USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 901 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 42 ASN : amide:sc= -1.26 X(o=-5.2,f=-5.4) USER MOD Set 1.2: A 74 GLN : amide:sc= -3.98 K(o=-5.2,f=-7.7!) USER MOD Set 2.1: A 47 SER OG : rot -19:sc= -1.06 USER MOD Set 2.2: A 77 GLN : amide:sc= -0.443 X(o=-1.5,f=-1.2) USER MOD Set 3.1: A 21 GLN : amide:sc= -2.94 K(o=-2,f=-7.3!) USER MOD Set 3.2: A 52 SER OG : rot -55:sc= 0.947 USER MOD Single : A 22 CYS SG : rot -160:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -2.41! X(o=-2.4!,f=-2.1) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= -0.187 K(o=-0.19,f=-4!) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= -0.0238 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN :FLIP amide:sc= -0.7 F(o=-2.2,f=-0.7) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -150:sc= -0.415 (180deg=-2.5!) USER MOD Single : A 80 GLN : amide:sc= -0.0305 K(o=-0.031,f=-0.58) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 15:sc= -1.35 USER MOD Single : A 92 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00428) USER MOD Single : A 93 THR OG1 : rot 170:sc= -3.42! USER MOD Single : A 95 MET CE :methyl 161:sc= -3.28! (180deg=-3.73!) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0548 USER MOD Single : A 102 TYR OH : rot 30:sc= -0.0987 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 MET CE :methyl -150:sc= -1.62 (180deg=-3.97!) USER MOD Single : A 111 GLN : amide:sc= -1.09 K(o=-1.1,f=-2.3) USER MOD Single : A 113 THR OG1 : rot 16:sc= -0.761 USER MOD Single : A 115 MET CE :methyl -140:sc= -4.13! (180deg=-6.99!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 79:sc= 0.967 USER MOD Single : A 134 ASN : amide:sc= -0.337 X(o=-0.34,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 81 N GLU A 9 10.402 -9.785 9.139 1.00 0.00 N ATOM 82 CA GLU A 9 11.378 -9.821 8.064 1.00 0.00 C ATOM 83 C GLU A 9 10.722 -9.429 6.738 1.00 0.00 C ATOM 84 O GLU A 9 11.343 -8.770 5.905 1.00 0.00 O ATOM 85 CB GLU A 9 12.035 -11.199 7.965 1.00 0.00 C ATOM 86 CG GLU A 9 10.990 -12.288 7.714 1.00 0.00 C ATOM 87 CD GLU A 9 11.602 -13.681 7.866 1.00 0.00 C ATOM 88 OE1 GLU A 9 11.658 -14.153 9.022 1.00 0.00 O ATOM 89 OE2 GLU A 9 12.001 -14.243 6.823 1.00 0.00 O ATOM 0 HA GLU A 9 12.162 -9.097 8.287 1.00 0.00 H new ATOM 0 HB2 GLU A 9 12.767 -11.200 7.157 1.00 0.00 H new ATOM 0 HB3 GLU A 9 12.576 -11.415 8.886 1.00 0.00 H new ATOM 0 HG2 GLU A 9 10.163 -12.172 8.415 1.00 0.00 H new ATOM 0 HG3 GLU A 9 10.577 -12.176 6.712 1.00 0.00 H new ATOM 96 N LEU A 10 9.476 -9.852 6.584 1.00 0.00 N ATOM 97 CA LEU A 10 8.729 -9.554 5.374 1.00 0.00 C ATOM 98 C LEU A 10 8.226 -8.110 5.433 1.00 0.00 C ATOM 99 O LEU A 10 8.327 -7.373 4.453 1.00 0.00 O ATOM 100 CB LEU A 10 7.618 -10.584 5.162 1.00 0.00 C ATOM 101 CG LEU A 10 6.220 -10.019 4.901 1.00 0.00 C ATOM 102 CD1 LEU A 10 6.170 -9.279 3.563 1.00 0.00 C ATOM 103 CD2 LEU A 10 5.160 -11.118 4.988 1.00 0.00 C ATOM 0 H LEU A 10 8.965 -10.399 7.277 1.00 0.00 H new ATOM 0 HA LEU A 10 9.375 -9.632 4.499 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.894 -11.219 4.320 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.571 -11.225 6.043 1.00 0.00 H new ATOM 0 HG LEU A 10 5.994 -9.291 5.680 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.166 -8.887 3.401 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.883 -8.455 3.576 1.00 0.00 H new ATOM 0 HD13 LEU A 10 6.425 -9.967 2.757 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.176 -10.690 4.799 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.371 -11.886 4.244 1.00 0.00 H new ATOM 0 HD23 LEU A 10 5.177 -11.562 5.983 1.00 0.00 H new ATOM 115 N GLU A 11 7.695 -7.749 6.592 1.00 0.00 N ATOM 116 CA GLU A 11 7.175 -6.407 6.791 1.00 0.00 C ATOM 117 C GLU A 11 8.290 -5.374 6.609 1.00 0.00 C ATOM 118 O GLU A 11 8.131 -4.410 5.862 1.00 0.00 O ATOM 119 CB GLU A 11 6.522 -6.271 8.168 1.00 0.00 C ATOM 120 CG GLU A 11 5.130 -5.645 8.055 1.00 0.00 C ATOM 121 CD GLU A 11 4.275 -5.986 9.277 1.00 0.00 C ATOM 122 OE1 GLU A 11 4.423 -5.270 10.291 1.00 0.00 O ATOM 123 OE2 GLU A 11 3.493 -6.955 9.170 1.00 0.00 O ATOM 0 H GLU A 11 7.614 -8.363 7.403 1.00 0.00 H new ATOM 0 HA GLU A 11 6.407 -6.221 6.041 1.00 0.00 H new ATOM 0 HB2 GLU A 11 6.447 -7.252 8.637 1.00 0.00 H new ATOM 0 HB3 GLU A 11 7.150 -5.656 8.813 1.00 0.00 H new ATOM 0 HG2 GLU A 11 5.221 -4.563 7.961 1.00 0.00 H new ATOM 0 HG3 GLU A 11 4.638 -6.004 7.151 1.00 0.00 H new ATOM 130 N GLU A 12 9.393 -5.612 7.303 1.00 0.00 N ATOM 131 CA GLU A 12 10.533 -4.715 7.227 1.00 0.00 C ATOM 132 C GLU A 12 10.753 -4.258 5.783 1.00 0.00 C ATOM 133 O GLU A 12 10.924 -3.067 5.525 1.00 0.00 O ATOM 134 CB GLU A 12 11.791 -5.378 7.790 1.00 0.00 C ATOM 135 CG GLU A 12 11.599 -5.760 9.259 1.00 0.00 C ATOM 136 CD GLU A 12 12.485 -4.907 10.169 1.00 0.00 C ATOM 137 OE1 GLU A 12 12.327 -3.668 10.114 1.00 0.00 O ATOM 138 OE2 GLU A 12 13.300 -5.512 10.898 1.00 0.00 O ATOM 0 H GLU A 12 9.521 -6.413 7.921 1.00 0.00 H new ATOM 0 HA GLU A 12 10.321 -3.837 7.837 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.029 -6.268 7.207 1.00 0.00 H new ATOM 0 HB3 GLU A 12 12.638 -4.699 7.695 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.553 -5.630 9.538 1.00 0.00 H new ATOM 0 HG3 GLU A 12 11.838 -6.814 9.398 1.00 0.00 H new ATOM 145 N ARG A 13 10.743 -5.228 4.881 1.00 0.00 N ATOM 146 CA ARG A 13 10.939 -4.940 3.471 1.00 0.00 C ATOM 147 C ARG A 13 9.836 -4.011 2.960 1.00 0.00 C ATOM 148 O ARG A 13 10.121 -2.965 2.379 1.00 0.00 O ATOM 149 CB ARG A 13 10.939 -6.226 2.641 1.00 0.00 C ATOM 150 CG ARG A 13 12.352 -6.573 2.168 1.00 0.00 C ATOM 151 CD ARG A 13 12.531 -8.088 2.043 1.00 0.00 C ATOM 152 NE ARG A 13 13.965 -8.416 1.884 1.00 0.00 N ATOM 153 CZ ARG A 13 14.430 -9.647 1.629 1.00 0.00 C ATOM 154 NH1 ARG A 13 13.578 -10.673 1.503 1.00 0.00 N ATOM 155 NH2 ARG A 13 15.748 -9.852 1.500 1.00 0.00 N ATOM 0 H ARG A 13 10.602 -6.214 5.099 1.00 0.00 H new ATOM 0 HA ARG A 13 11.908 -4.452 3.364 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.539 -7.047 3.236 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.282 -6.107 1.779 1.00 0.00 H new ATOM 0 HG2 ARG A 13 12.544 -6.100 1.205 1.00 0.00 H new ATOM 0 HG3 ARG A 13 13.083 -6.173 2.871 