USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 801 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 11 THR OG1 : rot 94:sc= -5.64! USER MOD Set 1.2: A 56 GLN : amide:sc= -4.04 K(o=-9.7,f=-11!) USER MOD Single : A 5 GLN : amide:sc= -2.55! C(o=-2.6!,f=-5.5!) USER MOD Single : A 10 ASN : amide:sc= -4.32! C(o=-4.3!,f=-12!) USER MOD Single : A 14 HIS : no HE2:sc= -10.2! C(o=-10!,f=-15!) USER MOD Single : A 16 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.0381) USER MOD Single : A 42 THR OG1 : rot -102:sc= 0.148 USER MOD Single : A 43 TYR OH : rot -120:sc= -0.482 USER MOD Single : A 47 LYS NZ :NH3+ -151:sc= -0.259 (180deg=-1.8!) USER MOD Single : A 58 THR OG1 : rot -64:sc= 0.834 USER MOD Single : A 62 GLN : amide:sc= -2.75 K(o=-2.7,f=-0.86) USER MOD Single : A 63 ASN : amide:sc= -3.43! C(o=-3.4!,f=-5.5!) USER MOD Single : A 64 GLN : amide:sc= -6.53! C(o=-6.5!,f=-11!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 CYS SG : rot 39:sc= 0.271 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -31:sc= 0.0713 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0614 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 55 N GLN A 5 3.425 31.337 -11.007 1.00 0.00 N ATOM 56 CA GLN A 5 2.002 31.636 -11.340 1.00 0.00 C ATOM 57 C GLN A 5 1.299 32.281 -10.144 1.00 0.00 C ATOM 58 O GLN A 5 1.749 32.183 -9.019 1.00 0.00 O ATOM 59 CB GLN A 5 1.381 30.273 -11.654 1.00 0.00 C ATOM 60 CG GLN A 5 0.974 30.221 -13.129 1.00 0.00 C ATOM 61 CD GLN A 5 -0.502 29.836 -13.240 1.00 0.00 C ATOM 62 OE1 GLN A 5 -1.373 30.665 -13.063 1.00 0.00 O ATOM 63 NE2 GLN A 5 -0.826 28.604 -13.528 1.00 0.00 N ATOM 0 HA GLN A 5 1.910 32.333 -12.173 1.00 0.00 H new ATOM 0 HB2 GLN A 5 2.094 29.478 -11.435 1.00 0.00 H new ATOM 0 HB3 GLN A 5 0.511 30.104 -11.020 1.00 0.00 H new ATOM 0 HG2 GLN A 5 1.144 31.190 -13.598 1.00 0.00 H new ATOM 0 HG3 GLN A 5 1.590 29.497 -13.662 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -0.097 27.906 -13.677 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -1.808 28.339 -13.604 1.00 0.00 H new ATOM 72 N VAL A 6 0.193 32.934 -10.376 1.00 0.00 N ATOM 73 CA VAL A 6 -0.545 33.575 -9.252 1.00 0.00 C ATOM 74 C VAL A 6 -1.593 32.602 -8.713 1.00 0.00 C ATOM 75 O VAL A 6 -2.080 31.750 -9.430 1.00 0.00 O ATOM 76 CB VAL A 6 -1.215 34.807 -9.862 1.00 0.00 C ATOM 77 CG1 VAL A 6 -1.849 35.647 -8.753 1.00 0.00 C ATOM 78 CG2 VAL A 6 -0.171 35.648 -10.599 1.00 0.00 C ATOM 0 H VAL A 6 -0.231 33.051 -11.296 1.00 0.00 H new ATOM 0 HA VAL A 6 0.107 33.846 -8.421 1.00 0.00 H new ATOM 0 HB VAL A 6 -1.985 34.487 -10.563 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -2.326 36.525 -9.189 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -2.596 35.052 -8.227 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -1.078 35.964 -8.051 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -0.651 36.525 -11.033 1.00 0.00 H new ATOM 0 HG22 VAL A 6 0.601 35.966 -9.898 1.00 0.00 H new ATOM 0 HG23 VAL A 6 0.282 35.053 -11.392 1.00 0.00 H new ATOM 88 N VAL A 7 -1.941 32.712 -7.460 1.00 0.00 N ATOM 89 CA VAL A 7 -2.958 31.781 -6.888 1.00 0.00 C ATOM 90 C VAL A 7 -4.098 31.568 -7.887 1.00 0.00 C ATOM 91 O VAL A 7 -4.741 32.503 -8.321 1.00 0.00 O ATOM 92 CB VAL A 7 -3.475 32.469 -5.626 1.00 0.00 C ATOM 93 CG1 VAL A 7 -4.697 31.711 -5.102 1.00 0.00 C ATOM 94 CG2 VAL A 7 -2.379 32.468 -4.558 1.00 0.00 C ATOM 0 H VAL A 7 -1.568 33.403 -6.809 1.00 0.00 H new ATOM 0 HA VAL A 7 -2.536 30.800 -6.668 1.00 0.00 H new ATOM 0 HB VAL A 7 -3.753 33.497 -5.859 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.069 32.199 -4.201 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -5.478 31.709 -5.863 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -4.416 30.684 -4.869 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -2.748 32.959 -3.658 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -2.101 31.441 -4.323 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -1.506 33.004 -4.932 1.00 0.00 H new ATOM 104 N LEU A 8 -4.346 30.343 -8.258 1.00 0.00 N ATOM 105 CA LEU A 8 -5.438 30.062 -9.233 1.00 0.00 C ATOM 106 C LEU A 8 -6.799 30.096 -8.533 1.00 0.00 C ATOM 107 O LEU A 8 -6.883 29.957 -7.329 1.00 0.00 O ATOM 108 CB LEU A 8 -5.137 28.656 -9.754 1.00 0.00 C ATOM 109 CG LEU A 8 -4.511 28.739 -11.149 1.00 0.00 C ATOM 110 CD1 LEU A 8 -3.450 29.843 -11.177 1.00 0.00 C ATOM 111 CD2 LEU A 8 -3.854 27.400 -11.491 1.00 0.00 C ATOM 0 H LEU A 8 -3.839 29.522 -7.928 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.480 30.799 -10.035 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.459 28.144 -9.072 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.055 28.069 -9.792 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.288 28.966 -11.878 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -3.008 29.898 -12.172 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.913 30.799 -10.933 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.673 29.619 -10.446 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.408 27.457 -12.484 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.080 27.177 -10.757 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.606 26.611 -11.476 1.00 0.00 H new ATOM 123 N PRO A 9 -7.826 30.276 -9.320 1.00 0.00 N ATOM 124 CA PRO A 9 -9.202 30.325 -8.773 1.00 0.00 C ATOM 125 C PRO A 9 -9.677 28.914 -8.411 1.00 0.00 C ATOM 126 O PRO A 9 -9.608 28.502 -7.271 1.00 0.00 O ATOM 127 CB PRO A 9 -10.022 30.909 -9.922 1.00 0.00 C ATOM 128 CG PRO A 9 -9.250 30.587 -11.166 1.00 0.00 C ATOM 129 CD PRO A 9 -7.798 30.453 -10.776 1.00 0.00 C ATOM 0 HA PRO A 9 -9.287 30.915 -7.860 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -11.020 30.471 -9.955 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -10.149 31.985 -9.806 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -9.614 29.662 -11.614 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -9.376 31.373 -11.910 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -7.331 29.602 -11.271 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -7.228 31.338 -11.058 1.00 0.00 H new ATOM 137 N ASN A 10 -10.153 28.173 -9.371 1.00 0.00 N ATOM 138 CA ASN A 10 -10.628 26.789 -9.082 1.00 0.00 C ATOM 139 C ASN A 10 -9.994 25.807 -10.066 1.00 0.00 C ATOM 140 O ASN A 10 -10.676 25.069 -10.748 1.00 0.00 O ATOM 141 CB ASN A 10 -12.139 26.841 -9.286 1.00 0.00 C ATOM 142 CG ASN A 10 -12.451 27.575 -10.592 1.00 0.00 C ATOM 143 OD1 ASN A 10 -11.556 27.910 -11.341 1.00 0.00 O ATOM 144 ND2 ASN A 10 -13.691 27.837 -10.900 1.00 0.00 N ATOM 0 H ASN A 10 -10.234 28.465 -10.345 1.00 0.00 H new ATOM 0 HA ASN A 10 -10.362 26.459 -8.078 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -12.548 25.831 -9.317 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -12.613 27.351 -8.447 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -13.909 28.323 -11.770 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -14.443 27.556 -10.271 1.00 0.00 H new ATOM 151 N THR A 11 -8.695 25.798 -10.156 1.00 0.00 N ATOM 152 CA THR A 11 -8.028 24.869 -11.112 1.00 0.00 C ATOM 153 C THR A 11 -6.879 24.136 -10.418 1.00 0.00 C ATOM 154 O THR A 11 -6.342 24.599 -9.431 1.00 0.00 O ATOM 155 CB THR A 11 -7.489 25.754 -12.245 1.00 0.00 C ATOM 156 OG1 THR A 11 -6.164 26.159 -11.936 1.00 0.00 O ATOM 157 CG2 THR A 11 -8.370 26.997 -12.431 1.00 0.00 C ATOM 0 H THR A 11 -8.067 26.390 -9.612 1.00 0.00 H new ATOM 0 HA THR A 11 -8.716 24.112 -11.487 1.00 0.00 H new ATOM 0 HB THR A 11 -7.498 25.179 -13.171 1.00 0.00 H new ATOM 0 HG1 THR A 11 -5.528 25.537 -12.346 1.00 0.00 H new ATOM 0 HG21 THR A 11 -7.969 27.609 -13.239 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.386 26.689 -12.679 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.381 27.576 -11.508 1.00 0.00 H new ATOM 165 N ALA A 12 -6.487 23.000 -10.931 1.00 0.00 N ATOM 166 CA ALA A 12 -5.363 22.249 -10.302 1.00 0.00 C ATOM 167 C ALA A 12 -4.490 21.629 -11.390 1.00 0.00 C ATOM 168 O ALA A 12 -4.901 21.507 -12.523 1.00 0.00 O ATOM 169 CB ALA A 12 -6.025 21.164 -9.452 1.00 0.00 C ATOM 0 H ALA A 12 -6.896 22.561 -11.756 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.720 22.889 -9.697 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.257 20.570 -8.957 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.663 21.629 -8.701 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.628 20.518 -10.091 1.00 0.00 H new ATOM 175 N LEU A 13 -3.288 21.245 -11.069 1.00 0.00 N ATOM 176 CA LEU A 13 -2.409 20.646 -12.116 1.00 0.00 C ATOM 177 C LEU A 13 -1.731 19.374 -11.606 1.00 0.00 C ATOM 178 O LEU A 13 -1.567 19.176 -10.421 1.00 0.00 O ATOM 179 CB LEU A 13 -1.370 21.722 -12.429 1.00 0.00 C ATOM 180 CG LEU A 13 -0.372 21.838 -11.277 1.00 0.00 C ATOM 181 CD1 LEU A 13 1.047 21.669 -11.818 1.00 0.00 C ATOM 182 CD2 LEU A 13 -0.508 23.214 -10.628 1.00 0.00 C ATOM 0 H LEU A 13 -2.877 21.317 -10.138 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.978 20.355 -12.999 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.845 21.475 -13.352 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.864 22.680 -12.590 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.574 21.064 -10.537 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.761 21.751 -10.999 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.144 20.690 -12.286 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.250 22.445 -12.556 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.202 23.300 -9.806 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.302 23.987 -11.368 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.521 23.338 -10.246 1.00 0.00 H new ATOM 194 N HIS A 14 -1.336 18.510 -12.502 1.00 0.00 N ATOM 195 CA HIS A 14 -0.663 17.249 -12.079 1.00 0.00 C ATOM 196 C HIS A 14 0.856 17.420 -12.152 1.00 0.00 C ATOM 197 O HIS A 14 1.401 17.737 -13.189 1.00 0.00 O ATOM 198 CB HIS A 14 -1.112 16.192 -13.090 1.00 0.00 C ATOM 199 CG HIS A 14 -2.609 16.060 -13.066 1.00 0.00 C ATOM 200 ND1 HIS A 14 -3.249 14.866 -13.359 1.00 0.00 N ATOM 201 CD2 HIS A 14 -3.606 16.961 -12.797 1.00 0.00 C ATOM 202 CE1 HIS A 14 -4.572 15.080 -13.260 1.00 0.00 C ATOM 203 NE2 HIS A 14 -4.846 16.342 -12.920 1.00 0.00 N ATOM 0 H HIS A 14 -1.451 18.623 -13.509 1.00 0.00 H new ATOM 0 HA HIS A 14 -0.918 16.974 -11.056 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -0.779 16.469 -14.090 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -0.650 15.233 -12.855 1.00 0.00 H new ATOM 0 HD1 HIS A 14 -2.798 13.985 -13.605 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -3.452 17.996 -12.530 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -5.323 14.323 -13.434 1.00 0.00 H new ATOM 211 N LEU A 15 1.545 17.204 -11.070 1.00 0.00 N ATOM 212 CA LEU A 15 3.026 17.345 -11.108 1.00 0.00 C ATOM 213 C LEU A 15 3.675 16.061 -10.595 1.00 0.00 C ATOM 214 O LEU A 15 3.124 15.361 -9.768 1.00 0.00 O ATOM 215 CB LEU A 15 3.388 18.553 -10.224 1.00 0.00 C ATOM 216 CG LEU A 15 2.349 18.775 -9.118 1.00 0.00 C ATOM 217 CD1 LEU A 15 2.925 19.739 -8.084 1.00 0.00 C ATOM 218 CD2 LEU A 15 1.079 19.390 -9.709 1.00 0.00 C ATOM 0 H LEU A 15 1.152 16.938 -10.167 1.00 0.00 H new ATOM 0 HA LEU A 15 3.390 17.509 -12.122 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.369 18.396 -9.776 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.460 19.448 -10.842 1.00 0.00 H new ATOM 0 HG LEU A 15 2.107 17.818 -8.655 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.194 19.904 -7.293 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.833 19.314 -7.656 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.161 20.689 -8.564 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.347 19.544 -8.917 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.320 20.347 -10.172 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.665 18.718 -10.460 1.00 0.00 H new ATOM 230 N LYS A 16 4.833 15.735 -11.097 1.00 0.00 N ATOM 231 CA LYS A 16 5.511 14.482 -10.659 1.00 0.00 C ATOM 232 C LYS A 16 6.540 14.777 -9.570 1.00 0.00 C ATOM 233 O LYS A 16 7.489 15.507 -9.778 1.00 0.00 O ATOM 234 CB LYS A 16 6.196 13.942 -11.912 1.00 0.00 C ATOM 235 CG LYS A 16 5.635 12.557 -12.242 1.00 0.00 C ATOM 236 CD LYS A 16 5.859 12.254 -13.726 1.00 0.00 C ATOM 237 CE LYS A 16 6.868 11.111 -13.868 1.00 0.00 C ATOM 238 NZ LYS A 16 6.106 9.871 -13.540 1.00 0.00 N ATOM 0 H LYS A 16 5.340 16.282 -11.792 1.00 0.00 H new ATOM 0 HA LYS A 16 4.807 13.765 -10.236 1.00 0.00 H new ATOM 0 HB2 LYS A 16 6.034 14.621 -12.749 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.273 13.882 -11.754 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.123 11.800 -11.628 1.00 0.00 H new ATOM 0 HG3 LYS A 16 4.571 12.519 -12.009 1.00 0.00 H new ATOM 0 HD2 LYS A 16 4.916 11.981 -14.199 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.227 13.143 -14.238 1.00 0.00 H new ATOM 0 HE2 LYS A 16 7.274 11.068 -14.879 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.712 11.245 -13.