00 C ATOM 787 CD ARG A 56 -12.610 -2.792 4.937 1.00 0.00 C ATOM 788 NE ARG A 56 -14.098 -2.494 5.050 1.00 0.00 N ATOM 789 CZ ARG A 56 -15.156 -3.311 5.539 1.00 0.00 C ATOM 790 NH1 ARG A 56 -14.988 -4.584 6.025 1.00 0.00 N ATOM 791 NH2 ARG A 56 -16.384 -2.810 5.528 1.00 0.00 N ATOM 0 H ARG A 56 -9.157 -1.708 1.956 1.00 0.00 H new ATOM 0 HA ARG A 56 -9.505 -0.002 4.384 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.259 -2.934 3.815 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.072 -2.357 5.459 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -11.943 -0.768 5.126 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -12.121 -1.313 3.470 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.465 -3.625 4.249 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -12.237 -3.113 5.909 1.00 0.00 H new ATOM 0 HE ARG A 56 -14.380 -1.569 4.726 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -14.058 -5.001 6.051 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -15.794 -5.113 6.360 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -16.547 -1.866 5.176 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -17.166 -3.368 5.871 1.00 0.00 H new ATOM 805 N VAL A 57 -7.483 -1.134 5.834 1.00 0.00 N ATOM 806 CA VAL A 57 -6.127 -1.502 6.653 1.00 0.00 C ATOM 807 C VAL A 57 -5.596 -3.010 6.515 1.00 0.00 C ATOM 808 O VAL A 57 -4.354 -3.282 6.548 1.00 0.00 O ATOM 809 CB VAL A 57 -6.096 -1.050 8.243 1.00 0.00 C ATOM 810 CG1 VAL A 57 -5.863 0.420 8.404 1.00 0.00 C ATOM 811 CG2 VAL A 57 -7.357 -1.455 9.056 1.00 0.00 C ATOM 0 H VAL A 57 -8.174 -0.692 6.441 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.426 -0.865 6.114 1.00 0.00 H new ATOM 0 HB VAL A 57 -5.256 -1.608 8.655 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -5.850 0.672 9.464 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -4.906 0.688 7.956 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -6.663 0.971 7.909 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.249 -1.118 10.087 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -8.239 -0.992 8.614 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -7.469 -2.539 9.038 1.00 0.00 H new ATOM 821 N ASN A 58 -6.634 -3.917 6.318 1.00 0.00 N ATOM 822 CA ASN A 58 -6.564 -5.376 6.189 1.00 0.00 C ATOM 823 C ASN A 58 -6.373 -5.895 4.632 1.00 0.00 C ATOM 824 O ASN A 58 -6.386 -7.146 4.381 1.00 0.00 O ATOM 825 CB ASN A 58 -7.798 -6.033 7.061 1.00 0.00 C ATOM 826 CG ASN A 58 -9.291 -5.837 6.554 1.00 0.00 C ATOM 827 OD1 ASN A 58 -9.954 -4.856 6.902 1.00 0.00 O ATOM 828 ND2 ASN A 58 -9.789 -6.791 5.763 1.00 0.00 N ATOM 0 H ASN A 58 -7.597 -3.589 6.245 1.00 0.00 H new ATOM 0 HA ASN A 58 -5.643 -5.758 6.629 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -7.614 -7.105 7.135 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -7.738 -5.629 8.071 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -10.749 -6.723 5.425 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -9.209 -7.587 5.497 1.00 0.00 H new ATOM 835 N ASP A 59 -6.118 -4.853 3.598 1.00 0.00 N ATOM 836 CA ASP A 59 -5.874 -5.165 2.109 1.00 0.00 C ATOM 837 C ASP A 59 -4.350 -5.389 1.708 1.00 0.00 C ATOM 838 O ASP A 59 -4.062 -6.281 0.855 1.00 0.00 O ATOM 839 CB ASP A 59 -6.608 -4.148 1.134 1.00 0.00 C ATOM 840 CG ASP A 59 -8.125 -4.409 0.926 1.00 0.00 C ATOM 841 OD1 ASP A 59 -8.941 -3.893 1.725 1.00 0.00 O ATOM 842 OD2 ASP A 59 -8.482 -5.122 -0.044 1.00 0.00 O ATOM 0 H ASP A 59 -6.089 -3.856 3.813 1.00 0.00 H new ATOM 0 HA ASP A 59 -6.342 -6.139 1.969 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -6.480 -3.138 1.524 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -6.114 -4.180 0.163 1.00 0.00 H new ATOM 847 N SER A 60 -3.335 -4.544 2.372 1.00 0.00 N ATOM 848 CA SER A 60 -1.754 -4.567 2.233 1.00 0.00 C ATOM 849 C SER A 60 -1.178 -4.630 0.733 1.00 0.00 C ATOM 850 O SER A 60 -1.445 -5.621 -0.008 1.00 0.00 O ATOM 851 CB SER A 60 -1.080 -5.644 3.233 1.00 0.00 C ATOM 852 OG SER A 60 0.355 -5.585 3.263 1.00 0.00 O ATOM 0 H SER A 60 -3.628 -3.820 3.028 1.00 0.00 H new ATOM 0 HA SER A 60 -1.437 -3.576 2.558 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.463 -5.480 4.240 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.387 -6.646 2.934 1.00 0.00 H new ATOM 0 HG SER A 60 0.679 -5.930 4.121 1.00 0.00 H new ATOM 858 N ILE A 61 -0.334 -3.564 0.350 1.00 0.00 N ATOM 859 CA ILE A 61 0.308 -3.402 -1.060 1.00 0.00 C ATOM 860 C ILE A 61 1.701 -4.218 -1.119 1.00 0.00 C ATOM 861 O ILE A 61 2.608 -4.021 -0.245 1.00 0.00 O ATOM 862 CB ILE A 61 0.498 -1.779 -1.599 1.00 0.00 C ATOM 863 CG1 ILE A 61 -0.845 -0.881 -1.335 1.00 0.00 C ATOM 864 CG2 ILE A 61 0.850 -1.733 -3.198 1.00 0.00 C ATOM 865 CD1 ILE A 61 -0.686 0.684 -1.227 1.00 0.00 C ATOM 0 H ILE A 61 -0.083 -2.810 0.990 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.405 -3.827 -1.766 1.00 0.00 H new ATOM 0 HB ILE A 61 1.321 -1.357 -1.022 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.548 -1.089 -2.141 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.305 -1.233 -0.412 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.965 -0.697 -3.515 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.778 -2.274 -3.382 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.041 -2.197 -3.762 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.662 1.138 -1.052 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.019 0.926 -0.399 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.267 1.072 -2.155 1.00 0.00 H new ATOM 877 N LEU A 62 1.777 -5.153 -2.190 1.00 0.00 N ATOM 878 CA LEU A 62 3.037 -5.889 -2.624 1.00 0.00 C ATOM 879 C LEU A 62 3.794 -5.138 -3.777 1.00 0.00 C ATOM 880 O LEU A 62 5.049 -4.982 -3.694 1.00 0.00 O ATOM 881 CB LEU A 62 2.803 -7.493 -2.933 1.00 0.00 C ATOM 882 CG LEU A 62 1.783 -8.020 -4.038 1.00 0.00 C ATOM 883 CD1 LEU A 62 2.197 -9.387 -4.464 1.00 0.00 C ATOM 884 CD2 LEU A 62 0.362 -8.116 -3.516 1.00 0.00 C ATOM 0 H LEU A 62 0.964 -5.398 -2.755 1.00 0.00 H new ATOM 0 HA LEU A 62 3.700 -5.875 -1.759 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.779 -7.905 -3.190 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.502 -7.950 -1.990 1.00 0.00 