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.132 -8.584 2.928 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.967 -8.460 1.187 1.00 0.00 H new ATOM 0 HE ARG A 13 14.642 -7.658 1.974 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.575 -10.518 1.601 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.933 -11.609 1.309 1.00 0.00 H new ATOM 0 HH21 ARG A 13 16.397 -9.071 1.596 1.00 0.00 H new ATOM 0 HH22 ARG A 13 16.102 -10.789 1.306 1.00 0.00 H new ATOM 169 N LEU A 14 8.601 -4.427 3.194 1.00 0.00 N ATOM 170 CA LEU A 14 7.454 -3.645 2.765 1.00 0.00 C ATOM 171 C LEU A 14 7.731 -2.162 3.014 1.00 0.00 C ATOM 172 O LEU A 14 7.656 -1.349 2.094 1.00 0.00 O ATOM 173 CB LEU A 14 6.177 -4.154 3.437 1.00 0.00 C ATOM 174 CG LEU A 14 5.318 -5.111 2.608 1.00 0.00 C ATOM 175 CD1 LEU A 14 6.182 -5.936 1.653 1.00 0.00 C ATOM 176 CD2 LEU A 14 4.457 -5.997 3.511 1.00 0.00 C ATOM 0 H LEU A 14 8.369 -5.296 3.675 1.00 0.00 H new ATOM 0 HA LEU A 14 7.292 -3.763 1.694 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.453 -4.656 4.364 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.566 -3.294 3.710 1.00 0.00 H new ATOM 0 HG LEU A 14 4.639 -4.517 1.996 1.00 0.00 H new ATOM 0 HD11 LEU A 14 5.547 -6.608 1.076 1.00 0.00 H new ATOM 0 HD12 LEU A 14 6.714 -5.269 0.975 1.00 0.00 H new ATOM 0 HD13 LEU A 14 6.902 -6.520 2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.856 -6.668 2.897 1.00 0.00 H new ATOM 0 HD22 LEU A 14 5.101 -6.584 4.166 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.800 -5.371 4.115 1.00 0.00 H new ATOM 188 N VAL A 15 8.045 -1.853 4.264 1.00 0.00 N ATOM 189 CA VAL A 15 8.334 -0.481 4.646 1.00 0.00 C ATOM 190 C VAL A 15 9.572 0.005 3.890 1.00 0.00 C ATOM 191 O VAL A 15 9.507 0.987 3.152 1.00 0.00 O ATOM 192 CB VAL A 15 8.485 -0.382 6.166 1.00 0.00 C ATOM 193 CG1 VAL A 15 8.689 1.070 6.603 1.00 0.00 C ATOM 194 CG2 VAL A 15 7.283 -1.005 6.878 1.00 0.00 C ATOM 0 H VAL A 15 8.106 -2.529 5.025 1.00 0.00 H new ATOM 0 HA VAL A 15 7.507 0.174 4.371 1.00 0.00 H new ATOM 0 HB VAL A 15 9.373 -0.946 6.452 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.793 1.112 7.687 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.590 1.467 6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.829 1.666 6.298 1.00 0.00 H new ATOM 0 HG21 VAL A 15 7.416 -0.921 7.957 1.00 0.00 H new ATOM 0 HG22 VAL A 15 6.374 -0.482 6.583 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.202 -2.057 6.603 1.00 0.00 H new ATOM 204 N GLU A 16 10.670 -0.706 4.098 1.00 0.00 N ATOM 205 CA GLU A 16 11.921 -0.360 3.445 1.00 0.00 C ATOM 206 C GLU A 16 11.670 0.019 1.984 1.00 0.00 C ATOM 207 O GLU A 16 12.388 0.843 1.420 1.00 0.00 O ATOM 208 CB GLU A 16 12.929 -1.506 3.548 1.00 0.00 C ATOM 209 CG GLU A 16 13.506 -1.602 4.962 1.00 0.00 C ATOM 210 CD GLU A 16 15.036 -1.591 4.932 1.00 0.00 C ATOM 211 OE1 GLU A 16 15.603 -2.618 4.501 1.00 0.00 O ATOM 212 OE2 GLU A 16 15.604 -0.555 5.340 1.00 0.00 O ATOM 0 H GLU A 16 10.719 -1.521 4.710 1.00 0.00 H new ATOM 0 HA GLU A 16 12.348 0.503 3.956 1.00 0.00 H new ATOM 0 HB2 GLU A 16 12.445 -2.446 3.284 1.00 0.00 H new ATOM 0 HB3 GLU A 16 13.736 -1.351 2.832 1.00 0.00 H new ATOM 0 HG2 GLU A 16 13.145 -0.768 5.563 1.00 0.00 H new ATOM 0 HG3 GLU A 16 13.155 -2.516 5.441 1.00 0.00 H new ATOM 219 N TRP A 17 10.647 -0.601 1.412 1.00 0.00 N ATOM 220 CA TRP A 17 10.292 -0.339 0.028 1.00 0.00 C ATOM 221 C TRP A 17 9.534 0.989 -0.022 1.00 0.00 C ATOM 222 O TRP A 17 10.015 1.961 -0.603 1.00 0.00 O ATOM 223 CB TRP A 17 9.497 -1.504 -0.564 1.00 0.00 C ATOM 224 CG TRP A 17 8.992 -1.254 -1.986 1.00 0.00 C ATOM 225 CD1 TRP A 17 9.555 -0.501 -2.942 1.00 0.00 C ATOM 226 CD2 TRP A 17 7.790 -1.790 -2.579 1.00 0.00 C ATOM 227 NE1 TRP A 17 8.807 -0.514 -4.102 1.00 0.00 N ATOM 228 CE2 TRP A 17 7.700 -1.323 -3.874 1.00 0.00 C ATOM 229 CE3 TRP A 17 6.812 -2.643 -2.038 1.00 0.00 C ATOM 230 CZ2 TRP A 17 6.648 -1.653 -4.737 1.00 0.00 C ATOM 231 CZ3 TRP A 17 5.767 -2.964 -2.913 1.00 0.00 C ATOM 232 CH2 TRP A 17 5.662 -2.501 -4.219 1.00 0.00 C ATOM 0 H TRP A 17 10.053 -1.284 1.883 1.00 0.00 H new ATOM 0 HA TRP A 17 11.186 -0.253 -0.590 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.124 -2.396 -0.564 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.644 -1.714 0.082 1.00 0.00 H new ATOM 0 HD1 TRP A 17 10.478 0.047 -2.820 1.00 0.00 H new ATOM 0 HE1 TRP A 17 9.026 -0.021 -4.967 1.00 0.00 H new ATOM 0 HE3 TRP A 17 6.863 -3.021 -1.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 6.600 -1.274 -5.747 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 4.988 -3.617 -2.547 1.00 0.00 H new ATOM 0 HH2 TRP A 17 4.823 -2.794 -4.832 1.00 0.00 H new ATOM 243 N ILE A 18 8.361 0.988 0.594 1.00 0.00 N ATOM 244 CA ILE A 18 7.531 2.180 0.626 1.00 0.00 C ATOM 245 C ILE A 18 8.407 3.397 0.931 1.00 0.00 C ATOM 246 O ILE A 18 8.080 4.516 0.538 1.00 0.00 O ATOM 247 CB ILE A 18 6.369 1.998 1.605 1.00 0.00 C ATOM 248 CG1 ILE A 18 5.448 0.861 1.157 1.00 0.00 C ATOM 249 CG2 ILE A 18 5.606 3.310 1.801 1.00 0.00 C ATOM 250 CD1 ILE A 18 5.161 -0.099 2.313 1.00 0.00 C ATOM 0 H ILE A 18 7.966 0.180 1.075 1.00 0.00 H new ATOM 0 HA ILE A 18 7.073 2.352 -0.348 1.00 0.00 H new ATOM 0 HB ILE A 18 6.780 1.717 2.575 1.00 0.00 H new ATOM 0 HG12 ILE A 18 4.512 1.273 0.781 1.00 0.00 H new ATOM 0 HG13 ILE A 18 5.910 0.317 0.334 1.00 0.00 H new ATOM 0 HG21 ILE A 18 4.786 3.153 2.501 1.00 0.00 H new ATOM 0 HG22 ILE A 18 6.281 4.068 2.198 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.207 3.645 0.844 1.00 0.00 H new ATOM 0 HD11 ILE A 18 4.504 -0.898 1.968 1.00 0.00 H new ATOM 0 HD12 ILE A 18 6.097 -0.528 2.671 1.00 0.00 H new ATOM 0 HD13 ILE A 18 4.677 0.444 3.125 1.00 0.00 H new ATOM 262 N VAL A 19 9.502 3.138 1.630 1.00 0.00 N ATOM 263 CA VAL A 19 10.427 4.198 1.992 1.00 0.00 C ATOM 264 C VAL A 19 11.090 4.745 0.727 1.00 0.00 C ATOM 265 O VAL A 19 11.047 5.947 0.469 1.00 0.00 O ATOM 266 CB VAL A 19 11.436 3.684 3.021 1.00 0.00 C ATOM 267 CG1 VAL A 19 12.641 4.621 3.123 1.00 0.00 C ATOM 268 CG2 VAL A 19 10.775 3.489 4.387 1.00 0.00 C ATOM 0 H VAL A 19 9.769 2.209 1.955 1.00 0.00 H new ATOM 0 HA VAL A 19 9.895 5.024 2.463 1.00 0.00 H new ATOM 0 HB VAL A 19 11.795 2.713 2.681 1.00 0.00 H new ATOM 0 HG11 VAL A 19 13.343 4.232 3.861 1.00 0.00 H new ATOM 0 