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 6.601 9.348 -12.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.152 10.126 -13.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.033 9.274 -14.388 1.00 0.00 H new ATOM 252 N ALA A 17 6.361 14.205 -8.414 1.00 0.00 N ATOM 253 CA ALA A 17 7.326 14.443 -7.308 1.00 0.00 C ATOM 254 C ALA A 17 8.599 13.628 -7.532 1.00 0.00 C ATOM 255 O ALA A 17 8.590 12.412 -7.509 1.00 0.00 O ATOM 256 CB ALA A 17 6.607 13.975 -6.043 1.00 0.00 C ATOM 0 H ALA A 17 5.586 13.582 -8.187 1.00 0.00 H new ATOM 0 HA ALA A 17 7.626 15.489 -7.242 1.00 0.00 H new ATOM 0 HB1 ALA A 17 7.257 14.119 -5.180 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.693 14.553 -5.909 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.357 12.918 -6.136 1.00 0.00 H new ATOM 262 N LEU A 18 9.696 14.298 -7.738 1.00 0.00 N ATOM 263 CA LEU A 18 10.984 13.586 -7.953 1.00 0.00 C ATOM 264 C LEU A 18 11.758 13.546 -6.633 1.00 0.00 C ATOM 265 O LEU A 18 12.365 14.518 -6.229 1.00 0.00 O ATOM 266 CB LEU A 18 11.728 14.434 -8.986 1.00 0.00 C ATOM 267 CG LEU A 18 10.909 14.509 -10.273 1.00 0.00 C ATOM 268 CD1 LEU A 18 11.584 15.473 -11.250 1.00 0.00 C ATOM 269 CD2 LEU A 18 10.825 13.119 -10.906 1.00 0.00 C ATOM 0 H LEU A 18 9.756 15.316 -7.767 1.00 0.00 H new ATOM 0 HA LEU A 18 10.855 12.558 -8.292 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.899 15.436 -8.593 1.00 0.00 H new ATOM 0 HB3 LEU A 18 12.707 14.000 -9.191 1.00 0.00 H new ATOM 0 HG LEU A 18 9.905 14.866 -10.044 1.00 0.00 H new ATOM 0 HD11 LEU A 18 11.000 15.527 -12.169 1.00 0.00 H new ATOM 0 HD12 LEU A 18 11.645 16.464 -10.800 1.00 0.00 H new ATOM 0 HD13 LEU A 18 12.588 15.116 -11.478 1.00 0.00 H new ATOM 0 HD21 LEU A 18 10.241 13.172 -11.825 1.00 0.00 H new ATOM 0 HD22 LEU A 18 11.829 12.762 -11.135 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.345 12.431 -10.210 1.00 0.00 H new ATOM 281 N LEU A 19 11.725 12.436 -5.945 1.00 0.00 N ATOM 282 CA LEU A 19 12.441 12.348 -4.640 1.00 0.00 C ATOM 283 C LEU A 19 12.722 10.886 -4.275 1.00 0.00 C ATOM 284 O LEU A 19 11.928 10.005 -4.543 1.00 0.00 O ATOM 285 CB LEU A 19 11.461 12.960 -3.636 1.00 0.00 C ATOM 286 CG LEU A 19 12.222 13.707 -2.542 1.00 0.00 C ATOM 287 CD1 LEU A 19 13.023 12.712 -1.701 1.00 0.00 C ATOM 288 CD2 LEU A 19 13.173 14.722 -3.179 1.00 0.00 C ATOM 0 H LEU A 19 11.234 11.588 -6.230 1.00 0.00 H new ATOM 0 HA LEU A 19 13.405 12.857 -4.659 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.783 13.643 -4.149 1.00 0.00 H new ATOM 0 HB3 LEU A 19 10.848 12.176 -3.192 1.00 0.00 H new ATOM 0 HG LEU A 19 11.511 14.230 -1.902 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.565 13.248 -0.922 1.00 0.00 H new ATOM 0 HD12 LEU A 19 12.344 11.993 -1.242 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.732 12.185 -2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.715 15.254 -2.397 1.00 0.00 H new ATOM 0 HD22 LEU A 19 13.883 14.202 -3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 19 12.600 15.435 -3.772 1.00 0.00 H new ATOM 300 N ASP A 20 13.838 10.623 -3.648 1.00 0.00 N ATOM 301 CA ASP A 20 14.156 9.223 -3.245 1.00 0.00 C ATOM 302 C ASP A 20 13.523 8.939 -1.879 1.00 0.00 C ATOM 303 O ASP A 20 14.016 9.368 -0.856 1.00 0.00 O ATOM 304 CB ASP A 20 15.681 9.165 -3.156 1.00 0.00 C ATOM 305 CG ASP A 20 16.173 10.215 -2.158 1.00 0.00 C ATOM 306 OD1 ASP A 20 15.646 11.315 -2.178 1.00 0.00 O ATOM 307 OD2 ASP A 20 17.069 9.902 -1.391 1.00 0.00 O ATOM 0 H ASP A 20 14.542 11.317 -3.398 1.00 0.00 H new ATOM 0 HA ASP A 20 13.772 8.483 -3.948 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.000 8.171 -2.842 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.121 9.346 -4.137 1.00 0.00 H new ATOM 312 N PHE A 21 12.426 8.236 -1.858 1.00 0.00 N ATOM 313 CA PHE A 21 11.750 7.946 -0.560 1.00 0.00 C ATOM 314 C PHE A 21 11.606 6.438 -0.347 1.00 0.00 C ATOM 315 O PHE A 21 11.354 5.692 -1.271 1.00 0.00 O ATOM 316 CB PHE A 21 10.369 8.591 -0.687 1.00 0.00 C ATOM 317 CG PHE A 21 10.073 9.402 0.549 1.00 0.00 C ATOM 318 CD1 PHE A 21 9.475 8.791 1.655 1.00 0.00 C ATOM 319 CD2 PHE A 21 10.397 10.763 0.589 1.00 0.00 C ATOM 320 CE1 PHE A 21 9.203 9.540 2.806 1.00 0.00 C ATOM 321 CE2 PHE A 21 10.125 11.514 1.738 1.00 0.00 C ATOM 322 CZ PHE A 21 9.529 10.902 2.848 1.00 0.00 C ATOM 0 H PHE A 21 11.967 7.849 -2.683 1.00 0.00 H new ATOM 0 HA PHE A 21 12.317 8.331 0.288 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.335 9.229 -1.570 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.608 7.822 -0.820 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.223 7.741 1.622 1.00 0.00 H new ATOM 0 HD2 PHE A 21 10.857 11.234 -0.267 1.00 0.00 H new ATOM 0 HE1 PHE A 21 8.742 9.068 3.661 1.00 0.00 H new ATOM 0 HE2 PHE A 21 10.374 12.564 1.769 1.00 0.00 H new ATOM 0 HZ PHE A 21 9.321 11.480 3.736 1.00 0.00 H new ATOM 434 N VAL A 29 9.758 4.918 -3.090 1.00 0.00 N ATOM 435 CA VAL A 29 9.522 5.762 -4.300 1.00 0.00 C ATOM 436 C VAL A 29 10.869 6.295 -4.801 1.00 0.00 C ATOM 437 O VAL A 29 11.691 6.745 -4.028 1.00 0.00 O ATOM 438 CB VAL A 29 8.575 6.909 -3.859 1.00 0.00 C ATOM 439 CG1 VAL A 29 7.700 6.460 -2.684 1.00 0.00 C ATOM 440 CG2 VAL A 29 9.381 8.137 -3.426 1.00 0.00 C ATOM 0 HA VAL A 29 9.067 5.205 -5.119 1.00 0.00 H new ATOM 0 HB VAL A 29 7.945 7.166 -4.711 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.042 7.277 -2.387 1.00 0.00 H new ATOM 0 HG12 VAL A 29 7.100 5.601 -2.985 1.00 0.00 H new ATOM 0 HG13 VAL A 29 8.335 6.182 -1.843 1.00 0.00 H new ATOM 0 HG21 VAL A 29 8.699 8.931 -3.120 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.027 7.872 -2.589 1.00 0.00 H new ATOM 0 HG23 VAL A 29 9.991 8.484 -4.260 1.00 0.00 H new ATOM 450 N VAL A 30 11.113 6.236 -6.081 1.00 0.00 N ATOM 451 CA VAL A 30 12.419 6.727 -6.604 1.00 0.00 C ATOM 452 C VAL A 30 12.198 7.761 -7.708 1.00 0.00 C ATOM 453 O VAL A 30 12.096 7.430 -8.872 1.00 0.00 O ATOM 454 CB VAL A 30 13.116 5.485 -7.161 1.00 0.00 C ATOM 455 CG1 VAL A 30 13.460 4.535 -6.012 1.00 0.00 C ATOM 456 CG2 VAL A 30 12.184 4.774 -8.144 1.00 0.00 C ATOM 0 H VAL A 30 10.469 5.872 -6.783 1.00 0.00 H new ATOM 0 HA VAL A 30 13.013 7.216 -5.832 1.00 0.00 H new ATOM 0 HB VAL A 30 14.030 5.783 -7.675 1.00 0.00 H new ATOM 0 HG11 VAL A 30 13.957 3.649 -6.408 1.00 0.00 H new ATOM 0 HG12 VAL A 30 14.123 5.039 -5.309 1.00 0.00 H new ATOM 0 HG13 VAL A 30 12.545 4.239 -5.499 1.00 0.00 H new ATOM 0 HG21 VAL A 30 12.681 3.889 -8.541 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.270 4.477 -7.629 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.936 5.449 -8.963 1.00 0.00 H new ATOM 466 N ALA A 31 12.130 9.013 -7.352 1.00 0.00 N ATOM 467 CA ALA A 31 11.923 10.066 -8.384 1.00 0.00 C ATOM 468 C ALA A 31 10.860 9.619 -9.390 1.00 0.00 C ATOM 469 O ALA A 31 11.130 9.477 -10.566 1.00 0.00 O ATOM 470 CB ALA A 31 13.283 10.214 -9.068 1.00 0.00 C ATOM 0 H ALA A 31 12.209 9.352 -6.393 1.00 0.00 H new ATOM 0 HA ALA A 31 11.576 11.006 -7.955 1.00 0.00 H new ATOM 0 HB1 ALA A 31 13.218 10.974 -9.846 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.030 10.511 -8.332 1.00 0.00 H new ATOM 0 HB3 ALA A 31 13.571 9.262 -9.514 1.00 0.00 H new ATOM 476 N GLY A 32 9.653 9.389 -8.943 1.00 0.00 N ATOM 477 CA GLY A 32 8.593 8.948 -9.892 1.00 0.00 C ATOM 478 C GLY A 32 7.206 9.149 -9.277 1.00 0.00 C ATOM 479 O GLY A 32 6.255 8.496 -9.656 1.00 0.00 O ATOM 0 H GLY A 32 9.359 9.487 -7.971 1.00 0.00 H new ATOM 0 HA2 GLY A 32 8.671 9.513 -10.821 1.00 0.00 H new ATOM 0 HA3 GLY A 32 8.737 7.897 -10.144 1.00 0.00 H new ATOM 483 N ASP A 33 7.071 10.047 -8.339 1.00 0.00 N ATOM 484 CA ASP A 33 5.725 10.271 -7.731 1.00 0.00 C ATOM 485 C ASP A 33 4.958 11.328 -8.530 1.00 0.00 C ATOM 486 O ASP A 33 5.537 12.092 -9.276 1.00 0.00 O ATOM 487 CB ASP A 33 5.996 10.766 -6.309 1.00 0.00 C ATOM 488 CG ASP A 33 6.740 9.686 -5.522 1.00 0.00 C ATOM 489 OD1 ASP A 33 7.840 9.339 -5.922 1.00 0.00 O ATOM 490 OD2 ASP A 33 6.196 9.221 -4.534 1.00 0.00 O ATOM 0 H ASP A 33 7.823 10.629 -7.970 1.00 0.00 H new ATOM 0 HA ASP A 33 5.120 9.365 -7.732 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.587 11.681 -6.338 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.057 11.009 -5.813 1.00 0.00 H new ATOM 495 N GLU A 34 3.662 11.378 -8.382 1.00 0.00 N ATOM 496 CA GLU A 34 2.867 12.389 -9.137 1.00 0.00 C ATOM 497 C GLU A 34 1.506 12.611 -8.470 1.00 0.00 C ATOM 498 O GLU A 34 0.795 11.675 -8.161 1.00 0.00 O ATOM 499 CB GLU A 34 2.695 11.791 -10.536 1.00 0.00 C ATOM 500 CG GLU A 34 1.639 10.683 -10.498 1.00 0.00 C ATOM 501 CD GLU A 34 1.547 10.016 -11.872 1.00 0.00 C ATOM 502 OE1 GLU A 34 2.538 9.450 -12.303 1.00 0.00 O ATOM 503 OE2 GLU A 34 0.485 10.079 -12.469 1.00 0.00 O ATOM 0 H GLU A 34 3.120 10.765 -7.773 1.00 0.00 H new ATOM 0 HA GLU A 34 3.359 13.361 -9.166 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.396 12.568 -11.240 1.00 0.00 H new ATOM 0 HB3 GLU A 34 3.645 11.389 -10.890 1.00 0.00 H new ATOM 0 HG2 GLU A 34 1.899 9.944 -9.740 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.671 11.099 -10.218 1.00 0.00 H new ATOM 510 N TRP A 35 1.138 13.845 -8.253 1.00 0.00 N ATOM 511 CA TRP A 35 -0.178 14.130 -7.611 1.00 0.00 C ATOM 512 C TRP A 35 -0.777 15.418 -8.181 1.00 0.00 C ATOM 513 O TRP A 35 -0.132 16.147 -8.909 1.00 0.00 O ATOM 514 CB TRP A 35 0.126 14.283 -6.116 1.00 0.00 C ATOM 515 CG TRP A 35 0.717 15.628 -5.839 1.00 0.00 C ATOM 516 CD1 TRP A 35 0.066 16.654 -5.243 1.00 0.00 C ATOM 517 CD2 TRP A 35 2.060 16.107 -6.128 1.00 0.00 C ATOM 518 NE1 TRP A 35 0.926 17.732 -5.145 1.00 0.00 N ATOM 519 CE2 TRP A 35 2.167 17.445 -5.678 1.00 0.00 C ATOM 520 CE3 TRP A 35 3.186 15.518 -6.731 1.00 0.00 C ATOM 521 CZ2 TRP A 35 3.349 18.171 -5.821 1.00 0.00 C ATOM 522 CZ3 TRP A 35 4.376 16.247 -6.878 1.00 0.00 C ATOM 523 CH2 TRP A 35 4.457 17.569 -6.423 1.00 0.00 C ATOM 0 H TRP A 35 1.691 14.668 -8.492 1.00 0.00 H new ATOM 0 HA TRP A 35 -0.905 13.338 -7.793 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -0.789 14.155 -5.537 1.00 0.00 H new ATOM 0 HB3 TRP A 35 0.817 13.503 -5.797 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -0.958 16.634 -4.900 1.00 0.00 H new ATOM 0 HE1 TRP A 35 0.675 18.629 -4.730 1.00 0.00 H new ATOM 0 HE3 TRP A 35 3.134 14.498 -7.083 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 3.408 19.190 -5.