H new ATOM 0 HG LEU A 62 1.804 -7.307 -4.863 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.505 -9.757 -5.221 1.00 0.00 H new ATOM 0 HD12 LEU A 62 3.204 -9.349 -4.880 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.185 -10.056 -3.603 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.293 -8.480 -4.308 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.330 -8.806 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.026 -7.131 -3.192 1.00 0.00 H new ATOM 896 N PHE A 63 2.964 -4.651 -4.858 1.00 0.00 N ATOM 897 CA PHE A 63 3.502 -3.960 -6.123 1.00 0.00 C ATOM 898 C PHE A 63 2.778 -2.636 -6.454 1.00 0.00 C ATOM 899 O PHE A 63 1.530 -2.591 -6.449 1.00 0.00 O ATOM 900 CB PHE A 63 3.511 -4.984 -7.406 1.00 0.00 C ATOM 901 CG PHE A 63 4.598 -6.128 -7.385 1.00 0.00 C ATOM 902 CD1 PHE A 63 4.428 -7.290 -6.621 1.00 0.00 C ATOM 903 CD2 PHE A 63 5.753 -6.004 -8.119 1.00 0.00 C ATOM 904 CE1 PHE A 63 5.371 -8.285 -6.596 1.00 0.00 C ATOM 905 CE2 PHE A 63 6.711 -6.978 -8.123 1.00 0.00 C ATOM 906 CZ PHE A 63 6.530 -8.141 -7.362 1.00 0.00 C ATOM 0 H PHE A 63 1.948 -4.736 -4.850 1.00 0.00 H new ATOM 0 HA PHE A 63 4.534 -3.686 -5.903 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.528 -5.449 -7.479 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.653 -4.395 -8.312 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.528 -7.405 -6.035 1.00 0.00 H new ATOM 0 HD2 PHE A 63 5.908 -5.112 -8.709 1.00 0.00 H new ATOM 0 HE1 PHE A 63 5.220 -9.168 -5.992 1.00 0.00 H new ATOM 0 HE2 PHE A 63 7.607 -6.852 -8.712 1.00 0.00 H new ATOM 0 HZ PHE A 63 7.280 -8.918 -7.368 1.00 0.00 H new ATOM 916 N VAL A 64 3.596 -1.513 -6.706 1.00 0.00 N ATOM 917 CA VAL A 64 3.009 -0.117 -7.130 1.00 0.00 C ATOM 918 C VAL A 64 3.590 0.303 -8.508 1.00 0.00 C ATOM 919 O VAL A 64 4.758 0.235 -8.705 1.00 0.00 O ATOM 920 CB VAL A 64 3.044 1.172 -6.062 1.00 0.00 C ATOM 921 CG1 VAL A 64 1.706 1.935 -6.062 1.00 0.00 C ATOM 922 CG2 VAL A 64 3.482 0.911 -4.593 1.00 0.00 C ATOM 0 H VAL A 64 4.613 -1.530 -6.631 1.00 0.00 H new ATOM 0 HA VAL A 64 1.940 -0.329 -7.158 1.00 0.00 H new ATOM 0 HB VAL A 64 3.860 1.766 -6.474 1.00 0.00 H new ATOM 0 HG11 VAL A 64 1.761 2.766 -5.359 1.00 0.00 H new ATOM 0 HG12 VAL A 64 1.506 2.319 -7.062 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.903 1.261 -5.765 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.451 1.845 -4.033 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.805 0.190 -4.134 1.00 0.00 H new ATOM 0 HG23 VAL A 64 4.497 0.514 -4.581 1.00 0.00 H new ATOM 932 N ASN A 65 2.655 0.775 -9.483 1.00 0.00 N ATOM 933 CA ASN A 65 2.890 1.210 -11.017 1.00 0.00 C ATOM 934 C ASN A 65 3.182 -0.098 -12.005 1.00 0.00 C ATOM 935 O ASN A 65 3.318 0.058 -13.257 1.00 0.00 O ATOM 936 CB ASN A 65 4.115 2.362 -11.184 1.00 0.00 C ATOM 937 CG ASN A 65 4.057 3.277 -12.450 1.00 0.00 C ATOM 938 OD1 ASN A 65 4.616 2.942 -13.498 1.00 0.00 O ATOM 939 ND2 ASN A 65 3.399 4.425 -12.331 1.00 0.00 N ATOM 0 H ASN A 65 1.671 0.874 -9.232 1.00 0.00 H new ATOM 0 HA ASN A 65 1.957 1.672 -11.338 1.00 0.00 H new ATOM 0 HB2 ASN A 65 4.101 3.002 -10.302 1.00 0.00 H new ATOM 0 HB3 ASN A 65 5.073 1.841 -11.185 1.00 0.00 H new ATOM 0 HD21 ASN A 65 3.343 5.065 -13.123 1.00 0.00 H new ATOM 0 HD22 ASN A 65 2.950 4.666 -11.448 1.00 0.00 H new ATOM 946 N GLU A 66 3.149 -1.395 -11.367 1.00 0.00 N ATOM 947 CA GLU A 66 3.746 -2.792 -11.819 1.00 0.00 C ATOM 948 C GLU A 66 5.282 -3.004 -11.293 1.00 0.00 C ATOM 949 O GLU A 66 5.930 -4.074 -11.562 1.00 0.00 O ATOM 950 CB GLU A 66 3.513 -3.262 -13.383 1.00 0.00 C ATOM 951 CG GLU A 66 2.036 -3.587 -13.786 1.00 0.00 C ATOM 952 CD GLU A 66 1.852 -4.016 -15.263 1.00 0.00 C ATOM 953 OE1 GLU A 66 1.611 -3.126 -16.125 1.00 0.00 O ATOM 954 OE2 GLU A 66 1.917 -5.243 -15.551 1.00 0.00 O ATOM 0 H GLU A 66 2.675 -1.494 -10.469 1.00 0.00 H new ATOM 0 HA GLU A 66 3.106 -3.504 -11.298 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.883 -2.473 -14.038 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.123 -4.145 -13.571 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.664 -4.383 -13.141 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.419 -2.708 -13.597 1.00 0.00 H new ATOM 961 N VAL A 67 5.807 -1.957 -10.403 1.00 0.00 N ATOM 962 CA VAL A 67 7.198 -1.884 -9.766 1.00 0.00 C ATOM 963 C VAL A 67 7.300 -2.676 -8.412 1.00 0.00 C ATOM 964 O VAL A 67 6.299 -2.708 -7.592 1.00 0.00 O ATOM 965 CB VAL A 67 7.942 -0.341 -9.695 1.00 0.00 C ATOM 966 CG1 VAL A 67 7.854 0.436 -10.952 1.00 0.00 C ATOM 967 CG2 VAL A 67 7.790 0.595 -8.403 1.00 0.00 C ATOM 0 H VAL A 67 5.231 -1.158 -10.138 1.00 0.00 H new ATOM 0 HA VAL A 67 7.813 -2.408 -10.498 1.00 0.00 H new ATOM 0 HB VAL A 67 8.960 -0.703 -9.549 1.00 0.00 H new ATOM 0 HG11 VAL A 67 8.349 1.398 -10.820 1.00 0.00 H new ATOM 0 HG12 VAL A 67 8.341 -0.116 -11.756 1.00 0.00 H new ATOM 0 HG13 VAL A 67 6.807 0.599 -11.207 1.00 0.00 H new ATOM 0 HG21 VAL A 67 8.336 1.525 -8.561 1.00 0.00 H new ATOM 0 HG22 VAL A 67 6.736 0.817 -8.236 1.00 0.00 H new ATOM 0 HG23 VAL A 67 8.195 0.081 -7.531 1.00 0.00 H new ATOM 977 N ASP A 68 8.601 -3.115 -8.146 1.00 0.00 N ATOM 978 CA ASP A 68 9.038 -3.982 -7.034 1.00 0.00 C ATOM 979 C ASP A 68 9.385 -3.205 -5.698 1.00 0.00 C ATOM 980 O ASP A 68 10.519 -2.668 -5.508 1.00 0.00 O ATOM 981 CB ASP A 68 10.052 -5.199 -7.449 1.00 0.00 C ATOM 982 CG ASP A 68 11.406 -4.821 -8.160 1.00 0.00 C ATOM 983 OD1 ASP A 68 12.414 -4.602 -7.448 1.00 0.00 O ATOM 984 OD2 ASP A 68 11.428 -4.760 -9.411 1.00 0.00 O ATOM 0 H ASP A 68 9.381 -2.845 -8.745 1.00 0.00 H new ATOM 0 HA ASP A 68 8.139 -4.537 -6.763 1.00 0.00 H new ATOM 0 HB2 ASP A 68 10.294 -5.756 -6.544 1.00 0.00 H new ATOM 0 HB3 ASP A 68 9.508 -5.878 -8.105 1.00 0.00 H new ATOM 989 N VAL A 69 8.290 -3.129 -4.838 1.00 0.00 N ATOM 990 CA VAL A 69 8.228 -2.480 -3.450 1.00 0.00 C ATOM 991 C VAL A 69 8.544 -3.517 -2.238 1.00 0.00 C ATOM 992 O VAL A 69 8.752 -3.091 -1.090 1.00 0.00 O ATOM 993 CB VAL A 69 6.856 -1.544 -3.371 1.00 0.00 C ATOM 994 CG1 VAL A 69 5.748 -1.733 -2.258 1.00 0.00 C ATOM 995 CG2 VAL A 69 7.180 -0.096 -3.599 1.00 0.00 C ATOM 0 H VAL A 69 7.391 -3.533 -5.101 1.00 0.00 H new ATOM 0 HA VAL A 69 