HG12 VAL A 19 13.134 4.687 2.153 1.00 0.00 H new ATOM 0 HG13 VAL A 19 12.306 5.613 3.428 1.00 0.00 H new ATOM 0 HG21 VAL A 19 11.514 3.123 5.100 1.00 0.00 H new ATOM 0 HG22 VAL A 19 10.374 4.440 4.736 1.00 0.00 H new ATOM 0 HG23 VAL A 19 9.966 2.764 4.299 1.00 0.00 H new ATOM 278 N VAL A 20 11.688 3.836 -0.030 1.00 0.00 N ATOM 279 CA VAL A 20 12.359 4.213 -1.262 1.00 0.00 C ATOM 280 C VAL A 20 11.323 4.711 -2.271 1.00 0.00 C ATOM 281 O VAL A 20 11.581 5.654 -3.017 1.00 0.00 O ATOM 282 CB VAL A 20 13.188 3.038 -1.787 1.00 0.00 C ATOM 283 CG1 VAL A 20 13.793 2.236 -0.634 1.00 0.00 C ATOM 284 CG2 VAL A 20 12.349 2.140 -2.699 1.00 0.00 C ATOM 0 H VAL A 20 11.722 2.840 0.186 1.00 0.00 H new ATOM 0 HA VAL A 20 13.056 5.031 -1.082 1.00 0.00 H new ATOM 0 HB VAL A 20 14.008 3.444 -2.379 1.00 0.00 H new ATOM 0 HG11 VAL A 20 14.377 1.407 -1.034 1.00 0.00 H new ATOM 0 HG12 VAL A 20 14.440 2.883 -0.041 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.994 1.846 -0.004 1.00 0.00 H new ATOM 0 HG21 VAL A 20 12.961 1.313 -3.059 1.00 0.00 H new ATOM 0 HG22 VAL A 20 11.500 1.747 -2.141 1.00 0.00 H new ATOM 0 HG23 VAL A 20 11.988 2.720 -3.548 1.00 0.00 H new ATOM 294 N GLN A 21 10.171 4.055 -2.261 1.00 0.00 N ATOM 295 CA GLN A 21 9.094 4.420 -3.166 1.00 0.00 C ATOM 296 C GLN A 21 8.638 5.855 -2.897 1.00 0.00 C ATOM 297 O GLN A 21 8.888 6.751 -3.702 1.00 0.00 O ATOM 298 CB GLN A 21 7.924 3.441 -3.047 1.00 0.00 C ATOM 299 CG GLN A 21 8.270 2.094 -3.684 1.00 0.00 C ATOM 300 CD GLN A 21 7.715 2.001 -5.107 1.00 0.00 C ATOM 301 OE1 GLN A 21 6.728 1.335 -5.374 1.00 0.00 O ATOM 302 NE2 GLN A 21 8.403 2.704 -6.003 1.00 0.00 N ATOM 0 H GLN A 21 9.960 3.273 -1.641 1.00 0.00 H new ATOM 0 HA GLN A 21 9.469 4.365 -4.188 1.00 0.00 H new ATOM 0 HB2 GLN A 21 7.671 3.296 -1.997 1.00 0.00 H new ATOM 0 HB3 GLN A 21 7.043 3.861 -3.532 1.00 0.00 H new ATOM 0 HG2 GLN A 21 9.352 1.964 -3.703 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.862 1.285 -3.077 1.00 0.00 H new ATOM 0 HE21 GLN A 21 9.220 3.240 -5.712 1.00 0.00 H new ATOM 0 HE22 GLN A 21 8.113 2.707 -6.981 1.00 0.00 H new ATOM 311 N CYS A 22 7.977 6.029 -1.762 1.00 0.00 N ATOM 312 CA CYS A 22 7.483 7.340 -1.377 1.00 0.00 C ATOM 313 C CYS A 22 8.685 8.264 -1.169 1.00 0.00 C ATOM 314 O CYS A 22 8.755 9.340 -1.762 1.00 0.00 O ATOM 315 CB CYS A 22 6.598 7.268 -0.131 1.00 0.00 C ATOM 316 SG CYS A 22 5.071 6.329 -0.502 1.00 0.00 S ATOM 0 H CYS A 22 7.772 5.284 -1.097 1.00 0.00 H new ATOM 0 HA CYS A 22 6.850 7.740 -2.170 1.00 0.00 H new ATOM 0 HB2 CYS A 22 7.141 6.789 0.684 1.00 0.00 H new ATOM 0 HB3 CYS A 22 6.344 8.274 0.204 1.00 0.00 H new ATOM 0 HG CYS A 22 4.160 6.617 0.379 1.00 0.00 H new ATOM 322 N GLY A 23 9.601 7.810 -0.326 1.00 0.00 N ATOM 323 CA GLY A 23 10.797 8.583 -0.034 1.00 0.00 C ATOM 324 C GLY A 23 10.874 8.930 1.454 1.00 0.00 C ATOM 325 O GLY A 23 9.984 8.575 2.226 1.00 0.00 O ATOM 0 H GLY A 23 9.539 6.917 0.164 1.00 0.00 H new ATOM 0 HA2 GLY A 23 11.681 8.016 -0.325 1.00 0.00 H new ATOM 0 HA3 GLY A 23 10.796 9.499 -0.625 1.00 0.00 H new ATOM 329 N PRO A 24 11.975 9.639 1.823 1.00 0.00 N ATOM 330 CA PRO A 24 12.180 10.039 3.204 1.00 0.00 C ATOM 331 C PRO A 24 11.262 11.203 3.580 1.00 0.00 C ATOM 332 O PRO A 24 11.731 12.246 4.035 1.00 0.00 O ATOM 333 CB PRO A 24 13.656 10.391 3.297 1.00 0.00 C ATOM 334 CG PRO A 24 14.119 10.623 1.868 1.00 0.00 C ATOM 335 CD PRO A 24 13.050 10.077 0.936 1.00 0.00 C ATOM 0 HA PRO A 24 11.928 9.250 3.912 1.00 0.00 H new ATOM 0 HB2 PRO A 24 13.808 11.282 3.906 1.00 0.00 H new ATOM 0 HB3 PRO A 24 14.221 9.585 3.765 1.00 0.00 H new ATOM 0 HG2 PRO A 24 14.277 11.686 1.686 1.00 0.00 H new ATOM 0 HG3 PRO A 24 15.072 10.124 1.690 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.703 10.841 0.240 1.00 0.00 H new ATOM 0 HD3 PRO A 24 13.431 9.250 0.337 1.00 0.00 H new ATOM 343 N ASP A 25 9.971 10.987 3.376 1.00 0.00 N ATOM 344 CA ASP A 25 8.983 12.006 3.688 1.00 0.00 C ATOM 345 C ASP A 25 7.924 11.415 4.621 1.00 0.00 C ATOM 346 O ASP A 25 7.632 11.982 5.673 1.00 0.00 O ATOM 347 CB ASP A 25 8.278 12.495 2.422 1.00 0.00 C ATOM 348 CG ASP A 25 9.210 12.927 1.288 1.00 0.00 C ATOM 349 OD1 ASP A 25 9.554 12.047 0.470 1.00 0.00 O ATOM 350 OD2 ASP A 25 9.557 14.128 1.265 1.00 0.00 O ATOM 0 H ASP A 25 9.586 10.121 2.998 1.00 0.00 H new ATOM 0 HA ASP A 25 9.499 12.843 4.160 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.629 11.700 2.055 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.635 13.336 2.684 1.00 0.00 H new ATOM 355 N VAL A 26 7.378 10.283 4.202 1.00 0.00 N ATOM 356 CA VAL A 26 6.358 9.609 4.987 1.00 0.00 C ATOM 357 C VAL A 26 6.960 9.159 6.320 1.00 0.00 C ATOM 358 O VAL A 26 6.275 9.146 7.341 1.00 0.00 O ATOM 359 CB VAL A 26 5.757 8.454 4.183 1.00 0.00 C ATOM 360 CG1 VAL A 26 4.975 8.976 2.976 1.00 0.00 C ATOM 361 CG2 VAL A 26 6.841 7.466 3.748 1.00 0.00 C ATOM 0 H VAL A 26 7.623 9.816 3.329 1.00 0.00 H new ATOM 0 HA VAL A 26 5.539 10.291 5.214 1.00 0.00 H new ATOM 0 HB VAL A 26 5.060 7.922 4.830 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.558 8.135 2.421 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.166 9.622 3.318 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.643 9.543 2.327 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.387 6.655 3.178 1.00 0.00 H new ATOM 0 HG22 VAL A 26 7.574 7.980 3.126 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.336 7.058 4.629 1.00 0.00 H new ATOM 371 N GLY A 27 8.235 8.802 6.266 1.00 0.00 N ATOM 372 CA GLY A 27 8.937 8.352 7.456 1.00 0.00 C ATOM 373 C GLY A 27 8.823 6.835 7.620 1.00 0.00 C ATOM 374 O GLY A 27 8.730 6.106 6.634 1.00 0.00 O ATOM 0 H GLY A 27 8.800 8.815 5.417 1.00 0.00 H new ATOM 0 HA2 GLY A 27 9.987 8.636 7.392 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.525 8.848 8.335 1.00 0.00 H new ATOM 378 N ARG A 28 8.833 6.406 8.874 1.00 0.00 N ATOM 379 CA ARG A 28 8.732 4.989 9.180 1.00 0.00 C ATOM 380 C ARG A 28 7.640 4.748 10.224 1.00 0.00 C ATOM 381 O ARG A 28 7.133 5.693 10.827 1.00 0.00 O ATOM 382 CB ARG A 28 10.060 4.443 9.706 1.00 0.00 C ATOM 383 CG ARG A 28 10.601 3.341 8.792 1.00 0.00 C ATOM 384 CD ARG A 28 11.343 2.274 9.599 1.00 0.00 C ATOM 385 NE ARG A 28 12.607 1.914 8.919 1.00 0.00 N ATOM 386 CZ ARG A 28 13.525 1.081 9.430 1.00 0.00 