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 5.234 15.786 -7.345 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.377 18.124 -6.538 1.00 0.00 H new ATOM 534 N LEU A 36 -2.007 15.704 -7.856 1.00 0.00 N ATOM 535 CA LEU A 36 -2.643 16.945 -8.382 1.00 0.00 C ATOM 536 C LEU A 36 -2.404 18.106 -7.416 1.00 0.00 C ATOM 537 O LEU A 36 -2.179 17.914 -6.238 1.00 0.00 O ATOM 538 CB LEU A 36 -4.135 16.617 -8.481 1.00 0.00 C ATOM 539 CG LEU A 36 -4.942 17.907 -8.656 1.00 0.00 C ATOM 540 CD1 LEU A 36 -4.808 18.402 -10.096 1.00 0.00 C ATOM 541 CD2 LEU A 36 -6.415 17.627 -8.353 1.00 0.00 C ATOM 0 H LEU A 36 -2.598 15.134 -7.251 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.233 17.246 -9.346 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.314 15.949 -9.323 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.461 16.093 -7.583 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.564 18.668 -7.973 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -5.382 19.320 -10.220 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.759 18.598 -10.317 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.187 17.642 -10.779 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.992 18.543 -8.477 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.789 16.867 -9.039 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.514 17.271 -7.328 1.00 0.00 H new ATOM 553 N PHE A 37 -2.455 19.312 -7.908 1.00 0.00 N ATOM 554 CA PHE A 37 -2.236 20.493 -7.027 1.00 0.00 C ATOM 555 C PHE A 37 -3.329 21.533 -7.288 1.00 0.00 C ATOM 556 O PHE A 37 -3.378 22.145 -8.336 1.00 0.00 O ATOM 557 CB PHE A 37 -0.862 21.032 -7.434 1.00 0.00 C ATOM 558 CG PHE A 37 -0.304 21.910 -6.337 1.00 0.00 C ATOM 559 CD1 PHE A 37 -0.934 23.119 -6.024 1.00 0.00 C ATOM 560 CD2 PHE A 37 0.848 21.521 -5.643 1.00 0.00 C ATOM 561 CE1 PHE A 37 -0.412 23.940 -5.017 1.00 0.00 C ATOM 562 CE2 PHE A 37 1.370 22.342 -4.635 1.00 0.00 C ATOM 563 CZ PHE A 37 0.740 23.552 -4.323 1.00 0.00 C ATOM 0 H PHE A 37 -2.640 19.532 -8.887 1.00 0.00 H new ATOM 0 HA PHE A 37 -2.274 20.247 -5.966 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.181 20.204 -7.630 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -0.945 21.602 -8.360 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.823 23.419 -6.559 1.00 0.00 H new ATOM 0 HD2 PHE A 37 1.334 20.588 -5.885 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -0.899 24.873 -4.776 1.00 0.00 H new ATOM 0 HE2 PHE A 37 2.258 22.041 -4.099 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.142 24.186 -3.547 1.00 0.00 H new ATOM 573 N GLU A 38 -4.212 21.729 -6.346 1.00 0.00 N ATOM 574 CA GLU A 38 -5.307 22.723 -6.544 1.00 0.00 C ATOM 575 C GLU A 38 -4.876 24.092 -6.015 1.00 0.00 C ATOM 576 O GLU A 38 -4.297 24.202 -4.953 1.00 0.00 O ATOM 577 CB GLU A 38 -6.484 22.175 -5.733 1.00 0.00 C ATOM 578 CG GLU A 38 -7.497 23.292 -5.470 1.00 0.00 C ATOM 579 CD GLU A 38 -7.102 24.051 -4.201 1.00 0.00 C ATOM 580 OE1 GLU A 38 -6.212 23.587 -3.508 1.00 0.00 O ATOM 581 OE2 GLU A 38 -7.699 25.083 -3.943 1.00 0.00 O ATOM 0 H GLU A 38 -4.223 21.244 -5.449 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.564 22.858 -7.595 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.962 21.358 -6.274 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.127 21.765 -4.788 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.530 23.975 -6.319 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.497 22.872 -5.359 1.00 0.00 H new ATOM 588 N GLY A 39 -5.151 25.136 -6.745 1.00 0.00 N ATOM 589 CA GLY A 39 -4.750 26.492 -6.272 1.00 0.00 C ATOM 590 C GLY A 39 -3.223 26.589 -6.241 1.00 0.00 C ATOM 591 O GLY A 39 -2.652 27.053 -5.274 1.00 0.00 O ATOM 0 H GLY A 39 -5.633 25.111 -7.644 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -5.160 27.256 -6.933 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -5.157 26.678 -5.278 1.00 0.00 H new ATOM 595 N PRO A 40 -2.610 26.137 -7.302 1.00 0.00 N ATOM 596 CA PRO A 40 -1.129 26.162 -7.397 1.00 0.00 C ATOM 597 C PRO A 40 -0.620 27.605 -7.443 1.00 0.00 C ATOM 598 O PRO A 40 0.108 28.033 -6.574 1.00 0.00 O ATOM 599 CB PRO A 40 -0.841 25.419 -8.702 1.00 0.00 C ATOM 600 CG PRO A 40 -2.097 25.556 -9.500 1.00 0.00 C ATOM 601 CD PRO A 40 -3.227 25.577 -8.508 1.00 0.00 C ATOM 0 HA PRO A 40 -0.632 25.703 -6.542 1.00 0.00 H new ATOM 0 HB2 PRO A 40 0.011 25.853 -9.226 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -0.601 24.372 -8.517 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -2.083 26.470 -10.093 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -2.207 24.726 -10.197 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -4.057 26.191 -8.857 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.624 24.578 -8.329 1.00 0.00 H new ATOM 609 N GLY A 41 -1.008 28.355 -8.438 1.00 0.00 N ATOM 610 CA GLY A 41 -0.558 29.775 -8.531 1.00 0.00 C ATOM 611 C GLY A 41 0.936 29.889 -8.208 1.00 0.00 C ATOM 612 O GLY A 41 1.776 29.835 -9.084 1.00 0.00 O ATOM 0 H GLY A 41 -1.619 28.045 -9.194 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -0.749 30.158 -9.533 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -1.133 30.391 -7.839 1.00 0.00 H new ATOM 616 N THR A 42 1.270 30.060 -6.957 1.00 0.00 N ATOM 617 CA THR A 42 2.706 30.195 -6.570 1.00 0.00 C ATOM 618 C THR A 42 3.461 28.867 -6.722 1.00 0.00 C ATOM 619 O THR A 42 4.623 28.771 -6.379 1.00 0.00 O ATOM 620 CB THR A 42 2.678 30.624 -5.103 1.00 0.00 C ATOM 621 OG1 THR A 42 1.600 29.980 -4.441 1.00 0.00 O ATOM 622 CG2 THR A 42 2.499 32.141 -5.017 1.00 0.00 C ATOM 0 H THR A 42 0.608 30.112 -6.183 1.00 0.00 H new ATOM 0 HA THR A 42 3.224 30.911 -7.208 1.00 0.00 H new ATOM 0 HB THR A 42 3.616 30.343 -4.625 1.00 0.00 H new ATOM 0 HG1 THR A 42 0.857 30.611 -4.335 1.00 0.00 H new ATOM 0 HG21 THR A 42 2.479 32.446 -3.971 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.329 32.635 -5.523 1.00 0.00 H new ATOM 0 HG23 THR A 42 1.562 32.424 -5.496 1.00 0.00 H new ATOM 630 N TYR A 43 2.830 27.841 -7.230 1.00 0.00 N ATOM 631 CA TYR A 43 3.550 26.544 -7.384 1.00 0.00 C ATOM 632 C TYR A 43 4.633 26.671 -8.461 1.00 0.00 C ATOM 633 O TYR A 43 4.346 26.819 -9.633 1.00 0.00 O ATOM 634 CB TYR A 43 2.480 25.534 -7.816 1.00 0.00 C ATOM 635 CG TYR A 43 3.147 24.350 -8.480 1.00 0.00 C ATOM 636 CD1 TYR A 43 4.032 23.547 -7.751 1.00 0.00 C ATOM 637 CD2 TYR A 43 2.895 24.066 -9.829 1.00 0.00 C ATOM 638 CE1 TYR A 43 4.664 22.460 -8.369 1.00 0.00 C ATOM 639 CE2 TYR A 43 3.524 22.978 -10.445 1.00 0.00 C ATOM 640 CZ TYR A 43 4.408 22.176 -9.715 1.00 0.00 C ATOM 641 OH TYR A 43 5.032 21.106 -10.323 1.00 0.00 O ATOM 0 H TYR A 43 1.859 27.844 -7.541 1.00 0.00 H new ATOM 0 HA TYR A 43 4.045 26.237 -6.463 1.00 0.00 H new ATOM 0 HB2 TYR A 43 1.905 25.204 -6.951 1.00 0.00 H new ATOM 0 HB3 TYR A 43 1.778 26.004 -8.505 1.00 0.00 H new ATOM 0 HD1 TYR A 43 4.228 23.765 -6.712 1.00 0.00 H new ATOM 0 HD2 TYR A 43 2.215 24.687 -10.393 1.00 0.00 H new ATOM 0 HE1 TYR A 43 5.348 21.842 -7.807 1.00 0.00 H new ATOM 0 HE2 TYR A 43 3.327 22.758 -11.484 1.00 0.00 H new ATOM 0 HH TYR A 43 5.567 21.426 -11.079 1.00 0.00 H new ATOM 651 N ILE A 44 5.875 26.605 -8.070 1.00 0.00 N ATOM 652 CA ILE A 44 6.979 26.711 -9.065 1.00 0.00 C ATOM 653 C ILE A 44 7.578 25.326 -9.322 1.00 0.00 C ATOM 654 O ILE A 44 7.716 24.530 -8.413 1.00 0.00 O ATOM 655 CB ILE A 44 8.007 27.641 -8.412 1.00 0.00 C ATOM 656 CG1 ILE A 44 7.574 29.099 -8.613 1.00 0.00 C ATOM 657 CG2 ILE A 44 9.388 27.424 -9.044 1.00 0.00 C ATOM 658 CD1 ILE A 44 7.878 29.537 -10.048 1.00 0.00 C ATOM 0 H ILE A 44 6.174 26.482 -7.103 1.00 0.00 H new ATOM 0 HA ILE A 44 6.645 27.095 -10.029 1.00 0.00 H new ATOM 0 HB ILE A 44 8.065 27.419 -7.346 1.00 0.00 H new ATOM 0 HG12 ILE A 44 6.508 29.203 -8.409 1.00 0.00 H new ATOM 0 HG13 ILE A 44 8.098 29.744 -7.907 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.112 28.089 -8.574 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.697 26.389 -8.897 1.00 0.00 H new ATOM 0 HG23 ILE A 44 9.338 27.639 -10.111 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.569 30.573 -10.185 1.00 0.00 H new ATOM 0 HD12 ILE A 44 8.948 29.450 -10.236 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.334 28.900 -10.746 1.00 0.00 H new ATOM 670 N PRO A 45 7.918 25.086 -10.557 1.00 0.00 N ATOM 671 CA PRO A 45 8.514 23.783 -10.942 1.00 0.00 C ATOM 672 C PRO A 45 9.929 23.663 -10.372 1.00 0.00 C ATOM 673 O PRO A 45 10.889 24.106 -10.970 1.00 0.00 O ATOM 674 CB PRO A 45 8.535 23.837 -12.468 1.00 0.00 C ATOM 675 CG PRO A 45 8.542 25.294 -12.800 1.00 0.00 C ATOM 676 CD PRO A 45 7.786 25.994 -11.702 1.00 0.00 C ATOM 0 HA PRO A 45 7.961 22.923 -10.564 1.00 0.00 H new ATOM 0 HB2 PRO A 45 9.416 23.336 -12.869 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.664 23.339 -12.893 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.563 25.670 -12.867 1.00 0.00 H new ATOM 0 HG3 PRO A 45 8.072 25.472 -13.767 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.210 26.975 -11.486 1.00 0.00 H new ATOM 0 HD3 PRO A 45 6.741 26.150 -11.971 1.00 0.00 H new ATOM 684 N ARG A 46 10.064 23.075 -9.215 1.00 0.00 N ATOM 685 CA ARG A 46 11.421 22.937 -8.605 1.00 0.00 C ATOM 686 C ARG A 46 11.947 21.511 -8.779 1.00 0.00 C ATOM 687 O ARG A 46 11.194 20.579 -8.986 1.00 0.00 O ATOM 688 CB ARG A 46 11.229 23.255 -7.123 1.00 0.00 C ATOM 689 CG ARG A 46 12.516 23.861 -6.563 1.00 0.00 C ATOM 690 CD ARG A 46 12.609 25.332 -6.977 1.00 0.00 C ATOM 691 NE ARG A 46 13.757 25.394 -7.921 1.00 0.00 N ATOM 692 CZ ARG A 46 14.746 26.215 -7.692 1.00 0.00 C ATOM 693 NH1 ARG A 46 14.665 27.460 -8.073 1.00 0.00 N ATOM 694 NH2 ARG A 46 15.814 25.791 -7.074 1.00 0.00 N ATOM 0 H ARG A 46 9.298 22.685 -8.666 1.00 0.00 H new ATOM 0 HA ARG A 46 12.146 23.601 -9.076 1.00 0.00 H new ATOM 0 HB2 ARG A 46 10.400 23.951 -6.993 1.00 0.00 H new ATOM 0 HB3 ARG A 46 10.973 22.348 -6.575 1.00 0.00 H new ATOM 0 HG2 ARG A 46 12.528 23.776 -5.476 1.00 0.00 H new ATOM 0 HG3 ARG A 46 13.381 23.312 -6.935 1.00 0.00 H new ATOM 0 HD2 ARG A 46 11.688 25.667 -7.453 1.00 0.00 H new ATOM 0 HD3 ARG A 46 12.773 25.976 -6.113 1.00 0.00 H new ATOM 0 HE ARG A 46 13.771 24.795 -8.747 1.00 0.00 H new ATOM 0 HH11 ARG A 46 13.828 27.794 -8.551 1.00 0.00 H new ATOM 0 HH12 ARG A 46 15.439 28.100 -7.893 1.00 0.00 H new ATOM 0 HH21 ARG A 46 15.876 24.819 -6.770 1.00 0.00 H new ATOM 0 HH22 ARG A 46 16.587 26.431 -6.894 1.00 0.00 H new ATOM 708 N LYS A 47 13.237 21.337 -8.692 1.00 0.00 N ATOM 709 CA LYS A 47 13.820 19.975 -8.846 1.00 0.00 C ATOM 710 C LYS A 47 13.000 18.958 -8.047 1.00 0.00 C ATOM 711 O LYS A 47 12.825 17.828 -8.458 1.00 0.00 O ATOM 712 CB LYS A 47 15.238 20.088 -8.283 1.00 0.00 C ATOM 713 CG LYS A 47 15.945 18.737 -8.401 1.00 0.00 C ATOM 714 CD LYS A 47 15.755 18.184 -9.815 1.00 0.00 C ATOM 715 CE LYS A 47 16.498 16.854 -9.945 1.00 0.00 C ATOM 716 NZ LYS A 47 17.900 17.159 -9.545 1.00 0.00 N ATOM 0 H LYS A 47 13.913 22.081 -8.521 1.00 0.00 H new ATOM 0 HA LYS A 47 13.820 19.637 -9.882 1.00 0.00 H new ATOM 0 HB2 LYS A 47 15.796 20.851 -8.826 1.00 0.00 H new ATOM 0 HB3 LYS A 47 15.202 20.401 -7.240 1.00 0.00 H new ATOM 0 HG2 LYS A 47 17.007 18.850 -8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 47 15.542 18.038 -7.668 1.00 0.00 H new ATOM 0 HD2 LYS A 47 14.694 18.042 -10.022 1.00 0.00 H new ATOM 0 HD3 LYS A 47 16.131 18.896 -10.549 1.00 0.00 H new ATOM 0 HE2 LYS A 47 16.060 16.092 -9.301 1.00 0.00 H new ATOM 0 HE3 LYS A 47 16.452 16.474 -10.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 18.550 16.515 -10.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 18.127 18.142 -9.