9.052 -1.784 -3.293 1.00 0.00 H new ATOM 0 HB VAL A 69 6.303 -2.003 -4.190 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.949 -1.007 -2.413 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.339 -2.741 -2.319 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.191 -1.581 -1.274 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.266 0.495 -3.542 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.880 0.245 -2.836 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.630 0.025 -4.584 1.00 0.00 H new ATOM 1005 N ARG A 70 8.662 -4.871 -2.621 1.00 0.00 N ATOM 1006 CA ARG A 70 8.978 -6.109 -1.719 1.00 0.00 C ATOM 1007 C ARG A 70 10.483 -6.048 -0.990 1.00 0.00 C ATOM 1008 O ARG A 70 10.739 -6.816 -0.015 1.00 0.00 O ATOM 1009 CB ARG A 70 8.755 -7.434 -2.609 1.00 0.00 C ATOM 1010 CG ARG A 70 8.379 -8.756 -1.857 1.00 0.00 C ATOM 1011 CD ARG A 70 8.219 -9.932 -2.823 1.00 0.00 C ATOM 1012 NE ARG A 70 7.849 -11.221 -2.103 1.00 0.00 N ATOM 1013 CZ ARG A 70 7.699 -12.541 -2.612 1.00 0.00 C ATOM 1014 NH1 ARG A 70 7.890 -12.891 -3.925 1.00 0.00 N ATOM 1015 NH2 ARG A 70 7.352 -13.501 -1.763 1.00 0.00 N ATOM 0 H ARG A 70 8.537 -5.146 -3.595 1.00 0.00 H new ATOM 0 HA ARG A 70 8.294 -6.116 -0.870 1.00 0.00 H new ATOM 0 HB2 ARG A 70 7.968 -7.224 -3.334 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.669 -7.617 -3.175 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.151 -8.990 -1.124 1.00 0.00 H new ATOM 0 HG3 ARG A 70 7.450 -8.609 -1.306 1.00 0.00 H new ATOM 0 HD2 ARG A 70 7.450 -9.694 -3.558 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.149 -10.078 -3.372 1.00 0.00 H new ATOM 0 HE ARG A 70 7.683 -11.123 -1.101 1.00 0.00 H new ATOM 0 HH11 ARG A 70 8.158 -12.182 -4.608 1.00 0.00 H new ATOM 0 HH12 ARG A 70 7.764 -13.860 -4.218 1.00 0.00 H new ATOM 0 HH21 ARG A 70 7.201 -13.281 -0.778 1.00 0.00 H new ATOM 0 HH22 ARG A 70 7.236 -14.458 -2.095 1.00 0.00 H new ATOM 1029 N GLU A 71 11.416 -5.051 -1.499 1.00 0.00 N ATOM 1030 CA GLU A 71 12.861 -4.759 -0.998 1.00 0.00 C ATOM 1031 C GLU A 71 13.259 -3.271 -1.464 1.00 0.00 C ATOM 1032 O GLU A 71 13.927 -3.045 -2.539 1.00 0.00 O ATOM 1033 CB GLU A 71 13.963 -5.933 -1.412 1.00 0.00 C ATOM 1034 CG GLU A 71 15.332 -6.000 -0.613 1.00 0.00 C ATOM 1035 CD GLU A 71 16.284 -7.132 -1.068 1.00 0.00 C ATOM 1036 OE1 GLU A 71 17.122 -6.887 -1.978 1.00 0.00 O ATOM 1037 OE2 GLU A 71 16.210 -8.251 -0.492 1.00 0.00 O ATOM 0 H GLU A 71 11.157 -4.439 -2.273 1.00 0.00 H new ATOM 0 HA GLU A 71 12.884 -4.798 0.091 1.00 0.00 H new ATOM 0 HB2 GLU A 71 13.471 -6.900 -1.309 1.00 0.00 H new ATOM 0 HB3 GLU A 71 14.201 -5.807 -2.468 1.00 0.00 H new ATOM 0 HG2 GLU A 71 15.847 -5.045 -0.718 1.00 0.00 H new ATOM 0 HG3 GLU A 71 15.114 -6.130 0.447 1.00 0.00 H new ATOM 1044 N VAL A 72 12.696 -2.267 -0.661 1.00 0.00 N ATOM 1045 CA VAL A 72 12.876 -0.733 -0.796 1.00 0.00 C ATOM 1046 C VAL A 72 12.878 -0.028 0.655 1.00 0.00 C ATOM 1047 O VAL A 72 12.378 -0.626 1.638 1.00 0.00 O ATOM 1048 CB VAL A 72 11.761 0.061 -1.856 1.00 0.00 C ATOM 1049 CG1 VAL A 72 11.805 -0.373 -3.324 1.00 0.00 C ATOM 1050 CG2 VAL A 72 10.264 0.192 -1.365 1.00 0.00 C ATOM 0 H VAL A 72 12.086 -2.505 0.122 1.00 0.00 H new ATOM 0 HA VAL A 72 13.848 -0.613 -1.275 1.00 0.00 H new ATOM 0 HB VAL A 72 12.179 1.066 -1.802 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.065 0.190 -3.892 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.798 -0.181 -3.731 1.00 0.00 H new ATOM 0 HG13 VAL A 72 11.584 -1.438 -3.395 1.00 0.00 H new ATOM 0 HG21 VAL A 72 9.676 0.708 -2.124 1.00 0.00 H new ATOM 0 HG22 VAL A 72 9.848 -0.801 -1.197 1.00 0.00 H new ATOM 0 HG23 VAL A 72 10.235 0.760 -0.435 1.00 0.00 H new ATOM 1060 N THR A 73 13.392 1.289 0.700 1.00 0.00 N ATOM 1061 CA THR A 73 13.226 2.310 1.868 1.00 0.00 C ATOM 1062 C THR A 73 11.751 2.993 1.877 1.00 0.00 C ATOM 1063 O THR A 73 11.005 2.892 0.866 1.00 0.00 O ATOM 1064 CB THR A 73 14.375 3.465 1.891 1.00 0.00 C ATOM 1065 OG1 THR A 73 14.747 3.954 0.589 1.00 0.00 O ATOM 1066 CG2 THR A 73 15.603 3.083 2.699 1.00 0.00 C ATOM 0 H THR A 73 13.934 1.675 -0.073 1.00 0.00 H new ATOM 0 HA THR A 73 13.345 1.719 2.776 1.00 0.00 H new ATOM 0 HB THR A 73 13.892 4.294 2.407 1.00 0.00 H new ATOM 0 HG1 THR A 73 15.437 4.643 0.683 1.00 0.00 H new ATOM 0 HG21 THR A 73 16.326 3.899 2.670 1.00 0.00 H new ATOM 0 HG22 THR A 73 15.313 2.891 3.732 1.00 0.00 H new ATOM 0 HG23 THR A 73 16.052 2.185 2.275 1.00 0.00 H new ATOM 1074 N HIS A 74 11.351 3.656 3.085 1.00 0.00 N ATOM 1075 CA HIS A 74 10.042 4.486 3.381 1.00 0.00 C ATOM 1076 C HIS A 74 9.699 5.577 2.200 1.00 0.00 C ATOM 1077 O HIS A 74 8.678 5.376 1.406 1.00 0.00 O ATOM 1078 CB HIS A 74 10.227 5.126 4.881 1.00 0.00 C ATOM 1079 CG HIS A 74 9.010 5.793 5.624 1.00 0.00 C ATOM 1080 ND1 HIS A 74 8.869 7.171 5.759 1.00 0.00 N ATOM 1081 CD2 HIS A 74 7.967 5.253 6.336 1.00 0.00 C ATOM 1082 CE1 HIS A 74 7.804 7.446 6.517 1.00 0.00 C ATOM 1083 NE2 HIS A 74 7.244 6.300 6.874 1.00 0.00 N ATOM 0 H HIS A 74 11.954 3.625 3.907 1.00 0.00 H new ATOM 0 HA HIS A 74 9.157 3.850 3.371 1.00 0.00 H new ATOM 0 HB2 HIS A 74 10.600 4.330 5.526 1.00 0.00 H new ATOM 0 HB3 HIS A 74 11.014 5.878 4.815 1.00 0.00 H new ATOM 0 HD2 HIS A 74 7.751 4.201 6.454 1.00 0.00 H new ATOM 0 HE1 HIS A 74 7.459 8.432 6.791 1.00 0.00 H new ATOM 0 HE2 HIS A 74 6.411 6.205 7.454 1.00 0.00 H new ATOM 1092 N SER A 75 10.744 6.555 1.940 1.00 0.00 N ATOM 1093 CA SER A 75 10.712 7.674 0.879 1.00 0.00 C ATOM 1094 C SER A 75 10.646 7.098 -0.638 1.00 0.00 C ATOM 1095 O SER A 75 9.930 7.671 -1.454 1.00 0.00 O ATOM 1096 CB SER A 75 11.919 8.674 1.123 1.00 0.00 C ATOM 1097 OG SER A 75 11.850 9.868 0.324 1.00 0.00 O ATOM 0 H SER A 75 11.612 6.560 2.475 1.00 0.00 H new ATOM 0 HA SER A 75 9.785 8.236 0.995 1.00 0.00 H new ATOM 0 HB2 SER A 75 11.941 8.953 2.176 1.00 0.00 H new ATOM 0 HB3 SER A 75 12.855 8.158 0.910 1.00 0.00 H new ATOM 0 HG SER A 75 12.620 10.440 0.524 1.00 0.00 H new ATOM 1103 N ALA A 76 11.291 5.810 -0.864 1.00 0.00 N ATOM 1104 CA ALA A 76 11.332 4.979 -2.152 1.00 0.00 C ATOM 1105 C ALA A 76 9.941 4.225 -2.494 1.00 0.00 C ATOM 1106 O ALA A 76 9.678 3.915 -3.705 1.00 0.00 O ATOM 1107 CB ALA A 76 12.506 