C ATOM 387 NH1 ARG A 28 13.324 0.518 10.629 1.00 0.00 N ATOM 388 NH2 ARG A 28 14.642 0.812 8.742 1.00 0.00 N ATOM 0 H ARG A 28 8.909 7.014 9.689 1.00 0.00 H new ATOM 0 HA ARG A 28 8.478 4.468 8.257 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.787 5.252 9.776 1.00 0.00 H new ATOM 0 HB3 ARG A 28 9.922 4.050 10.713 1.00 0.00 H new ATOM 0 HG2 ARG A 28 9.778 2.881 8.245 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.273 3.775 8.052 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.553 2.645 10.602 1.00 0.00 H new ATOM 0 HD3 ARG A 28 10.716 1.390 9.711 1.00 0.00 H new ATOM 0 HE ARG A 28 12.792 2.325 8.004 1.00 0.00 H new ATOM 0 HH11 ARG A 28 12.473 0.723 11.153 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.022 -0.116 11.018 1.00 0.00 H new ATOM 0 HH21 ARG A 28 14.794 1.241 7.829 1.00 0.00 H new ATOM 0 HH22 ARG A 28 15.340 0.178 9.131 1.00 0.00 H new ATOM 402 N PRO A 29 7.301 3.444 10.412 1.00 0.00 N ATOM 403 CA PRO A 29 6.279 3.068 11.373 1.00 0.00 C ATOM 404 C PRO A 29 6.807 3.172 12.805 1.00 0.00 C ATOM 405 O PRO A 29 7.739 2.461 13.180 1.00 0.00 O ATOM 406 CB PRO A 29 5.880 1.652 10.989 1.00 0.00 C ATOM 407 CG PRO A 29 7.012 1.120 10.125 1.00 0.00 C ATOM 408 CD PRO A 29 7.880 2.299 9.716 1.00 0.00 C ATOM 0 HA PRO A 29 5.415 3.732 11.349 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.740 1.032 11.874 1.00 0.00 H new ATOM 0 HB3 PRO A 29 4.936 1.646 10.443 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.600 0.386 10.676 1.00 0.00 H new ATOM 0 HG3 PRO A 29 6.615 0.615 9.245 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.920 2.144 10.005 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.867 2.444 8.636 1.00 0.00 H new ATOM 502 N GLY A 35 1.673 -0.670 14.938 1.00 0.00 N ATOM 503 CA GLY A 35 2.312 0.524 14.411 1.00 0.00 C ATOM 504 C GLY A 35 2.271 0.539 12.882 1.00 0.00 C ATOM 505 O GLY A 35 1.731 1.466 12.281 1.00 0.00 O ATOM 0 HA2 GLY A 35 1.811 1.411 14.800 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.347 0.567 14.751 1.00 0.00 H new ATOM 509 N PHE A 36 2.849 -0.500 12.296 1.00 0.00 N ATOM 510 CA PHE A 36 2.886 -0.618 10.849 1.00 0.00 C ATOM 511 C PHE A 36 1.482 -0.491 10.253 1.00 0.00 C ATOM 512 O PHE A 36 1.293 0.176 9.237 1.00 0.00 O ATOM 513 CB PHE A 36 3.439 -2.008 10.527 1.00 0.00 C ATOM 514 CG PHE A 36 3.348 -2.387 9.048 1.00 0.00 C ATOM 515 CD1 PHE A 36 4.128 -1.751 8.134 1.00 0.00 C ATOM 516 CD2 PHE A 36 2.487 -3.360 8.647 1.00 0.00 C ATOM 517 CE1 PHE A 36 4.044 -2.103 6.760 1.00 0.00 C ATOM 518 CE2 PHE A 36 2.402 -3.712 7.274 1.00 0.00 C ATOM 519 CZ PHE A 36 3.183 -3.076 6.360 1.00 0.00 C ATOM 0 H PHE A 36 3.295 -1.268 12.798 1.00 0.00 H new ATOM 0 HA PHE A 36 3.505 0.174 10.427 1.00 0.00 H new ATOM 0 HB2 PHE A 36 4.482 -2.054 10.840 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.897 -2.749 11.115 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.812 -0.978 8.452 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.867 -3.865 9.373 1.00 0.00 H new ATOM 0 HE1 PHE A 36 4.664 -1.598 6.034 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.718 -4.484 6.956 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.119 -3.344 5.316 1.00 0.00 H new ATOM 529 N GLN A 37 0.534 -1.142 10.911 1.00 0.00 N ATOM 530 CA GLN A 37 -0.847 -1.110 10.459 1.00 0.00 C ATOM 531 C GLN A 37 -1.292 0.333 10.213 1.00 0.00 C ATOM 532 O GLN A 37 -1.690 0.683 9.103 1.00 0.00 O ATOM 533 CB GLN A 37 -1.769 -1.804 11.463 1.00 0.00 C ATOM 534 CG GLN A 37 -3.154 -2.047 10.860 1.00 0.00 C ATOM 535 CD GLN A 37 -4.247 -1.412 11.722 1.00 0.00 C ATOM 536 OE1 GLN A 37 -4.556 -1.866 12.811 1.00 0.00 O ATOM 537 NE2 GLN A 37 -4.813 -0.340 11.175 1.00 0.00 N ATOM 0 H GLN A 37 0.695 -1.695 11.753 1.00 0.00 H new ATOM 0 HA GLN A 37 -0.913 -1.656 9.518 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.330 -2.754 11.769 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.862 -1.192 12.360 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -3.194 -1.632 9.853 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.333 -3.119 10.771 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.506 -0.013 10.259 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -5.554 0.155 11.672 1.00 0.00 H new ATOM 546 N VAL A 38 -1.210 1.132 11.267 1.00 0.00 N ATOM 547 CA VAL A 38 -1.599 2.529 11.179 1.00 0.00 C ATOM 548 C VAL A 38 -0.823 3.200 10.044 1.00 0.00 C ATOM 549 O VAL A 38 -1.396 3.947 9.252 1.00 0.00 O ATOM 550 CB VAL A 38 -1.393 3.215 12.531 1.00 0.00 C ATOM 551 CG1 VAL A 38 -1.769 4.697 12.457 1.00 0.00 C ATOM 552 CG2 VAL A 38 -2.182 2.504 13.632 1.00 0.00 C ATOM 0 H VAL A 38 -0.880 0.838 12.186 1.00 0.00 H new ATOM 0 HA VAL A 38 -2.660 2.616 10.943 1.00 0.00 H new ATOM 0 HB VAL A 38 -0.334 3.150 12.782 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -1.613 5.161 13.431 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -1.145 5.194 11.714 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -2.817 4.793 12.173 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.018 3.011 14.583 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.244 2.523 13.389 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.846 1.470 13.710 1.00 0.00 H new ATOM 562 N TRP A 39 0.469 2.910 10.001 1.00 0.00 N ATOM 563 CA TRP A 39 1.330 3.475 8.976 1.00 0.00 C ATOM 564 C TRP A 39 0.625 3.318 7.627 1.00 0.00 C ATOM 565 O TRP A 39 0.678 4.214 6.787 1.00 0.00 O ATOM 566 CB TRP A 39 2.716 2.829 9.005 1.00 0.00 C ATOM 567 CG TRP A 39 3.786 3.614 8.244 1.00 0.00 C ATOM 568 CD1 TRP A 39 4.144 4.895 8.411 1.00 0.00 C ATOM 569 CD2 TRP A 39 4.627 3.115 7.183 1.00 0.00 C ATOM 570 NE1 TRP A 39 5.151 5.256 7.539 1.00 0.00 N ATOM 571 CE2 TRP A 39 5.453 4.140 6.768 1.00 0.00 C ATOM 572 CE3 TRP A 39 4.687 1.841 6.592 1.00 0.00 C ATOM 573 CZ2 TRP A 39 6.399 3.995 5.746 1.00 0.00 C ATOM 574 CZ3 TRP A 39 5.638 1.712 5.573 1.00 0.00 C ATOM 575 CH2 TRP A 39 6.477 2.734 5.144 1.00 0.00 C ATOM 0 H TRP A 39 0.941 2.291 10.660 1.00 0.00 H new ATOM 0 HA TRP A 39 1.501 4.536 9.158 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.031 2.717 10.042 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.647 1.826 8.583 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.700 5.561 9.137 1.00 0.00 H new ATOM 0 HE1 TRP A 39 5.592 6.173 7.473 1.00 0.00 H new ATOM 0 HE3 TRP A 39 4.049 1.026 6.900 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 7.034 4.812 5.