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 18.003 17.033 -8.518 1.00 0.00 H new ATOM 730 N GLU A 48 12.492 19.353 -6.910 1.00 0.00 N ATOM 731 CA GLU A 48 11.680 18.409 -6.089 1.00 0.00 C ATOM 732 C GLU A 48 10.684 17.660 -6.979 1.00 0.00 C ATOM 733 O GLU A 48 10.564 16.457 -6.904 1.00 0.00 O ATOM 734 CB GLU A 48 10.945 19.293 -5.081 1.00 0.00 C ATOM 735 CG GLU A 48 10.869 18.573 -3.732 1.00 0.00 C ATOM 736 CD GLU A 48 9.601 19.005 -2.993 1.00 0.00 C ATOM 737 OE1 GLU A 48 8.724 19.559 -3.635 1.00 0.00 O ATOM 738 OE2 GLU A 48 9.528 18.775 -1.796 1.00 0.00 O ATOM 0 H GLU A 48 12.604 20.287 -6.515 1.00 0.00 H new ATOM 0 HA GLU A 48 12.293 17.655 -5.596 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.465 20.245 -4.969 1.00 0.00 H new ATOM 0 HB3 GLU A 48 9.942 19.518 -5.442 1.00 0.00 H new ATOM 0 HG2 GLU A 48 10.864 17.494 -3.884 1.00 0.00 H new ATOM 0 HG3 GLU A 48 11.749 18.807 -3.133 1.00 0.00 H new ATOM 745 N VAL A 49 9.966 18.364 -7.819 1.00 0.00 N ATOM 746 CA VAL A 49 8.974 17.694 -8.716 1.00 0.00 C ATOM 747 C VAL A 49 8.880 18.445 -10.052 1.00 0.00 C ATOM 748 O VAL A 49 9.457 19.501 -10.222 1.00 0.00 O ATOM 749 CB VAL A 49 7.626 17.735 -7.962 1.00 0.00 C ATOM 750 CG1 VAL A 49 7.860 17.655 -6.449 1.00 0.00 C ATOM 751 CG2 VAL A 49 6.870 19.031 -8.286 1.00 0.00 C ATOM 0 H VAL A 49 10.024 19.377 -7.922 1.00 0.00 H new ATOM 0 HA VAL A 49 9.262 16.669 -8.948 1.00 0.00 H new ATOM 0 HB VAL A 49 7.031 16.880 -8.283 1.00 0.00 H new ATOM 0 HG11 VAL A 49 6.902 17.685 -5.931 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.373 16.724 -6.209 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.471 18.499 -6.130 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.923 19.044 -7.747 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.471 19.888 -7.984 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.678 19.082 -9.358 1.00 0.00 H new ATOM 761 N GLU A 50 8.156 17.910 -10.996 1.00 0.00 N ATOM 762 CA GLU A 50 8.023 18.598 -12.315 1.00 0.00 C ATOM 763 C GLU A 50 6.551 18.691 -12.730 1.00 0.00 C ATOM 764 O GLU A 50 5.846 17.703 -12.770 1.00 0.00 O ATOM 765 CB GLU A 50 8.797 17.718 -13.297 1.00 0.00 C ATOM 766 CG GLU A 50 10.229 18.240 -13.433 1.00 0.00 C ATOM 767 CD GLU A 50 10.622 18.278 -14.912 1.00 0.00 C ATOM 768 OE1 GLU A 50 10.375 17.299 -15.596 1.00 0.00 O ATOM 769 OE2 GLU A 50 11.163 19.286 -15.334 1.00 0.00 O ATOM 0 H GLU A 50 7.651 17.028 -10.913 1.00 0.00 H new ATOM 0 HA GLU A 50 8.405 19.618 -12.284 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.807 16.686 -12.947 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.304 17.720 -14.269 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.306 19.237 -13.000 1.00 0.00 H new ATOM 0 HG3 GLU A 50 10.915 17.598 -12.880 1.00 0.00 H new ATOM 776 N VAL A 51 6.084 19.870 -13.052 1.00 0.00 N ATOM 777 CA VAL A 51 4.660 20.019 -13.480 1.00 0.00 C ATOM 778 C VAL A 51 4.379 19.077 -14.652 1.00 0.00 C ATOM 779 O VAL A 51 5.102 19.055 -15.629 1.00 0.00 O ATOM 780 CB VAL A 51 4.528 21.480 -13.910 1.00 0.00 C ATOM 781 CG1 VAL A 51 5.493 21.766 -15.060 1.00 0.00 C ATOM 782 CG2 VAL A 51 3.092 21.748 -14.364 1.00 0.00 C ATOM 0 H VAL A 51 6.625 20.734 -13.037 1.00 0.00 H new ATOM 0 HA VAL A 51 3.951 19.770 -12.690 1.00 0.00 H new ATOM 0 HB VAL A 51 4.770 22.130 -13.069 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.397 22.808 -15.365 1.00 0.00 H new ATOM 0 HG12 VAL A 51 6.515 21.576 -14.733 1.00 0.00 H new ATOM 0 HG13 VAL A 51 5.256 21.118 -15.904 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.996 22.789 -14.671 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.849 21.098 -15.204 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.407 21.548 -13.540 1.00 0.00 H new ATOM 792 N VAL A 52 3.345 18.287 -14.559 1.00 0.00 N ATOM 793 CA VAL A 52 3.039 17.338 -15.666 1.00 0.00 C ATOM 794 C VAL A 52 1.773 17.763 -16.416 1.00 0.00 C ATOM 795 O VAL A 52 1.807 18.030 -17.601 1.00 0.00 O ATOM 796 CB VAL A 52 2.828 15.989 -14.980 1.00 0.00 C ATOM 797 CG1 VAL A 52 2.510 14.928 -16.032 1.00 0.00 C ATOM 798 CG2 VAL A 52 4.101 15.595 -14.231 1.00 0.00 C ATOM 0 H VAL A 52 2.701 18.257 -13.768 1.00 0.00 H new ATOM 0 HA VAL A 52 3.839 17.305 -16.406 1.00 0.00 H new ATOM 0 HB VAL A 52 1.999 16.065 -14.276 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.359 13.965 -15.544 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.604 15.208 -16.569 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.340 14.852 -16.735 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.952 14.633 -13.741 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.929 15.519 -14.936 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.331 16.352 -13.481 1.00 0.00 H new ATOM 808 N GLU A 53 0.655 17.817 -15.742 1.00 0.00 N ATOM 809 CA GLU A 53 -0.609 18.213 -16.433 1.00 0.00 C ATOM 810 C GLU A 53 -1.263 19.404 -15.728 1.00 0.00 C ATOM 811 O GLU A 53 -0.827 19.837 -14.680 1.00 0.00 O ATOM 812 CB GLU A 53 -1.527 16.988 -16.347 1.00 0.00 C ATOM 813 CG GLU A 53 -0.709 15.703 -16.487 1.00 0.00 C ATOM 814 CD GLU A 53 -1.580 14.608 -17.108 1.00 0.00 C ATOM 815 OE1 GLU A 53 -2.130 14.847 -18.172 1.00 0.00 O ATOM 816 OE2 GLU A 53 -1.681 13.549 -16.511 1.00 0.00 O ATOM 0 H GLU A 53 0.561 17.606 -14.749 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.420 18.514 -17.463 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.057 16.988 -15.395 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.282 17.034 -17.132 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.167 15.883 -17.110 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.345 15.383 -15.511 1.00 0.00 H new ATOM 823 N ILE A 54 -2.312 19.928 -16.301 1.00 0.00 N ATOM 824 CA ILE A 54 -3.014 21.089 -15.677 1.00 0.00 C ATOM 825 C ILE A 54 -4.532 20.864 -15.769 1.00 0.00 C ATOM 826 O ILE A 54 -5.002 20.130 -16.614 1.00 0.00 O ATOM 827 CB ILE A 54 -2.584 22.333 -16.478 1.00 0.00 C ATOM 828 CG1 ILE A 54 -1.214 22.107 -17.143 1.00 0.00 C ATOM 829 CG2 ILE A 54 -2.482 23.528 -15.530 1.00 0.00 C ATOM 830 CD1 ILE A 54 -0.130 21.947 -16.069 1.00 0.00 C ATOM 0 H ILE A 54 -2.716 19.601 -17.179 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.762 21.212 -14.624 1.00 0.00 H new ATOM 0 HB ILE A 54 -3.326 22.522 -17.254 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -1.248 21.218 -17.772 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -0.973 22.948 -17.793 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -2.178 24.412 -16.090 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -3.452 23.708 -15.066 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.743 23.317 -14.757 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.836 21.787 -16.548 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -0.088 22.849 -15.458 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.367 21.091 -15.437 1.00 0.00 H new ATOM 842 N ILE A 55 -5.301 21.466 -14.899 1.00 0.00 N ATOM 843 CA ILE A 55 -6.783 21.249 -14.939 1.00 0.00 C ATOM 844 C ILE A 55 -7.539 22.512 -14.505 1.00 0.00 C ATOM 845 O ILE A 55 -7.058 23.286 -13.704 1.00 0.00 O ATOM 846 CB ILE A 55 -7.028 20.102 -13.946 1.00 0.00 C ATOM 847 CG1 ILE A 55 -7.121 18.781 -14.709 1.00 0.00 C ATOM 848 CG2 ILE A 55 -8.333 20.323 -13.167 1.00 0.00 C ATOM 849 CD1 ILE A 55 -7.293 17.642 -13.706 1.00 0.00 C ATOM 0 H ILE A 55 -4.972 22.095 -14.166 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.137 21.016 -15.943 1.00 0.00 H new ATOM 0 HB ILE A 55 -6.198 20.073 -13.241 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -7.963 18.804 -15.401 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -6.222 18.626 -15.305 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -8.485 19.498 -12.470 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.272 21.260 -12.613 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -9.170 20.368 -13.864 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -7.361 16.694 -14.240 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -6.437 17.619 -13.032 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -8.205 17.799 -13.130 1.00 0.00 H new ATOM 861 N GLN A 56 -8.734 22.697 -15.012 1.00 0.00 N ATOM 862 CA GLN A 56 -9.547 23.890 -14.625 1.00 0.00 C ATOM 863 C GLN A 56 -10.912 23.450 -14.074 1.00 0.00 C ATOM 864 O GLN A 56 -11.282 22.295 -14.154 1.00 0.00 O ATOM 865 CB GLN A 56 -9.724 24.685 -15.920 1.00 0.00 C ATOM 866 CG GLN A 56 -8.359 25.157 -16.421 1.00 0.00 C ATOM 867 CD GLN A 56 -7.862 26.307 -15.543 1.00 0.00 C ATOM 868 OE1 GLN A 56 -8.578 27.262 -15.312 1.00 0.00 O ATOM 869 NE2 GLN A 56 -6.659 26.257 -15.041 1.00 0.00 N ATOM 0 H GLN A 56 -9.182 22.070 -15.680 1.00 0.00 H new ATOM 0 HA GLN A 56 -9.066 24.480 -13.845 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -10.206 24.065 -16.676 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -10.375 25.542 -15.747 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -7.646 24.333 -16.397 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -8.434 25.484 -17.458 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -6.058 25.456 -15.235 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -6.319 27.019 -14.455 1.00 0.00 H new ATOM 878 N ALA A 57 -11.659 24.364 -13.510 1.00 0.00 N ATOM 879 CA ALA A 57 -12.998 24.009 -12.945 1.00 0.00 C ATOM 880 C ALA A 57 -14.081 24.079 -14.025 1.00 0.00 C ATOM 881 O ALA A 57 -13.959 24.819 -14.979 1.00 0.00 O ATOM 882 CB ALA A 57 -13.261 25.082 -11.891 1.00 0.00 C ATOM 0 H ALA A 57 -11.399 25.346 -13.416 1.00 0.00 H new ATOM 0 HA ALA A 57 -13.014 22.997 -12.542 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -14.228 24.901 -11.421 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -12.477 25.048 -11.134 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -13.266 26.064 -12.365 1.00 0.00 H new ATOM 888 N THR A 58 -15.154 23.334 -13.877 1.00 0.00 N ATOM 889 CA THR A 58 -16.236 23.401 -14.906 1.00 0.00 C ATOM 890 C THR A 58 -17.330 22.345 -14.683 1.00 0.00 C ATOM 891 O THR A 58 -17.956 21.912 -15.632 1.00 0.00 O ATOM 892 CB THR A 58 -15.535 23.140 -16.244 1.00 0.00 C ATOM 893 OG1 THR A 58 -16.506 22.793 -17.222 1.00 0.00 O ATOM 894 CG2 THR A 58 -14.535 21.993 -16.089 1.00 0.00 C ATOM 0 H THR A 58 -15.323 22.694 -13.101 1.00 0.00 H new ATOM 0 HA THR A 58 -16.739 24.367 -14.864 1.00 0.00 H new ATOM 0 HB THR A 58 -15.004 24.039 -16.556 1.00 0.00 H new ATOM 0 HG1 THR A 58 -16.938 21.951 -16.969 1.00 0.00 H new ATOM 0 HG21 THR A 58 -14.039 21.811 -17.043 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.791 22.258 -15.338 1.00 0.00 H new ATOM 0 HG23 THR A 58 -15.061 21.091 -15.776 1.00 0.00 H new ATOM 902 N ILE A 59 -17.604 21.916 -13.472 1.00 0.00 N ATOM 903 CA ILE A 59 -18.694 20.895 -13.334 1.00 0.00 C ATOM 904 C ILE A 59 -19.255 20.769 -11.903 1.00 0.00 C ATOM 905 O ILE A 59 -20.430 20.514 -11.729 1.00 0.00 O ATOM 906 CB ILE A 59 -18.070 19.575 -13.802 1.00 0.00 C ATOM 907 CG1 ILE A 59 -19.177 18.657 -14.331 1.00 0.00 C ATOM 908 CG2 ILE A 59 -17.348 18.886 -12.643 1.00 0.00 C ATOM 909 CD1 ILE A 59 -18.628 17.241 -14.517 1.00 0.00 C ATOM 0 H ILE A 59 -17.145 22.211 -12.610 1.00 0.00 H new ATOM 0 HA ILE A 59 -19.558 21.189 -13.930 1.00 0.00 H new ATOM 0 HB ILE A 59 -17.347 19.782 -14.591 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -20.015 18.644 -13.635 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -19.556 19.038 -15.279 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -16.911 17.950 -12.992 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -16.559 19.538 -12.267 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -18.059 18.678 -11.843 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -19.418 16.591 -14.893 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -17.804 17.261 -15.230 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -18.270 16.861 -13.560 1.00 0.00 H new ATOM 921 N ILE A 60 -18.458 20.916 -10.878 1.00 0.00 N ATOM 922 CA ILE A 60 -19.023 20.764 -9.497 1.00 0.00 C ATOM 923 C ILE A 60 -19.839 21.996 -9.094 1.00 0.00 C ATOM 924 O ILE A 60 -19.606 23.093 -9.559 1.00 0.00 O ATOM 925 CB ILE A 60 -17.823 20.582 -8.565 1.00 0.00 C ATOM 926 CG1 ILE A 60 -17.272 19.165 -8.727 1.00 0.00 C ATOM 927 CG2 ILE A 60 -18.265 20.790 -7.113 1.00 0.00 C ATOM 928 CD1 ILE A 60 -15.958 19.037 -7.957 1.00 0.00 C ATOM 0 H ILE A 60 -17.462 21.130 -10.929 1.00 0.00 H new ATOM 0 HA ILE A 60 -19.702 19.913 -9.444 1.00 0.00 H new ATOM 0 HB ILE A 60 -17.052 21.310 -8.817 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -17.995 18.438 -8.357 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -17.110 18.945 -9.782 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -17.410 20.660 -6.450 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -18.666 21.797 -6.995 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -19.035 20.061 -6.859 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -15.565 18.027 -8.073 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -15.236 19.754 -8.348 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -16.134 19.239 -6.900 1.00 0.00 H new ATOM 940 N ARG A 61 -20.801 21.810 -8.229 1.00 0.00 N ATOM 941 CA ARG A 61 -21.649 22.953 -7.783 1.00 0.00 C ATOM 942 C ARG A 61 -20.994 23.665 -6.594 1.00 0.00 C ATOM 943 O ARG A 61 -19.791 23.624 -6.423 1.00 0.00 O ATOM 944 CB ARG A 61 -22.978 22.313 -7.373 1.00 0.00 C ATOM 945 CG ARG A 61 -24.058 22.675 -8.397 1.00 0.00 C ATOM 946 CD ARG A 61 -25.117 23.564 -7.739 1.00 0.00 C ATOM 947 NE ARG A 61 -26.218 23.654 -8.740 1.00 0.00 N ATOM 948 CZ ARG A 61 -26.214 24.610 -9.628 1.00 0.00 C ATOM 949 NH1 ARG A 61 -25.848 25.816 -9.290 1.00 0.00 N ATOM 950 NH2 ARG A 61 -26.577 24.360 -10.857 1.00 0.00 N ATOM 0 H ARG A 61 -21.037 20.910 -7.810 1.00 0.00 H new ATOM 0 HA ARG A 61 -21.783 23.705 -8.561 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -22.869 21.230 -7.312 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -23.271 22.660 -6.382 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -23.610 23.194 -9.245 