3.983 -2.071 1.00 0.00 C ATOM 0 H ALA A 76 11.798 5.346 -0.110 1.00 0.00 H new ATOM 0 HA ALA A 76 11.483 5.672 -2.980 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.542 3.388 -2.984 1.00 0.00 H new ATOM 0 HB2 ALA A 76 13.441 4.531 -1.958 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.366 3.324 -1.214 1.00 0.00 H new ATOM 1113 N ALA A 77 9.022 3.986 -1.373 1.00 0.00 N ATOM 1114 CA ALA A 77 7.602 3.435 -1.486 1.00 0.00 C ATOM 1115 C ALA A 77 6.507 4.581 -1.664 1.00 0.00 C ATOM 1116 O ALA A 77 5.481 4.345 -2.319 1.00 0.00 O ATOM 1117 CB ALA A 77 7.272 2.442 -0.345 1.00 0.00 C ATOM 0 H ALA A 77 9.288 4.182 -0.408 1.00 0.00 H new ATOM 0 HA ALA A 77 7.562 2.857 -2.409 1.00 0.00 H new ATOM 0 HB1 ALA A 77 6.253 2.075 -0.465 1.00 0.00 H new ATOM 0 HB2 ALA A 77 7.966 1.602 -0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 77 7.365 2.948 0.616 1.00 0.00 H new ATOM 1123 N VAL A 78 6.809 5.871 -1.075 1.00 0.00 N ATOM 1124 CA VAL A 78 6.003 7.244 -1.282 1.00 0.00 C ATOM 1125 C VAL A 78 6.273 7.842 -2.801 1.00 0.00 C ATOM 1126 O VAL A 78 5.324 8.311 -3.468 1.00 0.00 O ATOM 1127 CB VAL A 78 6.363 8.356 -0.047 1.00 0.00 C ATOM 1128 CG1 VAL A 78 5.642 9.735 -0.133 1.00 0.00 C ATOM 1129 CG2 VAL A 78 5.952 7.811 1.303 1.00 0.00 C ATOM 0 H VAL A 78 7.607 5.991 -0.451 1.00 0.00 H new ATOM 0 HA VAL A 78 4.933 7.049 -1.205 1.00 0.00 H new ATOM 0 HB VAL A 78 7.436 8.503 -0.173 1.00 0.00 H new ATOM 0 HG11 VAL A 78 5.949 10.359 0.706 1.00 0.00 H new ATOM 0 HG12 VAL A 78 5.909 10.227 -1.068 1.00 0.00 H new ATOM 0 HG13 VAL A 78 4.563 9.584 -0.097 1.00 0.00 H new ATOM 0 HG21 VAL A 78 6.192 8.539 2.078 1.00 0.00 H new ATOM 0 HG22 VAL A 78 4.879 7.618 1.306 1.00 0.00 H new ATOM 0 HG23 VAL A 78 6.488 6.883 1.499 1.00 0.00 H new ATOM 1139 N GLU A 79 7.605 7.705 -3.305 1.00 0.00 N ATOM 1140 CA GLU A 79 8.176 8.090 -4.706 1.00 0.00 C ATOM 1141 C GLU A 79 7.472 7.423 -5.930 1.00 0.00 C ATOM 1142 O GLU A 79 7.415 8.037 -6.952 1.00 0.00 O ATOM 1143 CB GLU A 79 9.717 7.856 -4.804 1.00 0.00 C ATOM 1144 CG GLU A 79 10.568 9.044 -4.298 1.00 0.00 C ATOM 1145 CD GLU A 79 12.102 8.862 -4.412 1.00 0.00 C ATOM 1146 OE1 GLU A 79 12.681 9.251 -5.464 1.00 0.00 O ATOM 1147 OE2 GLU A 79 12.727 8.362 -3.437 1.00 0.00 O ATOM 0 H GLU A 79 8.335 7.306 -2.715 1.00 0.00 H new ATOM 0 HA GLU A 79 7.956 9.156 -4.772 1.00 0.00 H new ATOM 0 HB2 GLU A 79 9.976 6.966 -4.230 1.00 0.00 H new ATOM 0 HB3 GLU A 79 9.978 7.652 -5.843 1.00 0.00 H new ATOM 0 HG2 GLU A 79 10.283 9.936 -4.856 1.00 0.00 H new ATOM 0 HG3 GLU A 79 10.318 9.228 -3.253 1.00 0.00 H new ATOM 1154 N ALA A 80 6.798 6.183 -5.687 1.00 0.00 N ATOM 1155 CA ALA A 80 5.967 5.365 -6.682 1.00 0.00 C ATOM 1156 C ALA A 80 4.514 6.025 -6.926 1.00 0.00 C ATOM 1157 O ALA A 80 3.916 5.889 -8.034 1.00 0.00 O ATOM 1158 CB ALA A 80 5.882 3.900 -6.176 1.00 0.00 C ATOM 0 H ALA A 80 6.833 5.737 -4.770 1.00 0.00 H new ATOM 0 HA ALA A 80 6.455 5.367 -7.657 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.293 3.307 -6.876 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.886 3.482 -6.102 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.407 3.881 -5.195 1.00 0.00 H new ATOM 1164 N LEU A 81 4.024 6.794 -5.809 1.00 0.00 N ATOM 1165 CA LEU A 81 2.722 7.528 -5.649 1.00 0.00 C ATOM 1166 C LEU A 81 2.817 9.065 -6.078 1.00 0.00 C ATOM 1167 O LEU A 81 1.832 9.625 -6.631 1.00 0.00 O ATOM 1168 CB LEU A 81 2.241 7.346 -4.099 1.00 0.00 C ATOM 1169 CG LEU A 81 1.898 5.936 -3.339 1.00 0.00 C ATOM 1170 CD1 LEU A 81 0.444 5.640 -3.315 1.00 0.00 C ATOM 1171 CD2 LEU A 81 2.602 4.647 -3.790 1.00 0.00 C ATOM 0 H LEU A 81 4.598 6.894 -4.972 1.00 0.00 H new ATOM 0 HA LEU A 81 1.980 7.103 -6.324 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.016 7.820 -3.497 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.343 7.956 -4.000 1.00 0.00 H new ATOM 0 HG LEU A 81 2.311 6.171 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.274 4.695 -2.800 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.081 6.439 -2.791 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.070 5.569 -4.336 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.257 3.812 -3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.369 4.453 -4.837 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.680 4.761 -3.673 1.00 0.00 H new ATOM 1183 N LYS A 82 4.059 9.715 -5.790 1.00 0.00 N ATOM 1184 CA LYS A 82 4.464 11.150 -6.145 1.00 0.00 C ATOM 1185 C LYS A 82 5.049 11.319 -7.631 1.00 0.00 C ATOM 1186 O LYS A 82 4.868 12.421 -8.240 1.00 0.00 O ATOM 1187 CB LYS A 82 5.433 11.770 -5.054 1.00 0.00 C ATOM 1188 CG LYS A 82 4.757 12.196 -3.690 1.00 0.00 C ATOM 1189 CD LYS A 82 5.756 12.881 -2.749 1.00 0.00 C ATOM 1190 CE LYS A 82 5.069 13.435 -1.496 1.00 0.00 C ATOM 1191 NZ LYS A 82 6.040 14.098 -0.579 1.00 0.00 N ATOM 0 H LYS A 82 4.804 9.226 -5.294 1.00 0.00 H new ATOM 0 HA LYS A 82 3.537 11.723 -6.138 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.216 11.044 -4.837 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.920 12.645 -5.484 1.00 0.00 H new ATOM 0 HG2 LYS A 82 3.926 12.871 -3.892 1.00 0.00 H new ATOM 0 HG3 LYS A 82 4.341 11.316 -3.200 1.00 0.00 H new ATOM 0 HD2 LYS A 82 6.527 12.168 -2.456 1.00 0.00 H new ATOM 0 HD3 LYS A 82 6.256 13.692 -3.278 1.00 0.00 H new ATOM 0 HE2 LYS A 82 4.300 14.150 -1.789 1.00 0.00 H new ATOM 0 HE3 LYS A 82 4.566 12.624 -0.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 5.537 14.460 0.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 6.760 13.410 -0.