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 5.726 0.752 5.086 1.00 0.00 H new ATOM 0 HH2 TRP A 39 7.186 2.556 4.349 1.00 0.00 H new ATOM 586 N LEU A 40 -0.019 2.172 7.462 1.00 0.00 N ATOM 587 CA LEU A 40 -0.733 1.885 6.230 1.00 0.00 C ATOM 588 C LEU A 40 -2.236 1.844 6.514 1.00 0.00 C ATOM 589 O LEU A 40 -2.927 0.920 6.087 1.00 0.00 O ATOM 590 CB LEU A 40 -0.194 0.608 5.583 1.00 0.00 C ATOM 591 CG LEU A 40 1.321 0.548 5.377 1.00 0.00 C ATOM 592 CD1 LEU A 40 1.731 -0.763 4.704 1.00 0.00 C ATOM 593 CD2 LEU A 40 1.818 1.770 4.603 1.00 0.00 C ATOM 0 H LEU A 40 -0.061 1.431 8.162 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.568 2.678 5.501 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.491 -0.241 6.199 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.678 0.483 4.614 1.00 0.00 H new ATOM 0 HG LEU A 40 1.800 0.571 6.356 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.812 -0.780 4.569 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.430 -1.603 5.330 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.243 -0.841 3.732 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.898 1.702 4.470 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.334 1.804 3.627 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.577 2.676 5.159 1.00 0.00 H new ATOM 605 N LYS A 41 -2.698 2.856 7.234 1.00 0.00 N ATOM 606 CA LYS A 41 -4.106 2.946 7.581 1.00 0.00 C ATOM 607 C LYS A 41 -4.747 4.093 6.796 1.00 0.00 C ATOM 608 O LYS A 41 -5.702 3.881 6.050 1.00 0.00 O ATOM 609 CB LYS A 41 -4.278 3.067 9.096 1.00 0.00 C ATOM 610 CG LYS A 41 -5.704 3.493 9.454 1.00 0.00 C ATOM 611 CD LYS A 41 -5.827 3.793 10.949 1.00 0.00 C ATOM 612 CE LYS A 41 -7.279 3.668 11.416 1.00 0.00 C ATOM 613 NZ LYS A 41 -7.669 4.847 12.220 1.00 0.00 N ATOM 0 H LYS A 41 -2.122 3.621 7.586 1.00 0.00 H new ATOM 0 HA LYS A 41 -4.628 2.032 7.296 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -4.051 2.112 9.569 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -3.568 3.794 9.489 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -5.979 4.377 8.878 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -6.403 2.703 9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -5.199 3.105 11.515 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -5.461 4.799 11.153 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.938 3.575 10.553 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -7.400 2.761 12.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -8.657 4.745 12.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -7.052 4.918 13.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -7.573 5.707 11.644 1.00 0.00 H new ATOM 627 N ASN A 42 -4.196 5.282 6.991 1.00 0.00 N ATOM 628 CA ASN A 42 -4.703 6.462 6.310 1.00 0.00 C ATOM 629 C ASN A 42 -5.056 6.100 4.866 1.00 0.00 C ATOM 630 O ASN A 42 -6.200 6.261 4.444 1.00 0.00 O ATOM 631 CB ASN A 42 -3.650 7.571 6.275 1.00 0.00 C ATOM 632 CG ASN A 42 -3.637 8.356 7.589 1.00 0.00 C ATOM 633 OD1 ASN A 42 -3.761 7.806 8.671 1.00 0.00 O ATOM 634 ND2 ASN A 42 -3.479 9.667 7.435 1.00 0.00 N ATOM 0 H ASN A 42 -3.404 5.454 7.610 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.581 6.814 6.852 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -2.666 7.138 6.096 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.856 8.247 5.445 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -3.456 10.277 8.252 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -3.381 10.063 6.500 1.00 0.00 H new ATOM 641 N GLY A 43 -4.053 5.618 4.148 1.00 0.00 N ATOM 642 CA GLY A 43 -4.243 5.232 2.760 1.00 0.00 C ATOM 643 C GLY A 43 -3.418 6.119 1.826 1.00 0.00 C ATOM 644 O GLY A 43 -2.919 5.654 0.802 1.00 0.00 O ATOM 0 H GLY A 43 -3.105 5.486 4.501 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.954 4.189 2.626 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.299 5.306 2.499 1.00 0.00 H new ATOM 648 N VAL A 44 -3.299 7.381 2.212 1.00 0.00 N ATOM 649 CA VAL A 44 -2.543 8.338 1.422 1.00 0.00 C ATOM 650 C VAL A 44 -1.204 7.715 1.021 1.00 0.00 C ATOM 651 O VAL A 44 -0.789 7.818 -0.133 1.00 0.00 O ATOM 652 CB VAL A 44 -2.385 9.647 2.197 1.00 0.00 C ATOM 653 CG1 VAL A 44 -1.438 10.604 1.470 1.00 0.00 C ATOM 654 CG2 VAL A 44 -3.744 10.305 2.446 1.00 0.00 C ATOM 0 H VAL A 44 -3.714 7.763 3.062 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.077 8.582 0.504 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.945 9.411 3.166 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.343 11.527 2.042 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.458 10.138 1.368 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -1.837 10.830 0.481 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.603 11.234 2.999 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.224 10.520 1.492 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.374 9.630 3.025 1.00 0.00 H new ATOM 664 N ILE A 45 -0.565 7.084 1.994 1.00 0.00 N ATOM 665 CA ILE A 45 0.718 6.445 1.757 1.00 0.00 C ATOM 666 C ILE A 45 0.543 5.325 0.729 1.00 0.00 C ATOM 667 O ILE A 45 1.198 5.326 -0.313 1.00 0.00 O ATOM 668 CB ILE A 45 1.336 5.977 3.076 1.00 0.00 C ATOM 669 CG1 ILE A 45 1.498 7.146 4.050 1.00 0.00 C ATOM 670 CG2 ILE A 45 2.658 5.246 2.833 1.00 0.00 C ATOM 671 CD1 ILE A 45 2.570 6.841 5.098 1.00 0.00 C ATOM 0 H ILE A 45 -0.912 7.001 2.950 1.00 0.00 H new ATOM 0 HA ILE A 45 1.426 7.158 1.335 1.00 0.00 H new ATOM 0 HB ILE A 45 0.654 5.264 3.539 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.768 8.048 3.500 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.548 7.347 4.544 1.00 0.00 H new ATOM 0 HG21 ILE A 45 3.076 4.924 3.787 1.00 0.00 H new ATOM 0 HG22 ILE A 45 2.482 4.375 2.202 1.00 0.00 H new ATOM 0 HG23 ILE A 45 3.359 5.917 2.337 1.00 0.00 H new ATOM 0 HD11 ILE A 45 2.665 7.688 5.778 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.285 5.953 5.662 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.524 6.665 4.602 1.00 0.00 H new ATOM 683 N LEU A 46 -0.344 4.398 1.057 1.00 0.00 N ATOM 684 CA LEU A 46 -0.614 3.275 0.175 1.00 0.00 C ATOM 685 C LEU A 46 -0.894 3.796 -1.236 1.00 0.00 C ATOM 