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -24.521 21.769 -8.787 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -25.469 23.132 -6.802 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -24.715 24.550 -7.504 1.00 0.00 H new ATOM 0 HE ARG A 61 -26.974 22.969 -8.731 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -25.564 26.013 -8.330 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -25.846 26.562 -9.986 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -26.864 23.418 -11.122 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -26.574 25.107 -11.552 1.00 0.00 H new ATOM 964 N GLN A 62 -21.771 24.323 -5.777 1.00 0.00 N ATOM 965 CA GLN A 62 -21.186 25.042 -4.610 1.00 0.00 C ATOM 966 C GLN A 62 -20.947 24.082 -3.439 1.00 0.00 C ATOM 967 O GLN A 62 -19.823 23.788 -3.084 1.00 0.00 O ATOM 968 CB GLN A 62 -22.231 26.092 -4.234 1.00 0.00 C ATOM 969 CG GLN A 62 -21.713 26.939 -3.071 1.00 0.00 C ATOM 970 CD GLN A 62 -21.563 28.388 -3.531 1.00 0.00 C ATOM 971 OE1 GLN A 62 -21.883 29.306 -2.801 1.00 0.00 O ATOM 972 NE2 GLN A 62 -21.089 28.635 -4.720 1.00 0.00 N ATOM 0 H GLN A 62 -22.785 24.394 -5.867 1.00 0.00 H new ATOM 0 HA GLN A 62 -20.219 25.485 -4.848 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -22.447 26.728 -5.092 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -23.166 25.606 -3.955 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -22.403 26.882 -2.229 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -20.754 26.554 -2.724 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -20.821 27.865 -5.332 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -20.986 29.599 -5.038 1.00 0.00 H new ATOM 981 N ASN A 63 -21.994 23.601 -2.828 1.00 0.00 N ATOM 982 CA ASN A 63 -21.825 22.672 -1.674 1.00 0.00 C ATOM 983 C ASN A 63 -21.490 21.259 -2.162 1.00 0.00 C ATOM 984 O ASN A 63 -21.170 20.385 -1.385 1.00 0.00 O ATOM 985 CB ASN A 63 -23.175 22.686 -0.957 1.00 0.00 C ATOM 986 CG ASN A 63 -23.041 23.441 0.367 1.00 0.00 C ATOM 987 OD1 ASN A 63 -21.966 23.888 0.719 1.00 0.00 O ATOM 988 ND2 ASN A 63 -24.093 23.605 1.121 1.00 0.00 N ATOM 0 H ASN A 63 -22.960 23.811 -3.078 1.00 0.00 H new ATOM 0 HA ASN A 63 -21.008 22.977 -1.019 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -23.928 23.163 -1.585 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -23.512 21.666 -0.774 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -24.014 24.108 2.005 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -24.995 23.230 0.827 1.00 0.00 H new ATOM 995 N GLN A 64 -21.561 21.026 -3.440 1.00 0.00 N ATOM 996 CA GLN A 64 -21.248 19.663 -3.957 1.00 0.00 C ATOM 997 C GLN A 64 -19.853 19.219 -3.502 1.00 0.00 C ATOM 998 O GLN A 64 -18.868 19.889 -3.735 1.00 0.00 O ATOM 999 CB GLN A 64 -21.301 19.794 -5.479 1.00 0.00 C ATOM 1000 CG GLN A 64 -20.644 18.571 -6.120 1.00 0.00 C ATOM 1001 CD GLN A 64 -21.303 17.298 -5.585 1.00 0.00 C ATOM 1002 OE1 GLN A 64 -20.641 16.301 -5.375 1.00 0.00 O ATOM 1003 NE2 GLN A 64 -22.586 17.291 -5.352 1.00 0.00 N ATOM 0 H GLN A 64 -21.820 21.714 -4.147 1.00 0.00 H new ATOM 0 HA GLN A 64 -21.949 18.915 -3.586 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -22.336 19.880 -5.811 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -20.788 20.703 -5.794 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -20.745 18.617 -7.204 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -19.577 18.561 -5.899 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -23.141 18.128 -5.529 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -23.035 16.448 -4.993 1.00 0.00 H new ATOM 1012 N ALA A 65 -19.767 18.088 -2.853 1.00 0.00 N ATOM 1013 CA ALA A 65 -18.443 17.588 -2.378 1.00 0.00 C ATOM 1014 C ALA A 65 -18.001 16.381 -3.214 1.00 0.00 C ATOM 1015 O ALA A 65 -18.815 15.636 -3.726 1.00 0.00 O ATOM 1016 CB ALA A 65 -18.679 17.172 -0.926 1.00 0.00 C ATOM 0 H ALA A 65 -20.560 17.486 -2.630 1.00 0.00 H new ATOM 0 HA ALA A 65 -17.660 18.341 -2.468 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -17.750 16.791 -0.501 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -19.014 18.035 -0.350 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -19.441 16.393 -0.890 1.00 0.00 H new ATOM 1022 N LEU A 66 -16.716 16.181 -3.356 1.00 0.00 N ATOM 1023 CA LEU A 66 -16.229 15.022 -4.163 1.00 0.00 C ATOM 1024 C LEU A 66 -15.260 14.166 -3.339 1.00 0.00 C ATOM 1025 O LEU A 66 -14.245 14.639 -2.871 1.00 0.00 O ATOM 1026 CB LEU A 66 -15.506 15.647 -5.358 1.00 0.00 C ATOM 1027 CG LEU A 66 -16.243 15.294 -6.654 1.00 0.00 C ATOM 1028 CD1 LEU A 66 -16.546 13.795 -6.682 1.00 0.00 C ATOM 1029 CD2 LEU A 66 -17.554 16.080 -6.726 1.00 0.00 C ATOM 0 H LEU A 66 -15.986 16.767 -2.950 1.00 0.00 H new ATOM 0 HA LEU A 66 -17.043 14.367 -4.473 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -15.458 16.729 -5.240 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -14.479 15.285 -5.403 1.00 0.00 H new ATOM 0 HG LEU A 66 -15.616 15.552 -7.507 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -17.070 13.547 -7.605 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.613 13.234 -6.633 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -17.171 13.534 -5.828 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.079 15.829 -7.648 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -18.180 15.823 -5.871 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -17.339 17.148 -6.710 1.00 0.00 H new ATOM 1041 N ARG A 67 -15.564 12.908 -3.165 1.00 0.00 N ATOM 1042 CA ARG A 67 -14.656 12.021 -2.374 1.00 0.00 C ATOM 1043 C ARG A 67 -13.673 11.304 -3.303 1.00 0.00 C ATOM 1044 O ARG A 67 -14.066 10.626 -4.231 1.00 0.00 O ATOM 1045 CB ARG A 67 -15.582 11.009 -1.698 1.00 0.00 C ATOM 1046 CG ARG A 67 -16.515 11.734 -0.727 1.00 0.00 C ATOM 1047 CD ARG A 67 -16.018 11.535 0.707 1.00 0.00 C ATOM 1048 NE ARG A 67 -16.608 10.238 1.141 1.00 0.00 N ATOM 1049 CZ ARG A 67 -16.192 9.668 2.238 1.00 0.00 C ATOM 1050 NH1 ARG A 67 -14.923 9.689 2.543 1.00 0.00 N ATOM 1051 NH2 ARG A 67 -17.044 9.078 3.031 1.00 0.00 N ATOM 0 H ARG A 67 -16.400 12.455 -3.535 1.00 0.00 H new ATOM 0 HA ARG A 67 -14.062 12.580 -1.651 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -16.165 10.477 -2.449 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -14.994 10.263 -1.164 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -16.551 12.797 -0.966 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -17.530 11.350 -0.827 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -14.929 11.507 0.747 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -16.340 12.351 1.354 1.00 0.00 H new ATOM 0 HE ARG A 67 -17.337 9.796 0.581 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -14.257 10.151 1.924 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -14.597 9.243 3.401 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -18.036 9.062 2.793 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -16.718 8.632 3.889 1.00 0.00 H new ATOM 1065 N LEU A 68 -12.397 11.448 -3.064 1.00 0.00 N ATOM 1066 CA LEU A 68 -11.400 10.771 -3.942 1.00 0.00 C ATOM 1067 C LEU A 68 -10.455 9.901 -3.105 1.00 0.00 C ATOM 1068 O LEU A 68 -9.862 10.354 -2.146 1.00 0.00 O ATOM 1069 CB LEU A 68 -10.634 11.912 -4.608 1.00 0.00 C ATOM 1070 CG LEU A 68 -11.013 11.994 -6.087 1.00 0.00 C ATOM 1071 CD1 LEU A 68 -10.603 10.702 -6.789 1.00 0.00 C ATOM 1072 CD2 LEU A 68 -12.526 12.188 -6.221 1.00 0.00 C ATOM 0 H LEU A 68 -12.004 12.002 -2.303 1.00 0.00 H new ATOM 0 HA LEU A 68 -11.869 10.110 -4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -10.863 12.855 -4.111 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -9.561 11.750 -4.506 1.00 0.00 H new ATOM 0 HG LEU A 68 -10.498 12.838 -6.545 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -10.873 10.759 -7.844 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.526 10.564 -6.697 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -11.117 9.859 -6.328 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -12.793 12.246 -7.276 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -13.043 11.346 -5.762 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -12.820 13.111 -5.721 1.00 0.00 H new ATOM 1084 N ARG A 69 -10.309 8.652 -3.463 1.00 0.00 N ATOM 1085 CA ARG A 69 -9.401 7.753 -2.691 1.00 0.00 C ATOM 1086 C ARG A 69 -8.170 7.403 -3.531 1.00 0.00 C ATOM 1087 O ARG A 69 -8.142 7.621 -4.722 1.00 0.00 O ATOM 1088 CB ARG A 69 -10.231 6.500 -2.403 1.00 0.00 C ATOM 1089 CG ARG A 69 -9.894 5.974 -1.007 1.00 0.00 C ATOM 1090 CD ARG A 69 -10.528 4.596 -0.812 1.00 0.00 C ATOM 1091 NE ARG A 69 -11.481 4.770 0.318 1.00 0.00 N ATOM 1092 CZ ARG A 69 -11.522 3.889 1.278 1.00 0.00 C ATOM 1093 NH1 ARG A 69 -12.280 2.832 1.163 1.00 0.00 N ATOM 1094 NH2 ARG A 69 -10.803 4.063 2.353 1.00 0.00 N ATOM 0 H ARG A 69 -10.779 8.216 -4.256 1.00 0.00 H new ATOM 0 HA ARG A 69 -9.039 8.218 -1.774 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.294 6.732 -2.469 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.025 5.735 -3.151 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.813 5.909 -0.883 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -10.261 6.665 -0.248 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -11.042 4.266 -1.715 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -9.774 3.843 -0.581 1.00 0.00 H new ATOM 0 HE ARG A 69 -12.102 5.579 0.341 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -12.840 2.695 0.322 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -12.312 2.143 1.914 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -10.210 4.888 2.442 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -10.834 3.374 3.105 1.00 0.00 H new ATOM 1108 N ALA A 70 -7.149 6.868 -2.920 1.00 0.00 N ATOM 1109 CA ALA A 70 -5.922 6.516 -3.693 1.00 0.00 C ATOM 1110 C ALA A 70 -6.142 5.233 -4.501 1.00 0.00 C ATOM 1111 O ALA A 70 -6.995 4.426 -4.185 1.00 0.00 O ATOM 1112 CB ALA A 70 -4.838 6.301 -2.636 1.00 0.00 C ATOM 0 H ALA A 70 -7.110 6.659 -1.922 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.653 7.294 -4.408 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -3.900 6.038 -3.125 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -4.703 7.218 -2.062 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.137 5.494 -1.967 1.00 0.00 H new ATOM 1118 N ARG A 71 -5.372 5.036 -5.536 1.00 0.00 N ATOM 1119 CA ARG A 71 -5.523 3.804 -6.362 1.00 0.00 C ATOM 1120 C ARG A 71 -4.261 2.947 -6.239 1.00 0.00 C ATOM 1121 O ARG A 71 -4.322 1.734 -6.176 1.00 0.00 O ATOM 1122 CB ARG A 71 -5.700 4.305 -7.797 1.00 0.00 C ATOM 1123 CG ARG A 71 -5.903 3.114 -8.736 1.00 0.00 C ATOM 1124 CD ARG A 71 -7.276 3.220 -9.403 1.00 0.00 C ATOM 1125 NE ARG A 71 -7.775 1.818 -9.483 1.00 0.00 N ATOM 1126 CZ ARG A 71 -8.918 1.499 -8.938 1.00 0.00 C ATOM 1127 NH1 ARG A 71 -10.036 1.845 -9.514 1.00 0.00 N ATOM 1128 NH2 ARG A 71 -8.941 0.835 -7.815 1.00 0.00 N ATOM 0 H ARG A 71 -4.642 5.677 -5.846 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.365 3.187 -6.047 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -6.556 4.977 -7.855 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.824 4.877 -8.104 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -5.119 3.096 -9.493 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -5.829 2.180 -8.178 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -7.951 3.846 -8.820 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -7.200 3.669 -10.393 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.223 1.107 -9.964 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -10.018 2.365 -10.391 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -10.928 1.595 -9.087 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.067 0.566 -7.364 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -9.833 0.585 -7.388 1.00 0.00 H new ATOM 1142 N LYS A 72 -3.118 3.574 -6.196 1.00 0.00 N ATOM 1143 CA LYS A 72 -1.844 2.809 -6.066 1.00 0.00 C ATOM 1144 C LYS A 72 -0.909 3.528 -5.089 1.00 0.00 C ATOM 1145 O LYS A 72 -0.706 4.722 -5.180 1.00 0.00 O ATOM 1146 CB LYS A 72 -1.242 2.787 -7.473 1.00 0.00 C ATOM 1147 CG LYS A 72 -1.204 4.207 -8.045 1.00 0.00 C ATOM 1148 CD LYS A 72 -2.090 4.280 -9.289 1.00 0.00 C ATOM 1149 CE LYS A 72 -1.224 4.119 -10.542 1.00 0.00 C ATOM 1150 NZ LYS A 72 -2.191 3.873 -11.647 1.00 0.00 N ATOM 0 H LYS A 72 -3.010 4.587 -6.245 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.000 1.801 -5.682 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.235 2.371 -7.441 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.833 2.140 -8.121 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.549 4.921 -7.297 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.180 4.481 -8.298 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.848 3.498 -9.255 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.617 5.234 -9.318 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.630 5.013 -10.729 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.526 3.289 -10.