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 6.501 14.888 -1.074 1.00 0.00 H new ATOM 1205 N GLU A 83 5.725 10.167 -8.222 1.00 0.00 N ATOM 1206 CA GLU A 83 6.294 10.115 -9.697 1.00 0.00 C ATOM 1207 C GLU A 83 5.264 10.104 -10.895 1.00 0.00 C ATOM 1208 O GLU A 83 5.465 10.866 -11.894 1.00 0.00 O ATOM 1209 CB GLU A 83 7.491 9.095 -9.913 1.00 0.00 C ATOM 1210 CG GLU A 83 7.241 7.504 -10.067 1.00 0.00 C ATOM 1211 CD GLU A 83 8.522 6.662 -10.239 1.00 0.00 C ATOM 1212 OE1 GLU A 83 9.086 6.205 -9.210 1.00 0.00 O ATOM 1213 OE2 GLU A 83 8.944 6.439 -11.405 1.00 0.00 O ATOM 0 H GLU A 83 5.877 9.300 -7.707 1.00 0.00 H new ATOM 0 HA GLU A 83 6.713 11.119 -9.759 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.022 9.418 -10.808 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.172 9.227 -9.073 1.00 0.00 H new ATOM 0 HG2 GLU A 83 6.704 7.148 -9.188 1.00 0.00 H new ATOM 0 HG3 GLU A 83 6.593 7.334 -10.927 1.00 0.00 H new ATOM 1220 N ALA A 84 4.115 9.231 -10.739 1.00 0.00 N ATOM 1221 CA ALA A 84 3.053 8.957 -11.809 1.00 0.00 C ATOM 1222 C ALA A 84 2.147 10.244 -12.249 1.00 0.00 C ATOM 1223 O ALA A 84 1.509 10.255 -13.350 1.00 0.00 O ATOM 1224 CB ALA A 84 2.252 7.740 -11.381 1.00 0.00 C ATOM 0 H ALA A 84 3.936 8.725 -9.872 1.00 0.00 H new ATOM 0 HA ALA A 84 3.565 8.740 -12.746 1.00 0.00 H new ATOM 0 HB1 ALA A 84 1.489 7.526 -12.129 1.00 0.00 H new ATOM 0 HB2 ALA A 84 2.917 6.882 -11.285 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.774 7.938 -10.421 1.00 0.00 H new ATOM 1230 N GLY A 85 2.196 11.318 -11.320 1.00 0.00 N ATOM 1231 CA GLY A 85 1.704 12.736 -11.480 1.00 0.00 C ATOM 1232 C GLY A 85 0.226 13.113 -11.356 1.00 0.00 C ATOM 1233 O GLY A 85 -0.080 14.217 -10.831 1.00 0.00 O ATOM 0 H GLY A 85 2.608 11.178 -10.398 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.242 13.337 -10.747 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.029 13.069 -12.465 1.00 0.00 H new ATOM 1237 N SER A 86 -0.693 12.163 -11.832 1.00 0.00 N ATOM 1238 CA SER A 86 -2.198 12.352 -12.043 1.00 0.00 C ATOM 1239 C SER A 86 -2.973 10.989 -11.888 1.00 0.00 C ATOM 1240 O SER A 86 -4.106 11.013 -11.380 1.00 0.00 O ATOM 1241 CB SER A 86 -2.444 13.001 -13.489 1.00 0.00 C ATOM 1242 OG SER A 86 -3.786 13.473 -13.710 1.00 0.00 O ATOM 0 H SER A 86 -0.392 11.222 -12.084 1.00 0.00 H new ATOM 0 HA SER A 86 -2.586 13.024 -11.277 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.753 13.833 -13.622 1.00 0.00 H new ATOM 0 HB3 SER A 86 -2.202 12.261 -14.252 1.00 0.00 H new ATOM 0 HG SER A 86 -3.854 13.855 -14.610 1.00 0.00 H new ATOM 1248 N ILE A 87 -2.327 9.800 -12.382 1.00 0.00 N ATOM 1249 CA ILE A 87 -2.924 8.381 -12.337 1.00 0.00 C ATOM 1250 C ILE A 87 -1.873 7.385 -11.704 1.00 0.00 C ATOM 1251 O ILE A 87 -0.779 7.169 -12.270 1.00 0.00 O ATOM 1252 CB ILE A 87 -3.583 7.840 -13.846 1.00 0.00 C ATOM 1253 CG1 ILE A 87 -4.700 8.862 -14.542 1.00 0.00 C ATOM 1254 CG2 ILE A 87 -4.062 6.295 -13.919 1.00 0.00 C ATOM 1255 CD1 ILE A 87 -6.062 9.266 -13.797 1.00 0.00 C ATOM 0 H ILE A 87 -1.400 9.824 -12.808 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.799 8.408 -11.687 1.00 0.00 H new ATOM 0 HB ILE A 87 -2.689 7.884 -14.468 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -4.178 9.792 -14.768 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -4.983 8.416 -15.495 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.454 6.082 -14.914 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.214 5.641 -13.716 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -4.841 6.120 -13.177 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.638 9.939 -14.432 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.646 8.368 -13.595 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.828 9.766 -12.857 1.00 0.00 H new ATOM 1267 N VAL A 88 -2.355 6.726 -10.584 1.00 0.00 N ATOM 1268 CA VAL A 88 -1.610 5.684 -9.732 1.00 0.00 C ATOM 1269 C VAL A 88 -2.327 4.260 -9.720 1.00 0.00 C ATOM 1270 O VAL A 88 -3.523 4.154 -9.313 1.00 0.00 O ATOM 1271 CB VAL A 88 -1.061 6.167 -8.216 1.00 0.00 C ATOM 1272 CG1 VAL A 88 0.065 7.197 -8.284 1.00 0.00 C ATOM 1273 CG2 VAL A 88 -2.127 6.665 -7.159 1.00 0.00 C ATOM 0 H VAL A 88 -3.296 6.902 -10.231 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.673 5.574 -10.278 1.00 0.00 H new ATOM 0 HB VAL A 88 -0.702 5.209 -7.838 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.373 7.466 -7.274 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.913 6.774 -8.822 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.287 8.087 -8.805 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.621 6.941 -6.234 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -2.655 7.532 -7.556 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -2.841 5.866 -6.958 1.00 0.00 H new ATOM 1283 N ARG A 89 -1.539 3.191 -10.193 1.00 0.00 N ATOM 1284 CA ARG A 89 -1.982 1.714 -10.305 1.00 0.00 C ATOM 1285 C ARG A 89 -1.285 0.748 -9.247 1.00 0.00 C ATOM 1286 O ARG A 89 -0.140 0.284 -9.439 1.00 0.00 O ATOM 1287 CB ARG A 89 -2.072 1.132 -11.847 1.00 0.00 C ATOM 1288 CG ARG A 89 -0.818 1.196 -12.801 1.00 0.00 C ATOM 1289 CD ARG A 89 -1.231 0.810 -14.222 1.00 0.00 C ATOM 1290 NE ARG A 89 -1.284 -0.712 -14.504 1.00 0.00 N ATOM 1291 CZ ARG A 89 -1.721 -1.402 -15.662 1.00 0.00 C ATOM 1292 NH1 ARG A 89 -2.199 -0.786 -16.791 1.00 0.00 N ATOM 1293 NH2 ARG A 89 -1.669 -2.728 -15.656 1.00 0.00 N ATOM 0 H ARG A 89 -0.579 3.332 -10.507 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.027 1.720 -9.996 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.372 0.086 -11.779 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.883 1.664 -12.345 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.395 2.201 -12.795 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.041 0.521 -12.442 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.214 1.235 -14.426 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.534 1.269 -14.923 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.955 -1.306 -13.743 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.256 0.232 -16.831 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -2.497 -1.346 -17.590 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -1.322 -3.221 -14.833 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -1.976 -3.254 -16.474 1.00 0.00 H new ATOM 1307 N LEU A 90 -2.078 0.463 -8.134 1.00 0.00 N ATOM 1308 CA LEU A 90 -1.702 -0.351 -6.898 1.00 0.00 C ATOM 1309 C LEU A 90 -2.227 -1.854 -6.936 1.00 0.00 C ATOM 1310 O LEU A 90 -3.395 -2.124 -7.382 1.00 0.00 O ATOM 1311 CB LEU A 90 -2.090 0.465 -5.500 1.00 0.00 C ATOM 1312 CG LEU A 90 -3.572 0.955 -5.173 1.00 0.00 C ATOM 1313 CD1 LEU A 90 -4.426 -0.137 -4.509 1.00 0.00 C ATOM 1314 CD2 LEU A 90 -3.506 2.191 -4.315 1.00 0.00 C ATOM 0 H LEU A 90 -3.035 0.810 -8.074 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.617 -0.458 -6.907 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -1.784 -0.174 -4.672 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.456 1.351 -5.471 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.066 1.188 -6.116 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.424 0.253 -4.309 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -4.499 -0.997 -5.175 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.962 -0.442 -3.571 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.517 2.531 -4.088 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -2.983 1.962 -3.386 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.970 2.976 -4.849 1.00 0.00 H new ATOM 1326 N TYR A 91 -1.307 -2.799 -6.439 1.00 0.00 N ATOM 1327 CA TYR A 91 -1.510 -4.287 -6.353 1.00 0.00 C ATOM 1328 C TYR A 91 -1.434 -4.784 -4.871 1.00 0.00 C ATOM 1329 O TYR A 91 -0.295 -4.785 -4.220 1.00 0.00 O ATOM 1330 CB TYR A 91 -0.493 -5.086 -7.356 1.00 0.00 C ATOM 1331 CG TYR A 91 -0.801 -6.601 -7.740 1.00 0.00 C ATOM 1332 CD1 TYR A 91 -2.030 -7.011 -8.300 1.00 0.00 C ATOM 1333 CD2 TYR A 91 0.152 -7.571 -7.512 1.00 0.00 C ATOM 1334 CE1 TYR A 91 -2.283 -8.297 -8.603 1.00 0.00 C ATOM 1335 CE2 TYR A 91 -0.079 -8.887 -7.824 1.00 0.00 C ATOM 1336 CZ TYR A 91 -1.303 -9.259 -8.371 1.00 0.00 C ATOM 1337 OH TYR A 91 -1.533 -10.574 -8.702 1.00 0.00 O ATOM 0 H TYR A 91 -0.393 -2.516 -6.086 1.00 0.00 H new ATOM 0 HA TYR A 91 -2.518 -4.517 -6.700 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -0.437 -4.518 -8.285 1.00 0.00 H new ATOM 0 HB3 TYR A 91 0.499 -5.058 -6.905 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -2.791 -6.269 -8.491 1.00 0.00 H new ATOM 0 HD2 TYR A 91 1.100 -7.289 -7.079 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -3.237 -8.581 -9.022 1.00 0.00 H new ATOM 0 HE2 TYR A 91 0.685 -9.630 -7.646 1.00 0.00 H new ATOM 0 HH TYR A 91 -0.746 -11.111 -8.475 1.00 0.00 H new ATOM 1347 N VAL A 92 -2.679 -5.252 -4.408 1.00 0.00 N ATOM 1348 CA VAL A 92 -3.007 -5.749 -2.970 1.00 0.00 C ATOM 1349 C VAL A 92 -3.187 -7.380 -2.815 1.00 0.00 C ATOM 1350 O VAL A 92 -3.543 -8.096 -3.814 1.00 0.00 O ATOM 1351 CB VAL A 92 -4.277 -4.904 -2.237 1.00 0.00 C ATOM 1352 CG1 VAL A 92 -4.021 -3.397 -2.075 1.00 0.00 C ATOM 1353 CG2 VAL A 92 -5.684 -5.163 -2.875 1.00 0.00 C ATOM 0 H VAL A 92 -3.491 -5.297 -5.023 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.100 -5.510 -2.415 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.303 -5.334 -1.236 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.883 -2.931 -1.597 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.136 -3.243 -1.457 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.862 -2.947 -3.055 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.437 -4.582 -2.343 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.669 -4.864 -3.923 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.926 -6.223 -2.803 1.00 0.00 H new ATOM 1363 N MET A 93 -3.017 -7.850 -1.488 1.00 0.00 N ATOM 1364 CA MET A 93 -3.046 -9.323 -0.987 1.00 0.00 C ATOM 1365 C MET A 93 -4.199 -9.615 0.101 1.00 0.00 C ATOM 1366 O MET A 93 -4.132 -9.117 1.272 1.00 0.00 O ATOM 1367 CB MET A 93 -1.549 -9.923 -0.579 1.00 0.00 C ATOM 1368 CG MET A 93 -0.685 -9.196 0.534 1.00 0.00 C ATOM 1369 SD MET A 93 0.890 -10.023 0.838 1.00 0.00 S ATOM 1370 CE MET A 93 1.582 -8.980 2.119 1.00 0.00 C ATOM 0 H MET A 93 -2.852 -7.198 -0.721 1.00 0.00 H new ATOM 0 HA MET A 93 -3.341 -9.911 -1.856 1.00 0.00 H new ATOM 0 HB2 MET A 93 -1.689 -10.956 -0.259 1.00 0.00 H new ATOM 0 HB3 MET A 93 -0.950 -9.950 -1.489 1.00 0.00 H new ATOM 0 HG2 MET A 93 -0.498 -8.166 0.229 1.00 0.00 H new ATOM 0 HG3 MET A 93 -1.255 -9.155 1.462 1.00 0.00 H new ATOM 0 HE1 MET A 93 2.559 -9.364 2.413 1.00 0.00 H new ATOM 0 HE2 MET A 93 1.690 -7.963 1.741 1.00 0.00 H new ATOM 0 HE3 MET A 93 0.918 -8.977 2.984 1.00 0.00 H new ATOM 1380 N ARG A 94 -5.255 -10.447 -0.355 1.00 0.00 N ATOM 1381 CA ARG A 94 -6.493 -10.878 0.420 1.00 0.00 C ATOM 1382 C ARG A 94 -6.483 -12.493 0.579 1.00 0.00 C ATOM 1383 O ARG A 94 -5.975 -13.231 -0.311 1.00 0.00 O ATOM 1384 CB ARG A 94 -7.819 -10.306 -0.351 1.00 0.00 C ATOM 1385 CG ARG A 94 -9.158 -10.194 0.453 1.00 0.00 C ATOM 1386 CD ARG A 94 -10.286 -9.663 -0.432 1.00 0.00 C ATOM 1387 NE ARG A 94 -11.612 -9.566 0.306 1.00 0.00 N ATOM 1388 CZ ARG A 94 -12.890 -9.154 -0.168 1.00 0.00 C ATOM 1389 NH1 ARG A 94 -13.143 -8.752 -1.457 1.00 0.00 N ATOM 1390 NH2 ARG A 94 -13.903 -9.159 0.686 1.00 0.00 N ATOM 0 H ARG A 94 -5.248 -10.835 -1.298 1.00 0.00 H new ATOM 0 HA ARG A 94 -6.503 -10.463 1.428 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -7.578 -9.314 -0.734 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -8.003 -10.946 -1.214 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -9.431 -11.172 0.849 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -9.019 -9.532 1.307 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -10.013 -8.678 -0.811 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -10.403 -10.316 -1.297 1.00 0.00 H new ATOM 0 HE ARG A 94 -11.581 -9.837 1.289 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -12.389 -8.736 -2.144 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -14.085 -8.469 -1.728 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -13.755 -9.452 1.652 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.831 -8.869 0.378 1.00 0.00 H new ATOM 1404 N ARG A 95 -7.045 -12.970 1.769 1.00 0.00 N ATOM 1405 CA ARG A 95 -7.195 -14.455 2.201 1.00 0.00 C ATOM 1406 C ARG A 95 -8.641 -15.065 1.953 1.00 0.00 C ATOM 1407 O ARG A 95 -9.682 -14.352 2.099 1.00 0.00 O ATOM 1408 CB ARG A 95 -6.671 -14.726 3.692 1.00 0.00 C ATOM 1409 CG ARG A 95 -5.144 -14.882 3.827 1.00 0.00 C ATOM 1410 CD ARG A 95 -4.736 -15.226 5.255 1.00 0.00 C ATOM 1411 NE ARG A 95 -3.228 -15.380 5.399 1.00 0.00 N ATOM 1412 CZ ARG A 95 -2.453 -15.767 6.527 1.00 0.00 C ATOM 1413 NH1 ARG A 95 -2.979 -16.095 7.752 1.00 0.00 N ATOM 1414 NH2 ARG A 95 -1.132 -15.818 6.388 1.00 0.00 N ATOM 0 H ARG A 95 -7.415 -12.330 2.472 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.534 -15.002 1.528 