686 O LEU A 46 -0.416 3.228 -2.217 1.00 0.00 O ATOM 687 CB LEU A 46 -1.737 2.405 0.743 1.00 0.00 C ATOM 688 CG LEU A 46 -1.331 1.419 1.841 1.00 0.00 C ATOM 689 CD1 LEU A 46 -2.562 0.858 2.555 1.00 0.00 C ATOM 690 CD2 LEU A 46 -0.439 0.310 1.279 1.00 0.00 C ATOM 0 H LEU A 46 -0.885 4.401 1.921 1.00 0.00 H new ATOM 0 HA LEU A 46 0.259 2.625 0.108 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.513 3.060 1.139 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.184 1.842 -0.077 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.744 1.958 2.585 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -2.246 0.160 3.330 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.123 1.675 3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.195 0.339 1.835 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -0.165 -0.377 2.080 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.979 -0.233 0.504 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.463 0.749 0.853 1.00 0.00 H new ATOM 702 N SER A 47 -1.667 4.870 -1.293 1.00 0.00 N ATOM 703 CA SER A 47 -2.016 5.474 -2.568 1.00 0.00 C ATOM 704 C SER A 47 -0.769 6.074 -3.222 1.00 0.00 C ATOM 705 O SER A 47 -0.589 5.969 -4.434 1.00 0.00 O ATOM 706 CB SER A 47 -3.092 6.547 -2.393 1.00 0.00 C ATOM 707 OG SER A 47 -2.596 7.693 -1.704 1.00 0.00 O ATOM 0 H SER A 47 -2.062 5.338 -0.477 1.00 0.00 H new ATOM 0 HA SER A 47 -2.419 4.696 -3.216 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.468 6.847 -3.371 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.935 6.129 -1.842 1.00 0.00 H new ATOM 0 HG SER A 47 -1.782 7.453 -1.214 1.00 0.00 H new ATOM 713 N LYS A 48 0.058 6.689 -2.390 1.00 0.00 N ATOM 714 CA LYS A 48 1.283 7.305 -2.872 1.00 0.00 C ATOM 715 C LYS A 48 2.188 6.229 -3.473 1.00 0.00 C ATOM 716 O LYS A 48 2.891 6.478 -4.451 1.00 0.00 O ATOM 717 CB LYS A 48 1.948 8.118 -1.759 1.00 0.00 C ATOM 718 CG LYS A 48 1.317 9.507 -1.642 1.00 0.00 C ATOM 719 CD LYS A 48 1.760 10.203 -0.354 1.00 0.00 C ATOM 720 CE LYS A 48 1.383 11.686 -0.375 1.00 0.00 C ATOM 721 NZ LYS A 48 2.552 12.523 -0.022 1.00 0.00 N ATOM 0 H LYS A 48 -0.096 6.774 -1.385 1.00 0.00 H new ATOM 0 HA LYS A 48 1.064 8.017 -3.667 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.851 7.590 -0.811 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.014 8.215 -1.962 1.00 0.00 H new ATOM 0 HG2 LYS A 48 1.600 10.113 -2.503 1.00 0.00 H new ATOM 0 HG3 LYS A 48 0.231 9.419 -1.657 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.295 9.718 0.504 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.838 10.100 -0.233 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.017 11.960 -1.364 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.570 11.871 0.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 2.279 13.526 -0.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.883 12.272 0.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 3.316 12.359 -0.708 1.00 0.00 H new ATOM 735 N LEU A 49 2.143 5.054 -2.862 1.00 0.00 N ATOM 736 CA LEU A 49 2.950 3.938 -3.325 1.00 0.00 C ATOM 737 C LEU A 49 2.576 3.608 -4.771 1.00 0.00 C ATOM 738 O LEU A 49 3.347 3.874 -5.692 1.00 0.00 O ATOM 739 CB LEU A 49 2.820 2.750 -2.369 1.00 0.00 C ATOM 740 CG LEU A 49 3.808 1.602 -2.588 1.00 0.00 C ATOM 741 CD1 LEU A 49 5.226 2.017 -2.190 1.00 0.00 C ATOM 742 CD2 LEU A 49 3.353 0.340 -1.853 1.00 0.00 C ATOM 0 H LEU A 49 1.560 4.851 -2.050 1.00 0.00 H new ATOM 0 HA LEU A 49 4.007 4.205 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.938 3.115 -1.349 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.808 2.353 -2.450 1.00 0.00 H new ATOM 0 HG LEU A 49 3.828 1.366 -3.652 1.00 0.00 H new ATOM 0 HD11 LEU A 49 5.909 1.184 -2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.539 2.868 -2.795 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.241 2.295 -1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.072 -0.461 -2.025 1.00 0.00 H new ATOM 0 HD22 LEU A 49 3.287 0.545 -0.785 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.375 0.035 -2.225 1.00 0.00 H new ATOM 754 N VAL A 50 1.393 3.032 -4.926 1.00 0.00 N ATOM 755 CA VAL A 50 0.907 2.663 -6.244 1.00 0.00 C ATOM 756 C VAL A 50 1.152 3.820 -7.216 1.00 0.00 C ATOM 757 O VAL A 50 1.635 3.610 -8.327 1.00 0.00 O ATOM 758 CB VAL A 50 -0.565 2.252 -6.164 1.00 0.00 C ATOM 759 CG1 VAL A 50 -1.443 3.435 -5.751 1.00 0.00 C ATOM 760 CG2 VAL A 50 -1.040 1.653 -7.489 1.00 0.00 C ATOM 0 H VAL A 50 0.757 2.812 -4.160 1.00 0.00 H new ATOM 0 HA VAL A 50 1.452 1.798 -6.623 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.657 1.483 -5.397 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.484 3.116 -5.702 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.128 3.798 -4.773 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.343 4.235 -6.484 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.089 1.369 -7.405 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.926 2.391 -8.283 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.444 0.771 -7.724 1.00 0.00 H new ATOM 770 N ASN A 51 0.808 5.016 -6.761 1.00 0.00 N ATOM 771 CA ASN A 51 0.985 6.205 -7.576 1.00 0.00 C ATOM 772 C ASN A 51 2.445 6.299 -8.025 1.00 0.00 C ATOM 773 O ASN A 51 2.724 6.425 -9.216 1.00 0.00 O ATOM 774 CB ASN A 51 0.653 7.471 -6.782 1.00 0.00 C ATOM 775 CG ASN A 51 -0.730 8.006 -7.157 1.00 0.00 C ATOM 776 OD1 ASN A 51 -0.878 8.897 -7.977 1.00 0.00 O ATOM 777 ND2 ASN A 51 -1.732 7.415 -6.513 1.00 0.00 N ATOM 0 H ASN A 51 0.408 5.187 -5.838 1.00 0.00 H new ATOM 0 HA ASN A 51 0.315 6.129 -8.432 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.686 7.254 -5.714 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.407 8.234 -6.975 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -2.694 7.702 -6.694 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -1.539 6.675 -5.838 1.00 0.00 H new ATOM 784 N SER A 52 3.337 6.233 -7.047 1.00 0.00 N ATOM 785 CA SER A 52 4.760 6.308 -7.327 1.00 0.00 C ATOM 786 C SER A 52 5.087 5.519 -8.597 1.00 0.00 C ATOM 787 O SER A 52 5.813 6.003 -9.464 1.00 0.00 O ATOM 788 CB SER A 52 5.582 5.781 -6.149 1.00 0.00 C ATOM 789 OG SER A 52 5.760 4.368 -6.213 1.00 0.00 O ATOM 0 H SER A 52 3.101 6.128 -6.060 1.00 0.00 H new ATOM 0 HA SER A 52 5.023 7.355 -7.480 