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.673 3.752 -12.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.738 3.012 -11.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -2.838 4.683 -11.729 1.00 0.00 H new ATOM 1164 N GLU A 73 -0.341 2.816 -4.152 1.00 0.00 N ATOM 1165 CA GLU A 73 0.574 3.472 -3.174 1.00 0.00 C ATOM 1166 C GLU A 73 1.709 4.187 -3.912 1.00 0.00 C ATOM 1167 O GLU A 73 2.786 3.653 -4.085 1.00 0.00 O ATOM 1168 CB GLU A 73 1.124 2.334 -2.312 1.00 0.00 C ATOM 1169 CG GLU A 73 1.669 1.225 -3.213 1.00 0.00 C ATOM 1170 CD GLU A 73 1.145 -0.129 -2.731 1.00 0.00 C ATOM 1171 OE1 GLU A 73 -0.049 -0.232 -2.498 1.00 0.00 O ATOM 1172 OE2 GLU A 73 1.946 -1.040 -2.602 1.00 0.00 O ATOM 0 H GLU A 73 -0.471 1.813 -4.022 1.00 0.00 H new ATOM 0 HA GLU A 73 0.063 4.223 -2.572 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.913 2.707 -1.660 1.00 0.00 H new ATOM 0 HB3 GLU A 73 0.338 1.940 -1.668 1.00 0.00 H new ATOM 0 HG2 GLU A 73 1.364 1.398 -4.245 1.00 0.00 H new ATOM 0 HG3 GLU A 73 2.759 1.232 -3.197 1.00 0.00 H new ATOM 1179 N CYS A 74 1.469 5.392 -4.352 1.00 0.00 N ATOM 1180 CA CYS A 74 2.524 6.151 -5.086 1.00 0.00 C ATOM 1181 C CYS A 74 2.175 7.642 -5.114 1.00 0.00 C ATOM 1182 O CYS A 74 3.039 8.495 -5.053 1.00 0.00 O ATOM 1183 CB CYS A 74 2.508 5.577 -6.504 1.00 0.00 C ATOM 1184 SG CYS A 74 3.675 4.198 -6.618 1.00 0.00 S ATOM 0 H CYS A 74 0.584 5.886 -4.235 1.00 0.00 H new ATOM 0 HA CYS A 74 3.503 6.058 -4.616 1.00 0.00 H new ATOM 0 HB2 CYS A 74 1.504 5.238 -6.758 1.00 0.00 H new ATOM 0 HB3 CYS A 74 2.774 6.352 -7.223 1.00 0.00 H new ATOM 0 HG CYS A 74 3.633 3.502 -5.521 1.00 0.00 H new ATOM 1190 N TRP A 75 0.913 7.960 -5.210 1.00 0.00 N ATOM 1191 CA TRP A 75 0.494 9.390 -5.247 1.00 0.00 C ATOM 1192 C TRP A 75 0.620 10.012 -3.850 1.00 0.00 C ATOM 1193 O TRP A 75 -0.028 9.590 -2.912 1.00 0.00 O ATOM 1194 CB TRP A 75 -0.970 9.335 -5.717 1.00 0.00 C ATOM 1195 CG TRP A 75 -1.775 10.429 -5.086 1.00 0.00 C ATOM 1196 CD1 TRP A 75 -1.507 11.746 -5.202 1.00 0.00 C ATOM 1197 CD2 TRP A 75 -2.966 10.326 -4.250 1.00 0.00 C ATOM 1198 NE1 TRP A 75 -2.455 12.463 -4.494 1.00 0.00 N ATOM 1199 CE2 TRP A 75 -3.376 11.632 -3.891 1.00 0.00 C ATOM 1200 CE3 TRP A 75 -3.724 9.241 -3.773 1.00 0.00 C ATOM 1201 CZ2 TRP A 75 -4.496 11.853 -3.090 1.00 0.00 C ATOM 1202 CZ3 TRP A 75 -4.852 9.461 -2.966 1.00 0.00 C ATOM 1203 CH2 TRP A 75 -5.238 10.765 -2.626 1.00 0.00 C ATOM 0 H TRP A 75 0.149 7.286 -5.265 1.00 0.00 H new ATOM 0 HA TRP A 75 1.108 10.006 -5.904 1.00 0.00 H new ATOM 0 HB2 TRP A 75 -1.011 9.427 -6.802 1.00 0.00 H new ATOM 0 HB3 TRP A 75 -1.402 8.367 -5.463 1.00 0.00 H new ATOM 0 HD1 TRP A 75 -0.685 12.172 -5.758 1.00 0.00 H new ATOM 0 HE1 TRP A 75 -2.471 13.481 -4.426 1.00 0.00 H new ATOM 0 HE3 TRP A 75 -3.436 8.232 -4.029 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 -4.788 12.860 -2.830 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 -5.426 8.620 -2.605 1.00 0.00 H new ATOM 0 HH2 TRP A 75 -6.108 10.928 -2.006 1.00 0.00 H new ATOM 1214 N ASP A 76 1.445 11.015 -3.704 1.00 0.00 N ATOM 1215 CA ASP A 76 1.606 11.660 -2.368 1.00 0.00 C ATOM 1216 C ASP A 76 0.552 12.756 -2.177 1.00 0.00 C ATOM 1217 O ASP A 76 0.544 13.749 -2.876 1.00 0.00 O ATOM 1218 CB ASP A 76 3.007 12.269 -2.389 1.00 0.00 C ATOM 1219 CG ASP A 76 4.041 11.167 -2.624 1.00 0.00 C ATOM 1220 OD1 ASP A 76 3.646 10.014 -2.673 1.00 0.00 O ATOM 1221 OD2 ASP A 76 5.208 11.495 -2.752 1.00 0.00 O ATOM 0 H ASP A 76 2.013 11.415 -4.451 1.00 0.00 H new ATOM 0 HA ASP A 76 1.480 10.950 -1.551 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.076 13.021 -3.175 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.209 12.776 -1.445 1.00 0.00 H new ATOM 1226 N ARG A 77 -0.337 12.585 -1.235 1.00 0.00 N ATOM 1227 CA ARG A 77 -1.384 13.623 -1.006 1.00 0.00 C ATOM 1228 C ARG A 77 -0.730 14.985 -0.759 1.00 0.00 C ATOM 1229 O ARG A 77 -1.010 15.952 -1.440 1.00 0.00 O ATOM 1230 CB ARG A 77 -2.144 13.156 0.237 1.00 0.00 C ATOM 1231 CG ARG A 77 -3.565 12.749 -0.160 1.00 0.00 C ATOM 1232 CD ARG A 77 -4.577 13.498 0.712 1.00 0.00 C ATOM 1233 NE ARG A 77 -4.062 13.366 2.102 1.00 0.00 N ATOM 1234 CZ ARG A 77 -4.399 12.337 2.830 1.00 0.00 C ATOM 1235 NH1 ARG A 77 -5.602 12.260 3.332 1.00 0.00 N ATOM 1236 NH2 ARG A 77 -3.535 11.384 3.053 1.00 0.00 N ATOM 0 H ARG A 77 -0.384 11.775 -0.617 1.00 0.00 H new ATOM 0 HA ARG A 77 -2.046 13.739 -1.864 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -1.628 12.314 0.697 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -2.176 13.954 0.979 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -3.738 12.976 -1.212 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -3.693 11.673 -0.040 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -4.653 14.545 0.417 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -5.574 13.067 0.618 1.00 0.00 H new ATOM 0 HE ARG A 77 -3.445 14.081 2.486 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -6.277 13.004 3.155 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -5.867 11.456 3.901 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -2.596 11.444 2.658 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -3.799 10.580 3.622 1.00 0.00 H new ATOM 1250 N ASP A 78 0.141 15.068 0.208 1.00 0.00 N ATOM 1251 CA ASP A 78 0.819 16.366 0.497 1.00 0.00 C ATOM 1252 C ASP A 78 2.266 16.324 0.002 1.00 0.00 C ATOM 1253 O ASP A 78 3.121 17.035 0.491 1.00 0.00 O ATOM 1254 CB ASP A 78 0.781 16.504 2.020 1.00 0.00 C ATOM 1255 CG ASP A 78 0.413 17.942 2.394 1.00 0.00 C ATOM 1256 OD1 ASP A 78 0.110 18.708 1.494 1.00 0.00 O ATOM 1257 OD2 ASP A 78 0.442 18.252 3.574 1.00 0.00 O ATOM 0 H ASP A 78 0.414 14.293 0.812 1.00 0.00 H new ATOM 0 HA ASP A 78 0.333 17.205 -0.001 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.053 15.810 2.440 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.751 16.244 2.444 1.00 0.00 H new ATOM 1262 N GLY A 79 2.548 15.486 -0.957 1.00 0.00 N ATOM 1263 CA GLY A 79 3.942 15.389 -1.473 1.00 0.00 C ATOM 1264 C GLY A 79 4.723 14.394 -0.615 1.00 0.00 C ATOM 1265 O GLY A 79 5.826 14.005 -0.944 1.00 0.00 O ATOM 0 H GLY A 79 1.874 14.865 -1.405 1.00 0.00 H new ATOM 0 HA2 GLY A 79 3.936 15.065 -2.514 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.422 16.367 -1.446 1.00 0.00 H new ATOM 1269 N LYS A 80 4.156 13.980 0.487 1.00 0.00 N ATOM 1270 CA LYS A 80 4.858 13.010 1.374 1.00 0.00 C ATOM 1271 C LYS A 80 4.557 11.575 0.930 1.00 0.00 C ATOM 1272 O LYS A 80 3.432 11.237 0.618 1.00 0.00 O ATOM 1273 CB LYS A 80 4.291 13.280 2.771 1.00 0.00 C ATOM 1274 CG LYS A 80 2.894 12.665 2.891 1.00 0.00 C ATOM 1275 CD LYS A 80 2.397 12.796 4.331 1.00 0.00 C ATOM 1276 CE LYS A 80 0.879 12.607 4.365 1.00 0.00 C ATOM 1277 NZ LYS A 80 0.424 13.368 5.560 1.00 0.00 N ATOM 0 H LYS A 80 3.234 14.273 0.811 1.00 0.00 H new ATOM 0 HA LYS A 80 5.942 13.124 1.346 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.951 12.858 3.529 1.00 0.00 H new ATOM 0 HB3 LYS A 80 4.243 14.354 2.953 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.205 13.167 2.211 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.922 11.615 2.599 1.00 0.00 H new ATOM 0 HD2 LYS A 80 2.881 12.052 4.963 1.00 0.00 H new ATOM 0 HD3 LYS A 80 2.662 13.775 4.731 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.413 12.986 3.455 1.00 0.00 H new ATOM 0 HE3 LYS A 80 0.614 11.553 4.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -0.609 13.286 5.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.878 12.981 6.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 0.684 14.369 5.454 1.00 0.00 H new ATOM 1291 N GLU A 81 5.550 10.729 0.902 1.00 0.00 N ATOM 1292 CA GLU A 81 5.312 9.318 0.481 1.00 0.00 C ATOM 1293 C GLU A 81 4.082 8.757 1.200 1.00 0.00 C ATOM 1294 O GLU A 81 4.043 8.679 2.412 1.00 0.00 O ATOM 1295 CB GLU A 81 6.577 8.564 0.900 1.00 0.00 C ATOM 1296 CG GLU A 81 6.294 7.060 0.936 1.00 0.00 C ATOM 1297 CD GLU A 81 5.856 6.658 2.345 1.00 0.00 C ATOM 1298 OE1 GLU A 81 6.066 7.442 3.256 1.00 0.00 O ATOM 1299 OE2 GLU A 81 5.316 5.572 2.489 1.00 0.00 O ATOM 0 H GLU A 81 6.513 10.952 1.152 1.00 0.00 H new ATOM 0 HA GLU A 81 5.122 9.227 -0.588 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.386 8.775 0.201 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.907 8.905 1.881 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.516 6.808 0.216 1.00 0.00 H new ATOM 0 HG3 GLU A 81 7.186 6.504 0.648 1.00 0.00 H new ATOM 1306 N ARG A 82 3.074 8.371 0.467 1.00 0.00 N ATOM 1307 CA ARG A 82 1.847 7.824 1.117 1.00 0.00 C ATOM 1308 C ARG A 82 1.422 6.510 0.451 1.00 0.00 C ATOM 1309 O ARG A 82 1.756 6.243 -0.687 1.00 0.00 O ATOM 1310 CB ARG A 82 0.781 8.898 0.905 1.00 0.00 C ATOM 1311 CG ARG A 82 0.364 9.478 2.257 1.00 0.00 C ATOM 1312 CD ARG A 82 -0.144 8.350 3.156 1.00 0.00 C ATOM 1313 NE ARG A 82 -1.339 8.911 3.847 1.00 0.00 N ATOM 1314 CZ ARG A 82 -1.999 8.178 4.701 1.00 0.00 C ATOM 1315 NH1 ARG A 82 -2.548 7.059 4.315 1.00 0.00 N ATOM 1316 NH2 ARG A 82 -2.109 8.563 5.942 1.00 0.00 N ATOM 0 H ARG A 82 3.046 8.410 -0.552 1.00 0.00 H new ATOM 0 HA ARG A 82 2.007 7.602 2.172 1.00 0.00 H new ATOM 0 HB2 ARG A 82 1.169 9.688 0.263 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -0.084 8.471 0.398 1.00 0.00 H new ATOM 0 HG2 ARG A 82 1.210 9.980 2.727 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.415 10.228 2.119 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -0.405 7.468 2.572 1.00 0.00 H new ATOM 0 HD3 ARG A 82 0.618 8.044 3.873 1.00 0.00 H new ATOM 0 HE ARG A 82 -1.640 9.866 3.653 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -2.461 6.757 3.345 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.064 6.487 4.984 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -1.679 9.437 6.245 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -2.625 7.990 6.610 1.00 0.00 H new ATOM 1330 N VAL A 83 0.688 5.690 1.153 1.00 0.00 N ATOM 1331 CA VAL A 83 0.239 4.393 0.565 1.00 0.00 C ATOM 1332 C VAL A 83 -1.062 4.583 -0.218 1.00 0.00 C ATOM 1333 O VAL A 83 -1.587 5.674 -0.320 1.00 0.00 O ATOM 1334 CB VAL A 83 0.000 3.483 1.767 1.00 0.00 C ATOM 1335 CG1 VAL A 83 1.285 3.378 2.589 1.00 0.00 C ATOM 1336 CG2 VAL A 83 -1.117 4.071 2.634 1.00 0.00 C ATOM 0 H VAL A 83 0.379 5.861 2.110 1.00 0.00 H new ATOM 0 HA VAL A 83 0.971 3.982 -0.130 1.00 0.00 H new ATOM 0 HB VAL A 83 -0.291 2.491 1.423 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.116 2.728 3.448 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.080 2.962 1.970 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.577 4.369 2.936 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.290 3.423 3.493 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.825 5.063 2.980 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.032 4.146 2.047 1.00 0.00 H new ATOM 1346 N THR A 84 -1.588 3.522 -0.767 1.00 0.00 N ATOM 1347 CA THR A 84 -2.859 3.630 -1.540 1.00 0.00 C ATOM 1348 C THR A 84 -4.038 3.828 -0.583 1.00 0.00 C ATOM 1349 O THR A 84 -5.156 4.059 -0.998 1.00 0.00 O ATOM 1350 CB THR A 84 -2.989 2.293 -2.270 1.00 0.00 C ATOM 1351 OG1 THR A 84 -4.107 2.338 -3.144 1.00 0.00 O ATOM 1352 CG2 THR A 84 -3.183 1.172 -1.248 1.00 0.00 C ATOM 0 H THR A 84 -1.192 2.583 -0.714 1.00 0.00 H new ATOM 0 HA THR A 84 -2.856 4.475 -2.228 1.00 0.00 H new ATOM 0 HB THR A 84 -2.085 2.104 -2.848 1.00 0.00 H new ATOM 0 HG1 THR A 84 -4.795 2.923 -2.765 1.00 0.00 H new ATOM 0 HG21 THR A 84 -3.276 0.218 -1.767 