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -6.995 -13.904 4.330 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.148 -15.630 4.070 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -4.797 -15.664 3.151 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -4.655 -13.957 3.522 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -5.086 -14.445 5.930 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -5.225 -16.152 5.558 1.00 0.00 H new ATOM 0 HE ARG A 95 -2.691 -15.174 4.557 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.988 -16.070 7.897 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -2.360 -16.364 8.517 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -0.704 -15.583 5.492 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -0.546 -16.092 7.177 1.00 0.00 H new ATOM 1428 N LYS A 96 -8.647 -16.440 1.563 1.00 0.00 N ATOM 1429 CA LYS A 96 -9.887 -17.330 1.191 1.00 0.00 C ATOM 1430 C LYS A 96 -10.978 -17.621 2.407 1.00 0.00 C ATOM 1431 O LYS A 96 -10.524 -17.980 3.537 1.00 0.00 O ATOM 1432 CB LYS A 96 -9.462 -18.688 0.477 1.00 0.00 C ATOM 1433 CG LYS A 96 -9.085 -18.592 -1.030 1.00 0.00 C ATOM 1434 CD LYS A 96 -8.615 -19.972 -1.598 1.00 0.00 C ATOM 1435 CE LYS A 96 -8.344 -19.984 -3.142 1.00 0.00 C ATOM 1436 NZ LYS A 96 -7.063 -19.293 -3.570 1.00 0.00 N ATOM 0 H LYS A 96 -7.776 -16.967 1.498 1.00 0.00 H new ATOM 0 HA LYS A 96 -10.429 -16.703 0.483 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -8.611 -19.105 1.016 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.283 -19.398 0.579 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -9.945 -18.238 -1.598 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -8.292 -17.856 -1.161 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.704 -20.272 -1.080 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -9.373 -20.721 -1.370 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -8.313 -21.019 -3.483 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -9.184 -19.507 -3.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -6.967 -19.350 -4.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -7.093 -18.295 -3.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -6.250 -19.760 -3.120 1.00 0.00 H new ATOM 1450 N PRO A 97 -12.503 -17.417 2.183 1.00 0.00 N ATOM 1451 CA PRO A 97 -13.603 -17.679 3.261 1.00 0.00 C ATOM 1452 C PRO A 97 -13.837 -19.226 3.872 1.00 0.00 C ATOM 1453 O PRO A 97 -14.140 -19.276 5.093 1.00 0.00 O ATOM 1454 CB PRO A 97 -14.916 -17.135 2.593 1.00 0.00 C ATOM 1455 CG PRO A 97 -14.463 -16.207 1.510 1.00 0.00 C ATOM 1456 CD PRO A 97 -13.227 -16.834 0.930 1.00 0.00 C ATOM 0 HA PRO A 97 -13.273 -17.184 4.175 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -15.515 -17.950 2.186 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -15.539 -16.614 3.320 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -15.235 -16.086 0.750 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -14.249 -15.215 1.908 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -13.471 -17.613 0.207 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -12.609 -16.101 0.412 1.00 0.00 H new ATOM 1464 N PRO A 98 -13.695 -20.553 3.038 1.00 0.00 N ATOM 1465 CA PRO A 98 -13.980 -22.017 3.579 1.00 0.00 C ATOM 1466 C PRO A 98 -13.490 -22.466 5.077 1.00 0.00 C ATOM 1467 O PRO A 98 -14.221 -23.232 5.755 1.00 0.00 O ATOM 1468 CB PRO A 98 -13.388 -22.958 2.455 1.00 0.00 C ATOM 1469 CG PRO A 98 -12.669 -22.063 1.473 1.00 0.00 C ATOM 1470 CD PRO A 98 -13.337 -20.716 1.551 1.00 0.00 C ATOM 0 HA PRO A 98 -15.054 -22.084 3.753 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -12.704 -23.690 2.884 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -14.182 -23.516 1.960 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -11.611 -21.986 1.722 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -12.730 -22.468 0.463 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -12.671 -19.922 1.213 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -14.226 -20.676 0.921 1.00 0.00 H new ATOM 1478 N ALA A 99 -12.223 -21.915 5.565 1.00 0.00 N ATOM 1479 CA ALA A 99 -11.505 -22.131 6.956 1.00 0.00 C ATOM 1480 C ALA A 99 -11.147 -23.629 7.370 1.00 0.00 C ATOM 1481 O ALA A 99 -12.078 -24.437 7.683 1.00 0.00 O ATOM 1482 CB ALA A 99 -12.100 -21.260 8.146 1.00 0.00 C ATOM 1483 OXT ALA A 99 -9.939 -23.957 7.371 1.00 0.00 O ATOM 0 H ALA A 99 -11.675 -21.294 4.969 1.00 0.00 H new ATOM 0 HA ALA A 99 -10.519 -21.715 6.748 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.549 -21.471 9.062 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -12.009 -20.201 7.903 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -13.151 -21.510 8.290 1.00 0.00 H new TER 1489 ALA A 99 ATOM 1490 N VAL B 1 2.213 -1.692 17.814 1.00 0.00 N ATOM 1491 CA VAL B 1 3.408 -1.412 16.957 1.00 0.00 C ATOM 1492 C VAL B 1 4.367 -0.308 17.603 1.00 0.00 C ATOM 1493 O VAL B 1 3.953 0.853 17.893 1.00 0.00 O ATOM 1494 CB VAL B 1 3.021 -1.326 15.354 1.00 0.00 C ATOM 1495 CG1 VAL B 1 2.233 -0.091 14.795 1.00 0.00 C ATOM 1496 CG2 VAL B 1 4.110 -1.884 14.397 1.00 0.00 C ATOM 0 H1 VAL B 1 1.664 -2.472 17.400 1.00 0.00 H new ATOM 0 H2 VAL B 1 2.526 -1.958 18.770 1.00 0.00 H new ATOM 0 H3 VAL B 1 1.618 -0.841 17.869 1.00 0.00 H new ATOM 0 HA VAL B 1 4.078 -2.272 16.948 1.00 0.00 H new ATOM 0 HB VAL B 1 2.198 -2.041 15.357 1.00 0.00 H new ATOM 0 HG11 VAL B 1 2.073 -0.216 13.724 1.00 0.00 H new ATOM 0 HG12 VAL B 1 1.270 -0.016 15.299 1.00 0.00 H new ATOM 0 HG13 VAL B 1 2.808 0.818 14.973 1.00 0.00 H new ATOM 0 HG21 VAL B 1 3.772 -1.788 13.365 1.00 0.00 H new ATOM 0 HG22 VAL B 1 5.034 -1.322 14.530 1.00 0.00 H new ATOM 0 HG23 VAL B 1 4.289 -2.935 14.623 1.00 0.00 H new ATOM 1508 N VAL B 2 5.656 -0.777 17.751 1.00 0.00 N ATOM 1509 CA VAL B 2 6.794 -0.204 18.598 1.00 0.00 C ATOM 1510 C VAL B 2 7.926 0.730 17.815 1.00 0.00 C ATOM 1511 O VAL B 2 8.648 1.494 18.526 1.00 0.00 O ATOM 1512 CB VAL B 2 7.432 -1.483 19.531 1.00 0.00 C ATOM 1513 CG1 VAL B 2 8.154 -2.682 18.770 1.00 0.00 C ATOM 1514 CG2 VAL B 2 8.192 -1.069 20.835 1.00 0.00 C ATOM 0 H VAL B 2 5.957 -1.616 17.256 1.00 0.00 H new ATOM 0 HA VAL B 2 6.371 0.562 19.248 1.00 0.00 H new ATOM 