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.556 6.269 -6.139 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.085 6.042 -5.214 1.00 0.00 H new ATOM 0 HG SER A 52 4.885 3.930 -6.272 1.00 0.00 H new ATOM 795 N LEU A 53 4.533 4.317 -8.667 1.00 0.00 N ATOM 796 CA LEU A 53 4.756 3.457 -9.817 1.00 0.00 C ATOM 797 C LEU A 53 4.238 4.152 -11.077 1.00 0.00 C ATOM 798 O LEU A 53 5.023 4.623 -11.898 1.00 0.00 O ATOM 799 CB LEU A 53 4.142 2.076 -9.579 1.00 0.00 C ATOM 800 CG LEU A 53 4.551 1.373 -8.283 1.00 0.00 C ATOM 801 CD1 LEU A 53 3.668 0.152 -8.018 1.00 0.00 C ATOM 802 CD2 LEU A 53 6.038 1.012 -8.301 1.00 0.00 C ATOM 0 H LEU A 53 3.931 3.919 -7.947 1.00 0.00 H new ATOM 0 HA LEU A 53 5.822 3.286 -9.964 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.057 2.177 -9.587 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.409 1.433 -10.417 1.00 0.00 H new ATOM 0 HG LEU A 53 4.397 2.066 -7.456 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.980 -0.329 -7.091 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.628 0.467 -7.931 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.765 -0.553 -8.843 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.303 0.514 -7.368 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.240 0.345 -9.139 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.632 1.920 -8.408 1.00 0.00 H new ATOM 814 N TYR A 54 2.918 4.194 -11.191 1.00 0.00 N ATOM 815 CA TYR A 54 2.286 4.824 -12.337 1.00 0.00 C ATOM 816 C TYR A 54 2.960 6.156 -12.672 1.00 0.00 C ATOM 817 O TYR A 54 3.219 6.966 -11.783 1.00 0.00 O ATOM 818 CB TYR A 54 0.836 5.089 -11.926 1.00 0.00 C ATOM 819 CG TYR A 54 -0.077 3.867 -12.046 1.00 0.00 C ATOM 820 CD1 TYR A 54 -0.533 3.465 -13.285 1.00 0.00 C ATOM 821 CD2 TYR A 54 -0.446 3.167 -10.915 1.00 0.00 C ATOM 822 CE1 TYR A 54 -1.392 2.315 -13.398 1.00 0.00 C ATOM 823 CE2 TYR A 54 -1.305 2.018 -11.027 1.00 0.00 C ATOM 824 CZ TYR A 54 -1.736 1.648 -12.263 1.00 0.00 C ATOM 825 OH TYR A 54 -2.548 0.562 -12.370 1.00 0.00 O ATOM 0 H TYR A 54 2.270 3.802 -10.508 1.00 0.00 H new ATOM 0 HA TYR A 54 2.361 4.184 -13.216 1.00 0.00 H new ATOM 0 HB2 TYR A 54 0.820 5.442 -10.895 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.435 5.892 -12.544 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -0.245 4.013 -14.170 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.090 3.482 -9.945 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -1.755 1.989 -14.362 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -1.601 1.462 -10.150 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.709 0.185 -11.480 1.00 0.00 H new ATOM 835 N PRO A 55 3.231 6.348 -13.991 1.00 0.00 N ATOM 836 CA PRO A 55 3.870 7.568 -14.454 1.00 0.00 C ATOM 837 C PRO A 55 2.884 8.738 -14.451 1.00 0.00 C ATOM 838 O PRO A 55 1.679 8.539 -14.299 1.00 0.00 O ATOM 839 CB PRO A 55 4.393 7.236 -15.841 1.00 0.00 C ATOM 840 CG PRO A 55 3.629 6.001 -16.290 1.00 0.00 C ATOM 841 CD PRO A 55 2.938 5.412 -15.072 1.00 0.00 C ATOM 0 HA PRO A 55 4.683 7.890 -13.803 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.232 8.066 -16.528 1.00 0.00 H new ATOM 0 HB3 PRO A 55 5.466 7.045 -15.818 1.00 0.00 H new ATOM 0 HG2 PRO A 55 2.898 6.262 -17.055 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.308 5.272 -16.733 1.00 0.00 H new ATOM 0 HD2 PRO A 55 1.864 5.317 -15.233 1.00 0.00 H new ATOM 0 HD3 PRO A 55 3.316 4.415 -14.846 1.00 0.00 H new ATOM 849 N GLU A 56 3.431 9.932 -14.621 1.00 0.00 N ATOM 850 CA GLU A 56 2.615 11.134 -14.640 1.00 0.00 C ATOM 851 C GLU A 56 1.452 10.971 -15.621 1.00 0.00 C ATOM 852 O GLU A 56 1.647 10.523 -16.751 1.00 0.00 O ATOM 853 CB GLU A 56 3.457 12.364 -14.988 1.00 0.00 C ATOM 854 CG GLU A 56 4.199 12.887 -13.756 1.00 0.00 C ATOM 855 CD GLU A 56 5.429 13.700 -14.162 1.00 0.00 C ATOM 856 OE1 GLU A 56 5.240 14.680 -14.914 1.00 0.00 O ATOM 857 OE2 GLU A 56 6.532 13.324 -13.710 1.00 0.00 O ATOM 0 H GLU A 56 4.430 10.093 -14.747 1.00 0.00 H new ATOM 0 HA GLU A 56 2.205 11.286 -13.642 1.00 0.00 H new ATOM 0 HB2 GLU A 56 4.174 12.109 -15.768 1.00 0.00 H new ATOM 0 HB3 GLU A 56 2.814 13.147 -15.390 1.00 0.00 H new ATOM 0 HG2 GLU A 56 3.529 13.507 -13.160 1.00 0.00 H new ATOM 0 HG3 GLU A 56 4.503 12.050 -13.127 1.00 0.00 H new ATOM 864 N GLY A 57 0.269 11.342 -15.155 1.00 0.00 N ATOM 865 CA GLY A 57 -0.924 11.242 -15.977 1.00 0.00 C ATOM 866 C GLY A 57 -1.635 9.906 -15.751 1.00 0.00 C ATOM 867 O GLY A 57 -2.856 9.820 -15.873 1.00 0.00 O ATOM 0 H GLY A 57 0.111 11.713 -14.218 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.602 12.063 -15.742 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -0.655 11.342 -17.029 1.00 0.00 H new ATOM 871 N SER A 58 -0.841 8.897 -15.426 1.00 0.00 N ATOM 872 CA SER A 58 -1.379 7.570 -15.181 1.00 0.00 C ATOM 873 C SER A 58 -1.904 7.473 -13.748 1.00 0.00 C ATOM 874 O SER A 58 -2.655 6.557 -13.418 1.00 0.00 O ATOM 875 CB SER A 58 -0.322 6.492 -15.434 1.00 0.00 C ATOM 876 OG SER A 58 -0.885 5.318 -16.012 1.00 0.00 O ATOM 0 H SER A 58 0.171 8.972 -15.327 1.00 0.00 H new ATOM 0 HA SER A 58 -2.203 7.402 -15.874 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.449 6.888 -16.095 1.00 0.00 H new ATOM 0 HB3 SER A 58 0.166 6.235 -14.494 1.00 0.00 H new ATOM 0 HG SER A 58 -0.179 4.655 -16.159 1.00 0.00 H new ATOM 882 N LYS A 59 -1.487 8.431 -12.933 1.00 0.00 N ATOM 883 CA LYS A 59 -1.905 8.466 -11.542 1.00 0.00 C ATOM 884 C LYS A 59 -3.390 8.105 -11.452 1.00 0.00 C ATOM 885 O LYS A 59 -4.252 8.938 -11.726 1.00 0.00 O ATOM 886 CB LYS A 59 -1.561 9.817 -10.912 1.00 0.00 C ATOM 887 CG LYS A 59 -0.076 9.892 -10.553 1.00 0.00 C ATOM 888 CD LYS A 59 0.737 10.490 -11.703 1.00 0.00 C ATOM 889 CE LYS A 59 1.495 11.738 -11.249 1.00 0.00 C ATOM 890 NZ LYS A 59 2.802 11.366 -10.662 1.00 0.00 N ATOM 0 H LYS A 59 -0.864 9.189 -13.210 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.359 7.722 -10.961 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -1.812 10.620 -11.605 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -2.163 9.969 -10.016 1.00 0.00 H new ATOM 0 HG2 LYS A 59 0.055 10.498 -9.657 1.00 0.00 H new ATOM 0 HG3 LYS A 59 0.296 8.894 -10.320 1.00 0.00 H new ATOM 0 HD2 LYS A 59 1.442 9.748 -12.078 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.073 10.744 -12.529 1.00 0.00 H new ATOM 0 HE2 LYS A 59 1.647 12.406 -12.096 1.00 0.00 H new ATOM 0 HE3 LYS A 59 0.902 12.284 -10.