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.324 1.138 -0.578 1.00 0.00 H new ATOM 0 HG23 THR A 84 -4.088 1.360 -0.669 1.00 0.00 H new ATOM 1360 N GLY A 85 -3.793 3.735 0.696 1.00 0.00 N ATOM 1361 CA GLY A 85 -4.897 3.911 1.682 1.00 0.00 C ATOM 1362 C GLY A 85 -5.225 5.396 1.832 1.00 0.00 C ATOM 1363 O GLY A 85 -6.322 5.762 2.203 1.00 0.00 O ATOM 0 H GLY A 85 -2.876 3.545 1.100 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.781 3.365 1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.606 3.494 2.646 1.00 0.00 H new ATOM 1367 N GLU A 86 -4.286 6.260 1.550 1.00 0.00 N ATOM 1368 CA GLU A 86 -4.561 7.719 1.685 1.00 0.00 C ATOM 1369 C GLU A 86 -5.765 8.110 0.818 1.00 0.00 C ATOM 1370 O GLU A 86 -6.151 7.395 -0.086 1.00 0.00 O ATOM 1371 CB GLU A 86 -3.270 8.419 1.220 1.00 0.00 C ATOM 1372 CG GLU A 86 -3.339 8.771 -0.271 1.00 0.00 C ATOM 1373 CD GLU A 86 -2.169 9.688 -0.632 1.00 0.00 C ATOM 1374 OE1 GLU A 86 -1.434 10.059 0.269 1.00 0.00 O ATOM 1375 OE2 GLU A 86 -2.030 10.005 -1.801 1.00 0.00 O ATOM 0 H GLU A 86 -3.346 6.020 1.234 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.814 8.006 2.705 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.114 9.326 1.804 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.414 7.770 1.404 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.302 7.863 -0.872 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.285 9.264 -0.496 1.00 0.00 H new ATOM 1382 N GLU A 87 -6.358 9.241 1.085 1.00 0.00 N ATOM 1383 CA GLU A 87 -7.533 9.678 0.275 1.00 0.00 C ATOM 1384 C GLU A 87 -7.730 11.191 0.417 1.00 0.00 C ATOM 1385 O GLU A 87 -7.536 11.752 1.477 1.00 0.00 O ATOM 1386 CB GLU A 87 -8.718 8.913 0.869 1.00 0.00 C ATOM 1387 CG GLU A 87 -10.031 9.452 0.293 1.00 0.00 C ATOM 1388 CD GLU A 87 -11.114 9.414 1.372 1.00 0.00 C ATOM 1389 OE1 GLU A 87 -10.764 9.237 2.528 1.00 0.00 O ATOM 1390 OE2 GLU A 87 -12.274 9.560 1.025 1.00 0.00 O ATOM 0 H GLU A 87 -6.081 9.882 1.828 1.00 0.00 H new ATOM 0 HA GLU A 87 -7.413 9.476 -0.789 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -8.623 7.850 0.647 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -8.719 9.013 1.954 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -9.893 10.473 -0.063 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -10.337 8.854 -0.566 1.00 0.00 H new ATOM 1397 N TRP A 88 -8.112 11.859 -0.639 1.00 0.00 N ATOM 1398 CA TRP A 88 -8.317 13.333 -0.546 1.00 0.00 C ATOM 1399 C TRP A 88 -9.773 13.687 -0.893 1.00 0.00 C ATOM 1400 O TRP A 88 -10.418 13.024 -1.684 1.00 0.00 O ATOM 1401 CB TRP A 88 -7.300 13.933 -1.541 1.00 0.00 C ATOM 1402 CG TRP A 88 -7.945 14.945 -2.440 1.00 0.00 C ATOM 1403 CD1 TRP A 88 -8.363 14.706 -3.704 1.00 0.00 C ATOM 1404 CD2 TRP A 88 -8.243 16.344 -2.165 1.00 0.00 C ATOM 1405 NE1 TRP A 88 -8.896 15.869 -4.224 1.00 0.00 N ATOM 1406 CE2 TRP A 88 -8.849 16.907 -3.313 1.00 0.00 C ATOM 1407 CE3 TRP A 88 -8.051 17.170 -1.044 1.00 0.00 C ATOM 1408 CZ2 TRP A 88 -9.250 18.243 -3.347 1.00 0.00 C ATOM 1409 CZ3 TRP A 88 -8.453 18.516 -1.074 1.00 0.00 C ATOM 1410 CH2 TRP A 88 -9.051 19.050 -2.223 1.00 0.00 C ATOM 0 H TRP A 88 -8.290 11.450 -1.556 1.00 0.00 H new ATOM 0 HA TRP A 88 -8.155 13.730 0.456 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -6.483 14.401 -0.991 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.864 13.136 -2.143 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -8.292 13.761 -4.222 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -9.278 15.952 -5.166 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -7.591 16.767 -0.154 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -9.711 18.650 -4.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -8.300 19.142 -0.207 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -9.358 20.085 -2.240 1.00 0.00 H new ATOM 1421 N LEU A 89 -10.289 14.724 -0.291 1.00 0.00 N ATOM 1422 CA LEU A 89 -11.699 15.133 -0.558 1.00 0.00 C ATOM 1423 C LEU A 89 -11.727 16.487 -1.274 1.00 0.00 C ATOM 1424 O LEU A 89 -11.123 17.447 -0.837 1.00 0.00 O ATOM 1425 CB LEU A 89 -12.333 15.237 0.834 1.00 0.00 C ATOM 1426 CG LEU A 89 -13.859 15.376 0.734 1.00 0.00 C ATOM 1427 CD1 LEU A 89 -14.226 16.594 -0.115 1.00 0.00 C ATOM 1428 CD2 LEU A 89 -14.446 14.117 0.099 1.00 0.00 C ATOM 0 H LEU A 89 -9.791 15.310 0.379 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.231 14.431 -1.200 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -12.082 14.352 1.419 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.920 16.096 1.363 1.00 0.00 H new ATOM 0 HG LEU A 89 -14.268 15.507 1.736 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -15.311 16.680 -0.178 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -13.816 17.494 0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -13.813 16.477 -1.117 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.529 14.216 0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -14.028 13.984 -0.899 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.200 13.251 0.714 1.00 0.00 H new ATOM 1440 N VAL A 90 -12.432 16.571 -2.369 1.00 0.00 N ATOM 1441 CA VAL A 90 -12.511 17.861 -3.110 1.00 0.00 C ATOM 1442 C VAL A 90 -13.706 18.676 -2.609 1.00 0.00 C ATOM 1443 O VAL A 90 -14.841 18.407 -2.952 1.00 0.00 O ATOM 1444 CB VAL A 90 -12.705 17.466 -4.575 1.00 0.00 C ATOM 1445 CG1 VAL A 90 -12.934 18.722 -5.418 1.00 0.00 C ATOM 1446 CG2 VAL A 90 -11.456 16.741 -5.072 1.00 0.00 C ATOM 0 H VAL A 90 -12.957 15.801 -2.783 1.00 0.00 H new ATOM 0 HA VAL A 90 -11.622 18.477 -2.972 1.00 0.00 H new ATOM 0 HB VAL A 90 -13.570 16.808 -4.663 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -13.072 18.440 -6.462 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -13.823 19.242 -5.062 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -12.070 19.381 -5.332 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -11.591 16.458 -6.116 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -10.593 17.401 -4.983 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -11.292 15.846 -4.472 1.00 0.00 H new ATOM 1456 N THR A 91 -13.458 19.665 -1.792 1.00 0.00 N ATOM 1457 CA THR A 91 -14.577 20.494 -1.261 1.00 0.00 C ATOM 1458 C THR A 91 -14.543 21.893 -1.880 1.00 0.00 C ATOM 1459 O THR A 91 -14.977 22.857 -1.281 1.00 0.00 O ATOM 1460 CB THR A 91 -14.330 20.574 0.245 1.00 0.00 C ATOM 1461 OG1 THR A 91 -12.932 20.541 0.496 1.00 0.00 O ATOM 1462 CG2 THR A 91 -15.005 19.389 0.938 1.00 0.00 C ATOM 0 H THR A 91 -12.528 19.934 -1.470 1.00 0.00 H new ATOM 0 HA THR A 91 -15.552 20.066 -1.495 1.00 0.00 H new ATOM 0 HB THR A 91 -14.747 21.503 0.634 1.00 0.00 H new ATOM 0 HG1 THR A 91 -12.772 20.594 1.461 1.00 0.00 H new ATOM 0 HG21 THR A 91 -14.828 19.447 2.012 1.00 0.00 H new ATOM 0 HG22 THR A 91 -16.077 19.417 0.745 1.00 0.00 H new ATOM 0 HG23 THR A 91 -14.591 18.458 0.552 1.00 0.00 H new ATOM 1470 N THR A 92 -14.032 22.013 -3.073 1.00 0.00 N ATOM 1471 CA THR A 92 -13.975 23.353 -3.722 1.00 0.00 C ATOM 1472 C THR A 92 -15.363 23.745 -4.236 1.00 0.00 C ATOM 1473 O THR A 92 -16.273 22.940 -4.273 1.00 0.00 O ATOM 1474 CB THR A 92 -12.993 23.192 -4.883 1.00 0.00 C ATOM 1475 OG1 THR A 92 -12.691 24.470 -5.425 1.00 0.00 O ATOM 1476 CG2 THR A 92 -13.618 22.310 -5.965 1.00 0.00 C ATOM 0 H THR A 92 -13.652 21.244 -3.626 1.00 0.00 H new ATOM 0 HA THR A 92 -13.659 24.136 -3.033 1.00 0.00 H new ATOM 0 HB THR A 92 -12.077 22.724 -4.523 1.00 0.00 H new ATOM 0 HG1 THR A 92 -12.060 24.369 -6.168 1.00 0.00 H new ATOM 0 HG21 THR A 92 -12.917 22.196 -6.792 1.00 0.00 H new ATOM 0 HG22 THR A 92 -13.848 21.330 -5.547 1.00 0.00 H new ATOM 0 HG23 THR A 92 -14.535 22.774 -6.328 1.00 0.00 H new ATOM 1484 N VAL A 93 -15.533 24.975 -4.634 1.00 0.00 N ATOM 1485 CA VAL A 93 -16.863 25.417 -5.146 1.00 0.00 C ATOM 1486 C VAL A 93 -16.758 25.781 -6.630 1.00 0.00 C ATOM 1487 O VAL A 93 -16.200 26.797 -6.991 1.00 0.00 O ATOM 1488 CB VAL A 93 -17.217 26.648 -4.310 1.00 0.00 C ATOM 1489 CG1 VAL A 93 -18.605 27.154 -4.704 1.00 0.00 C ATOM 1490 CG2 VAL A 93 -17.218 26.268 -2.828 1.00 0.00 C ATOM 0 H VAL A 93 -14.810 25.694 -4.627 1.00 0.00 H new ATOM 0 HA VAL A 93 -17.622 24.639 -5.063 1.00 0.00 H new ATOM 0 HB VAL A 93 -16.482 27.433 -4.489 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -18.855 28.031 -4.107 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -18.608 27.421 -5.761 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -19.342 26.371 -4.525 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -17.470 27.143 -2.228 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -17.955 25.484 -2.654 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -16.230 25.906 -2.545 1.00 0.00 H new ATOM 1500 N GLY A 94 -17.289 24.956 -7.493 1.00 0.00 N ATOM 1501 CA GLY A 94 -17.215 25.256 -8.952 1.00 0.00 C ATOM 1502 C GLY A 94 -15.913 24.689 -9.522 1.00 0.00 C ATOM 1503 O GLY A 94 -14.957 25.408 -9.737 1.00 0.00 O ATOM 0 H GLY A 94 -17.770 24.089 -7.251 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -18.071 24.821 -9.468 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -17.258 26.333 -9.116 1.00 0.00 H new ATOM 1507 N ALA A 95 -15.873 23.404 -9.767 1.00 0.00 N ATOM 1508 CA ALA A 95 -14.635 22.775 -10.324 1.00 0.00 C ATOM 1509 C ALA A 95 -14.787 21.254 -10.391 1.00 0.00 C ATOM 1510 O ALA A 95 -15.880 20.729 -10.404 1.00 0.00 O ATOM 1511 CB ALA A 95 -13.523 23.139 -9.347 1.00 0.00 C ATOM 0 H ALA A 95 -16.647 22.760 -9.605 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.429 23.124 -11.336 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.582 22.711 -9.691 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.429 24.223 -9.290 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -13.762 22.744 -8.360 1.00 0.00 H new ATOM 1517 N TYR A 96 -13.693 20.537 -10.437 1.00 0.00 N ATOM 1518 CA TYR A 96 -13.789 19.048 -10.500 1.00 0.00 C ATOM 1519 C TYR A 96 -12.394 18.407 -10.642 1.00 0.00 C ATOM 1520 O TYR A 96 -12.257 17.305 -11.136 1.00 0.00 O ATOM 1521 CB TYR A 96 -14.698 18.774 -11.719 1.00 0.00 C ATOM 1522 CG TYR A 96 -13.944 18.110 -12.850 1.00 0.00 C ATOM 1523 CD1 TYR A 96 -13.048 18.851 -13.628 1.00 0.00 C ATOM 1524 CD2 TYR A 96 -14.148 16.753 -13.120 1.00 0.00 C ATOM 1525 CE1 TYR A 96 -12.356 18.236 -14.676 1.00 0.00 C ATOM 1526 CE2 TYR A 96 -13.457 16.136 -14.168 1.00 0.00 C ATOM 1527 CZ TYR A 96 -12.560 16.877 -14.946 1.00 0.00 C ATOM 1528 OH TYR A 96 -11.878 16.270 -15.980 1.00 0.00 O ATOM 0 H TYR A 96 -12.745 20.914 -10.434 1.00 0.00 H new ATOM 0 HA TYR A 96 -14.202 18.610 -9.591 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -15.530 18.138 -11.415 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -15.126 19.713 -12.070 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -12.891 19.899 -13.419 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -14.839 16.181 -12.519 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -11.665 18.809 -15.277 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -13.616 15.088 -14.377 1.00 0.00 H new ATOM 0 HH TYR A 96 -12.134 15.325 -16.031 1.00 0.00 H new ATOM 1538 N LEU A 97 -11.360 19.073 -10.198 1.00 0.00 N ATOM 1539 CA LEU A 97 -9.994 18.481 -10.305 1.00 0.00 C ATOM 1540 C LEU A 97 -9.922 17.177 -9.504 1.00 0.00 C ATOM 1541 O LEU A 97 -9.964 17.192 -8.290 1.00 0.00 O ATOM 1542 CB LEU A 97 -9.051 19.533 -9.712 1.00 0.00 C ATOM 1543 CG LEU A 97 -9.618 20.051 -8.389 1.00 0.00 C ATOM 1544 CD1 LEU A 97 -8.601 19.812 -7.269 1.00 0.00 C ATOM 1545 CD2 LEU A 97 -9.899 21.550 -8.511 1.00 0.00 C ATOM 0 H LEU A 97 -11.402 19.997 -9.768 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.729 18.238 -11.334 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -8.064 19.100 -9.550 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.926 20.359 -10.413 1.00 0.00 H new ATOM 0 HG LEU A 97 -10.543 19.524 -8.157 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -9.005 20.181 -6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -8.398 18.745 -7.184 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -7.676 20.340 -7.499 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -10.303 21.922 -7.570 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.973 22.076 -8.741 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -10.622 21.721 -9.309 1.00 0.00 H new ATOM 1557 N PRO A 98 -9.822 16.086 -10.217 1.00 0.00 N ATOM 1558 CA PRO A 98 -9.750 14.758 -9.568 1.00 0.00 C ATOM 1559 C PRO A 98 -8.336 14.484 -9.045 1.00 0.00 C ATOM 1560 O PRO A 98 -7.999 14.834 -7.931 1.00 0.00 O ATOM 1561 CB PRO A 98 -10.108 13.793 -10.692 1.00 0.00 C ATOM 1562 CG PRO A 98 -9.750 14.506 -11.960 1.00 0.00 C ATOM 1563 CD PRO A 98 -9.766 15.989 -11.680 1.00 0.00 C ATOM 0 HA PRO A 98 -10.411 14.670 -8.705 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.555 12.858 -10.598 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.168 13.540 -10.670 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -8.765 14.194 -12.308 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -10.460 14.259 -12.750 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -8.876 16.477 -12.076 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -10.627 16.471 -12.143 1.00 0.00 H new ATOM 1571 N ALA A 99 -7.506 13.858 -9.838 1.00 0.00 N ATOM 1572 CA ALA A 99 -6.118 13.559 -9.380 1.00 0.00 C ATOM 1573 C ALA A 99 -5.414 12.645 -10.390 1.00 0.00 C ATOM 1574 O ALA A 99 -5.791 12.573 -11.543 1.00 0.00 O ATOM 1575 CB ALA A 99 -6.294 12.844 -8.040 1.00 0.00 C ATOM 0 H ALA A 99 -7.729 13.542 -10.782 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.508 14.457 -9.287 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -5.316 12.588 -7.633 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.816 13.500 -7.344 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -6.875 11.934 -8.187 1.00 0.00 H new ATOM 1581 N VAL A 100 -4.399 11.943 -9.966 1.00 0.00 N ATOM 1582 CA VAL A 100 -3.677 11.030 -10.906 1.00 0.00 C ATOM 1583 C VAL A 100 -3.888 9.571 -10.487 1.00 0.00 C ATOM 1584 O VAL A 100 -4.413 8.772 -11.238 1.00 0.00 O ATOM 1585 CB VAL A 100 -2.185 11.409 -10.834 1.00 0.00 C ATOM 1586 CG1 VAL A 100 -1.854 12.364 -11.981 1.00 0.00 C ATOM 1587 CG2 VAL A 100 -1.855 12.098 -9.504 1.00 0.00 C ATOM 0 H VAL A 100 -4.037 11.960 -9.013 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.051 11.133 -11.925 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.594 10.497 -10.911 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.799 12.636 -11.935 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.062 11.875 -12.933 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.464 13.263 -11.894 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.796 12.354 -9.480 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.450 13.006 -9.407 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.084 11.424 -8.678 1.00 0.00 H new ATOM 1597 N PHE A 101 -3.498 9.217 -9.292 1.00 0.00 N ATOM 1598 CA PHE A 101 -3.694 7.812 -8.829 1.00 0.00 C ATOM 1599 C PHE A 101 -4.929 7.739 -7.934 1.00 0.00 C ATOM 1600 O PHE A 101 -5.161 6.758 -7.256 1.00 0.00 O ATOM 1601 CB PHE A 101 -2.445 7.471 -8.014 1.00 0.00 C ATOM 1602 CG PHE A 101 -1.214 7.503 -8.890 1.00 0.00 C ATOM 1603 CD1 PHE A 101 -1.336 7.585 -10.282 1.00 0.00 C ATOM 1604 CD2 PHE A 101 0.055 7.445 -8.301 1.00 0.00 C ATOM 1605 CE1 PHE A 101 -0.190 7.608 -11.085 1.00 0.00 C ATOM 1606 CE2 PHE A 101 1.201 7.470 -9.104 1.00 0.00 C ATOM 1607 CZ PHE A 101 1.079 7.551 -10.495 1.00 0.00 C ATOM 0 H PHE A 101 -3.053 9.839 -8.617 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.837 7.122 -9.661 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.334 8.181 -7.195 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.554 6.483 -7.567 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.315 7.631 -10.736 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.149 7.381 -7.227 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.284 7.670 -12.159 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.180 7.427 -8.649 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.964 7.570 -11.114 1.00 0.00 H new ATOM 1617 N GLU A 102 -5.714 8.779 -7.911 1.00 0.00 N ATOM 1618 CA GLU A 102 -6.922 8.774 -7.045 1.00 0.00 C ATOM 1619 C GLU A 102 -8.162 8.360 -7.838 1.00 0.00 C ATOM 1620 O GLU A 102 -8.212 8.474 -9.047 1.00 0.00 O ATOM 1621 CB GLU A 102 -7.058 10.214 -6.554 1.00 0.00 C ATOM 1622 CG GLU A 102 -7.562 10.211 -5.111 1.00 0.00 C ATOM 1623 CD GLU A 102 -7.235 11.549 -4.453 1.00 0.00 C ATOM 1624 OE1 GLU A 102 -6.405 12.265 -4.990 1.00 0.00 O ATOM 1625 OE2 GLU A 102 -7.819 11.835 -3.422 1.00 0.00 O ATOM 0 H GLU A 102 -5.571 9.630 -8.454 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.830 8.063 -6.224 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.096 10.723 -6.614 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.750 10.764 -7.192 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.638 10.038 -5.091 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -7.098 9.397 -4.554 1.00 0.00 H new ATOM 1632 N GLU A 103 -9.165 7.884 -7.156 1.00 0.00 N ATOM 1633 CA GLU A 103 -10.417 7.464 -7.842 1.00 0.00 C ATOM 1634 C GLU A 103 -11.622 7.892 -7.004 1.00 0.00 C ATOM 1635 O GLU A 103 -11.690 7.626 -5.821 1.00 0.00 O ATOM 1636 CB GLU A 103 -10.330 5.940 -7.924 1.00 0.00 C ATOM 1637 CG GLU A 103 -9.902 5.380 -6.566 1.00 0.00 C ATOM 1638 CD GLU A 103 -10.783 4.182 -6.208 1.00 0.00 C ATOM 1639 OE1 GLU A 103 -11.100 3.416 -7.104 1.00 0.00 O ATOM 1640 OE2 GLU A 103 -11.126 4.050 -5.045 1.00 0.00 O ATOM 0 H GLU A 103 -9.171 7.767 -6.143 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.531 7.913 -8.829 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -11.296 5.525 -8.213 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.615 5.647 -8.692 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -8.855 5.078 -6.599 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -9.988 6.150 -5.800 1.00 0.00 H new ATOM 1647 N VAL A 104 -12.568 8.563 -7.598 1.00 0.00 N ATOM 1648 CA VAL A 104 -13.754 9.010 -6.816 1.00 0.00 C ATOM 1649 C VAL A 104 -14.691 7.835 -6.549 1.00 0.00 C ATOM 1650 O VAL A 104 -14.757 6.892 -7.311 1.00 0.00 O ATOM 1651 CB VAL A 104 -14.440 10.059 -7.690 1.00 0.00 C ATOM 1652 CG1 VAL A 104 -14.758 9.457 -9.058 1.00 0.00 C ATOM 1653 CG2 VAL A 104 -15.739 10.501 -7.013 1.00 0.00 C ATOM 0 H VAL A 104 -12.572 8.820 -8.585 1.00 0.00 H new ATOM 0 HA VAL A 104 -13.473 9.414 -5.844 1.00 0.00 H new ATOM 0 HB VAL A 104 -13.781 10.917 -7.819 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.247 10.206 -9.680 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -13.834 9.134 -9.537 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -15.420 8.600 -8.933 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -16.235 11.250 -7.631 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -16.396 9.640 -6.889 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -15.513 10.928 -6.036 1.00 0.00 H new ATOM 1663 N LEU A 105 -15.421 7.890 -5.471 1.00 0.00 N ATOM 1664 CA LEU A 105 -16.361 6.782 -5.150 1.00 0.00 C ATOM 1665 C LEU A 105 -17.793 7.217 -5.463 1.00 0.00 C ATOM 1666 O LEU A 105 -18.665 6.404 -5.701 1.00 0.00 O ATOM 1667 CB LEU A 105 -16.195 6.529 -3.645 1.00 0.00 C ATOM 1668 CG LEU A 105 -14.706 6.453 -3.269 1.00 0.00 C ATOM 1669 CD1 LEU A 105 -13.914 5.746 -4.373 1.00 0.00 C ATOM 1670 CD2 LEU A 105 -14.151 7.867 -3.070 1.00 0.00 C ATOM 0 H LEU A 105 -15.407 8.656 -4.797 1.00 0.00 H new ATOM 0 HA LEU A 105 -16.156 5.883 -5.732 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -16.677 7.327 -3.081 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -16.693 5.599 -3.370 1.00 0.00 H new ATOM 0 HG LEU A 105 -14.607 5.887 -2.343 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -12.862 5.700 -4.093 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -14.299 4.735 -4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -14.017 6.300 -5.306 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -13.096 7.809 -2.804 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -14.262 8.435 -3.994 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -14.700 8.364 -2.271 1.00 0.00 H new ATOM 1682 N ASP A 106 -18.039 8.499 -5.462 1.00 0.00 N ATOM 1683 CA ASP A 106 -19.412 9.003 -5.754 1.00 0.00 C ATOM 1684 C ASP A 106 -19.474 10.514 -5.512 1.00 0.00 C ATOM 1685 O ASP A 106 -18.654 11.072 -4.811 1.00 0.00 O ATOM 1686 CB ASP A 106 -20.324 8.265 -4.769 1.00 0.00 C ATOM 1687 CG ASP A 106 -19.669 8.239 -3.386 1.00 0.00 C ATOM 1688 OD1 ASP A 106 -19.902 9.163 -2.625 1.00 0.00 O ATOM 1689 OD2 ASP A 106 -18.944 7.295 -3.114 1.00 0.00 O ATOM 0 H ASP A 106 -17.345 9.222 -5.271 1.00 0.00 H new ATOM 0 HA ASP A 106 -19.708 8.830 -6.789 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -21.294 8.760 -4.714 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -20.504 7.248 -5.117 1.00 0.00 H new ATOM 1694 N LEU A 107 -20.441 11.181 -6.079 1.00 0.00 N ATOM 1695 CA LEU A 107 -20.549 12.654 -5.869 1.00 0.00 C ATOM 1696 C LEU A 107 -21.552 12.942 -4.750 1.00 0.00 C ATOM 1697 O LEU A 107 -22.620 12.365 -4.701 1.00 0.00 O ATOM 1698 CB LEU A 107 -21.051 13.211 -7.202 1.00 0.00 C ATOM 1699 CG LEU A 107 -20.025 12.917 -8.299 1.00 0.00 C ATOM 1700 CD1 LEU A 107 -20.434 11.655 -9.061 1.00 0.00 C ATOM 1701 CD2 LEU A 107 -19.970 14.100 -9.268 1.00 0.00 C ATOM 0 H LEU A 107 -21.159 10.772 -6.677 1.00 0.00 H new ATOM 0 HA LEU A 107 -19.601 13.106 -5.577 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -22.011 12.762 -7.457 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -21.214 14.286 -7.121 1.00 0.00 H new ATOM 0 HG LEU A 107 -19.044 12.764 -7.848 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -19.702 11.448 -9.841 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -20.478 10.812 -8.372 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -21.414 11.805 -9.514 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -19.240 13.895 -10.051 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -20.952 14.249 -9.717 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -19.678 15.000 -8.727 1.00 0.00 H new ATOM 1713 N VAL A 108 -21.220 13.823 -3.845 1.00 0.00 N ATOM 1714 CA VAL A 108 -22.164 14.126 -2.730 1.00 0.00 C ATOM 1715 C VAL A 108 -22.520 15.615 -2.710 1.00 0.00 C ATOM 1716 O VAL A 108 -21.789 16.446 -3.206 1.00 0.00 O ATOM 1717 CB VAL A 108 -21.409 13.746 -1.457 1.00 0.00 C ATOM 1718 CG1 VAL A 108 -20.261 14.732 -1.228 1.00 0.00 C ATOM 1719 CG2 VAL A 108 -22.367 13.794 -0.266 1.00 0.00 C ATOM 0 H VAL A 108 -20.343 14.343 -3.829 1.00 0.00 H new ATOM 0 HA VAL A 108 -23.102 13.580 -2.834 1.00 0.00 H new ATOM 0 HB VAL A 108 -21.005 12.739 -1.561 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -19.723 14.460 -0.320 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -19.579 14.699 -2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -20.662 15.740 -1.124 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -21.831 13.523 0.643 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -22.770 14.802 -0.163 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -23.184 13.091 -0.428 1.00 0.00 H new ATOM 1729 N ASP A 109 -23.638 15.952 -2.129 1.00 0.00 N ATOM 1730 CA ASP A 109 -24.046 17.384 -2.059 1.00 0.00 C ATOM 1731 C ASP A 109 -23.961 17.874 -0.610 1.00 0.00 C ATOM 1732 O ASP A 109 -24.447 17.231 0.298 1.00 0.00 O ATOM 1733 CB ASP A 109 -25.493 17.408 -2.549 1.00 0.00 C ATOM 1734 CG ASP A 109 -25.512 17.529 -4.073 1.00 0.00 C ATOM 1735 OD1 ASP A 109 -25.315 16.518 -4.730 1.00 0.00 O ATOM 1736 OD2 ASP A 109 -25.721 18.628 -4.558 1.00 0.00 O ATOM 0 H ASP A 109 -24.289 15.295 -1.698 1.00 0.00 H new ATOM 0 HA ASP A 109 -23.406 18.032 -2.658 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -26.008 16.499 -2.239 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -26.027 18.246 -2.100 1.00 0.00 H new ATOM 1741 N ALA A 110 -23.344 18.999 -0.384 1.00 0.00 N ATOM 1742 CA ALA A 110 -23.228 19.511 1.013 1.00 0.00 C ATOM 1743 C ALA A 110 -24.418 20.414 1.359 1.00 0.00 C ATOM 1744 O ALA A 110 -24.286 21.371 2.095 1.00 0.00 O ATOM 1745 CB ALA A 110 -21.925 20.308 1.038 1.00 0.00 C ATOM 0 H ALA A 110 -22.916 19.585 -1.101 1.00 0.00 H new ATOM 0 HA ALA A 110 -23.227 18.703 1.744 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -21.769 20.718 2.036 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -21.093 19.653 0.780 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -21.983 21.122 0.316 1.00 0.00 H new