0 HB VAL B 2 6.486 -1.920 19.851 1.00 0.00 H new ATOM 0 HG11 VAL B 2 8.505 -3.415 19.496 1.00 0.00 H new ATOM 0 HG12 VAL B 2 7.449 -3.157 18.087 1.00 0.00 H new ATOM 0 HG13 VAL B 2 9.002 -2.296 18.205 1.00 0.00 H new ATOM 0 HG21 VAL B 2 8.552 -1.962 21.345 1.00 0.00 H new ATOM 0 HG22 VAL B 2 9.038 -0.432 20.576 1.00 0.00 H new ATOM 0 HG23 VAL B 2 7.515 -0.524 21.493 1.00 0.00 H new ATOM 1524 N SER B 3 7.992 0.691 16.379 1.00 0.00 N ATOM 1525 CA SER B 3 9.216 1.261 15.572 1.00 0.00 C ATOM 1526 C SER B 3 9.081 2.667 14.842 1.00 0.00 C ATOM 1527 O SER B 3 10.101 3.437 14.802 1.00 0.00 O ATOM 1528 CB SER B 3 9.833 0.175 14.634 1.00 0.00 C ATOM 1529 OG SER B 3 10.407 -0.899 15.371 1.00 0.00 O ATOM 0 H SER B 3 7.257 0.295 15.793 1.00 0.00 H new ATOM 0 HA SER B 3 9.905 1.516 16.377 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.060 -0.213 13.970 1.00 0.00 H new ATOM 0 HB3 SER B 3 10.596 0.631 14.003 1.00 0.00 H new ATOM 0 HG SER B 3 10.781 -1.559 14.750 1.00 0.00 H new ATOM 1535 N GLU B 4 7.801 3.028 14.339 1.00 0.00 N ATOM 1536 CA GLU B 4 7.509 4.225 13.413 1.00 0.00 C ATOM 1537 C GLU B 4 6.650 5.450 14.096 1.00 0.00 C ATOM 1538 O GLU B 4 6.218 5.342 15.281 1.00 0.00 O ATOM 1539 CB GLU B 4 6.885 3.612 11.991 1.00 0.00 C ATOM 1540 CG GLU B 4 5.362 3.180 11.828 1.00 0.00 C ATOM 1541 CD GLU B 4 4.732 2.232 12.887 1.00 0.00 C ATOM 1542 OE1 GLU B 4 4.919 1.016 12.785 1.00 0.00 O ATOM 1543 OE2 GLU B 4 4.048 2.743 13.805 1.00 0.00 O ATOM 0 H GLU B 4 6.961 2.496 14.568 1.00 0.00 H new ATOM 0 HA GLU B 4 8.439 4.750 13.197 1.00 0.00 H new ATOM 0 HB2 GLU B 4 7.079 4.359 11.221 1.00 0.00 H new ATOM 0 HB3 GLU B 4 7.483 2.735 11.743 1.00 0.00 H new ATOM 0 HG2 GLU B 4 4.762 4.090 11.802 1.00 0.00 H new ATOM 0 HG3 GLU B 4 5.258 2.702 10.854 1.00 0.00 H new ATOM 1550 N ARG B 5 6.452 6.604 13.265 1.00 0.00 N ATOM 1551 CA ARG B 5 5.609 7.848 13.585 1.00 0.00 C ATOM 1552 C ARG B 5 4.190 7.909 12.802 1.00 0.00 C ATOM 1553 O ARG B 5 3.165 8.299 13.417 1.00 0.00 O ATOM 1554 CB ARG B 5 6.471 9.269 13.513 1.00 0.00 C ATOM 1555 CG ARG B 5 7.228 9.756 12.142 1.00 0.00 C ATOM 1556 CD ARG B 5 8.576 9.015 11.759 1.00 0.00 C ATOM 1557 NE ARG B 5 9.758 9.323 12.695 1.00 0.00 N ATOM 1558 CZ ARG B 5 11.082 8.815 12.678 1.00 0.00 C ATOM 1559 NH1 ARG B 5 11.552 7.908 11.761 1.00 0.00 N ATOM 1560 NH2 ARG B 5 11.926 9.243 13.609 1.00 0.00 N ATOM 0 H ARG B 5 6.891 6.672 12.347 1.00 0.00 H new ATOM 0 HA ARG B 5 5.335 7.731 14.633 1.00 0.00 H new ATOM 0 HB2 ARG B 5 5.785 10.068 13.794 1.00 0.00 H new ATOM 0 HB3 ARG B 5 7.233 9.215 14.291 1.00 0.00 H new ATOM 0 HG2 ARG B 5 6.531 9.641 11.312 1.00 0.00 H new ATOM 0 HG3 ARG B 5 7.442 10.821 12.234 1.00 0.00 H new ATOM 0 HD2 ARG B 5 8.398 7.940 11.760 1.00 0.00 H new ATOM 0 HD3 ARG B 5 8.852 9.292 10.742 1.00 0.00 H new ATOM 0 HE ARG B 5 9.560 9.992 13.439 1.00 0.00 H new ATOM 0 HH11 ARG B 5 10.934 7.555 11.030 1.00 0.00 H new ATOM 0 HH12 ARG B 5 12.519 7.587 11.811 1.00 0.00 H new ATOM 0 HH21 ARG B 5 11.615 9.917 14.308 1.00 0.00 H new ATOM 0 HH22 ARG B 5 12.886 8.898 13.625 1.00 0.00 H new ATOM 1574 N ILE B 6 4.185 7.478 11.406 1.00 0.00 N ATOM 1575 CA ILE B 6 2.994 7.441 10.399 1.00 0.00 C ATOM 1576 C ILE B 6 2.495 8.869 9.824 1.00 0.00 C ATOM 1577 O ILE B 6 1.526 9.491 10.349 1.00 0.00 O ATOM 1578 CB ILE B 6 1.866 6.192 10.676 1.00 0.00 C ATOM 1579 CG1 ILE B 6 2.015 4.845 9.762 1.00 0.00 C ATOM 1580 CG2 ILE B 6 0.405 6.478 11.246 1.00 0.00 C ATOM 1581 CD1 ILE B 6 1.679 4.860 8.195 1.00 0.00 C ATOM 0 H ILE B 6 5.044 7.144 10.968 1.00 0.00 H new ATOM 0 HA ILE B 6 3.421 7.081 9.463 1.00 0.00 H new ATOM 0 HB ILE B 6 2.303 5.958 11.647 1.00 0.00 H new ATOM 0 HG12 ILE B 6 3.046 4.505 9.863 1.00 0.00 H new ATOM 0 HG13 ILE B 6 1.382 4.082 10.215 1.00 0.00 H new ATOM 0 HG21 ILE B 6 -0.139 5.538 11.342 1.00 0.00 H new ATOM 0 HG22 ILE B 6 0.483 6.954 12.224 1.00 0.00 H new ATOM 0 HG23 ILE B 6 -0.129 7.138 10.563 1.00 0.00 H new ATOM 0 HD11 ILE B 6 1.843 3.866 7.778 1.00 0.00 H new ATOM 0 HD12 ILE B 6 0.638 5.147 8.049 1.00 0.00 H new ATOM 0 HD13 ILE B 6 2.327 5.577 7.691 1.00 0.00 H new ATOM 1593 N SER B 7 3.292 9.364 8.768 1.00 0.00 N ATOM 1594 CA SER B 7 3.126 10.739 8.022 1.00 0.00 C ATOM 1595 C SER B 7 3.031 10.630 6.391 1.00 0.00 C ATOM 1596 O SER B 7 2.908 11.690 5.674 1.00 0.00 O ATOM 1597 CB SER B 7 4.291 11.750 8.466 1.00 0.00 C ATOM 1598 OG SER B 7 4.211 12.086 9.850 1.00 0.00 O ATOM 0 H SER B 7 4.076 8.825 8.400 1.00 0.00 H new ATOM 0 HA SER B 7 2.156 11.129 8.330 1.00 0.00 H new ATOM 0 HB2 SER B 7 5.261 11.298 8.259 1.00 0.00 H new ATOM 0 HB3 SER B 7 4.229 12.659 7.868 1.00 0.00 H new ATOM 0 HG SER B 7 4.938 12.701 10.080 1.00 0.00 H new ATOM 1604 N SER B 8 2.964 9.315 5.838 1.00 0.00 N ATOM 1605 CA SER B 8 3.023 8.907 4.332 1.00 0.00 C ATOM 1606 C SER B 8 1.643 9.118 3.472 1.00 0.00 C ATOM 1607 O SER B 8 0.654 9.683 4.011 1.00 0.00 O ATOM 1608 CB SER B 8 3.561 7.426 4.237 1.00 0.00 C ATOM 1609 OG SER B 8 4.870 7.283 4.770 1.00 0.00 O ATOM 0 H SER B 8 2.866 8.499 6.442 1.00 0.00 H new ATOM 0 HA SER B 8 3.708 9.604 3.849 1.00 0.00 H new ATOM 0 HB2 SER B 8 2.881 6.762 4.771 1.00 0.00 H new ATOM 0 HB3 SER B 8 3.561 7.110 3.194 1.00 0.00 H new ATOM 0 HG SER B 8 5.038 6.340 4.977 1.00 0.00 H new ATOM 1615 N VAL B 9 1.659 8.690 2.085 1.00 0.00 N ATOM 1616 CA VAL B 9 0.489 8.768 1.079 1.00 0.00 C ATOM 1617 C VAL B 9 -0.019 7.257 0.825 1.00 0.00 C ATOM 1618 O VAL B 9 -0.913 6.842 1.547 1.00 0.00 O ATOM 1619 CB VAL B 9 0.865 9.606 -0.394 1.00 0.00 C ATOM 1620 CG1 VAL B 9 -0.386 10.090 -1.142 1.00 0.00 C ATOM 1621 CG2 VAL B 9 1.795 10.851 -0.233 1.00 0.00 C ATOM 1622 OXT VAL B 9 0.513 6.553 -0.063 1.00 0.00 O ATOM 0 H VAL B 9 2.496 8.287 1.665 1.00 0.00 H new ATOM 0 HA VAL B 9 -0.307 9.377 1.508 1.00 0.00 H new ATOM 0 HB VAL B 9 1.396 8.840 -0.960 1.00 0.00 H new ATOM 0 HG11 VAL B 9 -0.087 10.606 -2.054 1.00 0.00 H new ATOM 0 HG12 VAL B 9 -1.011 9.234 -1.397 1.00 0.00 H new ATOM 0 HG13 VAL B 9 -0.949 10.773 -0.506 1.00 0.00 H new ATOM 0 HG21 VAL B 9 1.969 11.303 -1.209 1.00 0.00 H new ATOM 0 HG22 VAL B 9 1.319 11.578 0.424 1.00 0.00 H new ATOM 0 HG23 VAL B 9 2.747 10.541 0.198 1.00 0.00 H new TER 1632 VAL B 9