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 3.304 12.225 -10.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 2.650 10.746 -9.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.372 10.865 -11.373 1.00 0.00 H new ATOM 904 N PRO A 60 -3.648 6.830 -11.056 1.00 0.00 N ATOM 905 CA PRO A 60 -5.013 6.349 -10.926 1.00 0.00 C ATOM 906 C PRO A 60 -5.675 6.911 -9.666 1.00 0.00 C ATOM 907 O PRO A 60 -6.567 7.753 -9.752 1.00 0.00 O ATOM 908 CB PRO A 60 -4.897 4.834 -10.910 1.00 0.00 C ATOM 909 CG PRO A 60 -3.448 4.531 -10.564 1.00 0.00 C ATOM 910 CD PRO A 60 -2.652 5.816 -10.723 1.00 0.00 C ATOM 0 HA PRO A 60 -5.654 6.677 -11.744 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -5.574 4.398 -10.175 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -5.164 4.412 -11.879 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -3.370 4.157 -9.543 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -3.054 3.754 -11.219 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -2.121 6.069 -9.805 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -1.903 5.723 -11.510 1.00 0.00 H new ATOM 918 N VAL A 61 -5.212 6.422 -8.525 1.00 0.00 N ATOM 919 CA VAL A 61 -5.747 6.865 -7.249 1.00 0.00 C ATOM 920 C VAL A 61 -5.613 8.386 -7.144 1.00 0.00 C ATOM 921 O VAL A 61 -4.797 8.990 -7.839 1.00 0.00 O ATOM 922 CB VAL A 61 -5.053 6.124 -6.104 1.00 0.00 C ATOM 923 CG1 VAL A 61 -5.592 6.582 -4.748 1.00 0.00 C ATOM 924 CG2 VAL A 61 -5.195 4.609 -6.267 1.00 0.00 C ATOM 0 H VAL A 61 -4.472 5.723 -8.458 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.808 6.626 -7.177 1.00 0.00 H new ATOM 0 HB VAL A 61 -3.991 6.368 -6.142 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.082 6.040 -3.952 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.417 7.651 -4.629 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.662 6.382 -4.695 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.693 4.106 -5.441 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -6.251 4.341 -6.268 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.742 4.300 -7.209 1.00 0.00 H new ATOM 934 N LYS A 62 -6.426 8.961 -6.271 1.00 0.00 N ATOM 935 CA LYS A 62 -6.409 10.399 -6.066 1.00 0.00 C ATOM 936 C LYS A 62 -6.003 10.700 -4.622 1.00 0.00 C ATOM 937 O LYS A 62 -6.808 10.555 -3.704 1.00 0.00 O ATOM 938 CB LYS A 62 -7.751 11.014 -6.468 1.00 0.00 C ATOM 939 CG LYS A 62 -8.036 10.785 -7.954 1.00 0.00 C ATOM 940 CD LYS A 62 -8.729 12.001 -8.573 1.00 0.00 C ATOM 941 CE LYS A 62 -8.726 11.914 -10.101 1.00 0.00 C ATOM 942 NZ LYS A 62 -7.762 12.879 -10.673 1.00 0.00 N ATOM 0 H LYS A 62 -7.102 8.457 -5.697 1.00 0.00 H new ATOM 0 HA LYS A 62 -5.665 10.866 -6.711 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.550 10.576 -5.869 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -7.743 12.083 -6.256 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -7.103 10.587 -8.481 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -8.664 9.903 -8.076 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -9.755 12.063 -8.211 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -8.223 12.913 -8.256 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -8.466 10.903 -10.413 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -9.725 12.119 -10.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -7.773 12.807 -11.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -8.028 13.844 -10.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -6.807 12.666 -10.321 1.00 0.00 H new ATOM 956 N VAL A 63 -4.754 11.114 -4.467 1.00 0.00 N ATOM 957 CA VAL A 63 -4.231 11.437 -3.150 1.00 0.00 C ATOM 958 C VAL A 63 -3.848 12.917 -3.106 1.00 0.00 C ATOM 959 O VAL A 63 -2.988 13.363 -3.864 1.00 0.00 O ATOM 960 CB VAL A 63 -3.064 10.508 -2.808 1.00 0.00 C ATOM 961 CG1 VAL A 63 -2.159 10.295 -4.023 1.00 0.00 C ATOM 962 CG2 VAL A 63 -2.266 11.044 -1.618 1.00 0.00 C ATOM 0 H VAL A 63 -4.089 11.233 -5.231 1.00 0.00 H new ATOM 0 HA VAL A 63 -4.993 11.276 -2.387 1.00 0.00 H new ATOM 0 HB VAL A 63 -3.479 9.541 -2.525 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -1.338 9.631 -3.753 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -2.736 9.848 -4.832 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -1.758 11.254 -4.350 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -1.443 10.365 -1.396 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -1.868 12.029 -1.861 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -2.918 11.120 -0.748 1.00 0.00 H new ATOM 972 N PRO A 64 -4.524 13.659 -2.188 1.00 0.00 N ATOM 973 CA PRO A 64 -4.264 15.080 -2.036 1.00 0.00 C ATOM 974 C PRO A 64 -2.941 15.320 -1.307 1.00 0.00 C ATOM 975 O PRO A 64 -2.317 14.379 -0.818 1.00 0.00 O ATOM 976 CB PRO A 64 -5.466 15.621 -1.278 1.00 0.00 C ATOM 977 CG PRO A 64 -6.128 14.415 -0.631 1.00 0.00 C ATOM 978 CD PRO A 64 -5.550 13.165 -1.274 1.00 0.00 C ATOM 0 HA PRO A 64 -4.149 15.591 -2.992 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -5.159 16.348 -0.526 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -6.155 16.131 -1.951 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.946 14.410 0.444 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -7.208 14.452 -0.771 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -5.125 12.495 -0.526 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -6.317 12.603 -1.806 1.00 0.00 H new ATOM 986 N GLU A 65 -2.551 16.586 -1.256 1.00 0.00 N ATOM 987 CA GLU A 65 -1.313 16.961 -0.595 1.00 0.00 C ATOM 988 C GLU A 65 -1.362 16.574 0.884 1.00 0.00 C ATOM 989 O GLU A 65 -0.447 15.928 1.391 1.00 0.00 O ATOM 990 CB GLU A 65 -1.034 18.457 -0.762 1.00 0.00 C ATOM 991 CG GLU A 65 0.369 18.694 -1.323 1.00 0.00 C ATOM 992 CD GLU A 65 0.734 20.179 -1.278 1.00 0.00 C ATOM 993 OE1 GLU A 65 -0.064 20.976 -1.815 1.00 0.00 O ATOM 994 OE2 GLU A 65 1.804 20.483 -0.707 1.00 0.00 O ATOM 0 H GLU A 65 -3.071 17.364 -1.662 1.00 0.00 H new ATOM 0 HA GLU A 65 -0.494 16.417 -1.065 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -1.775 18.896 -1.429 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -1.134 18.959 0.200 1.00 0.00 H new ATOM 0 HG2 GLU A 65 1.096 18.120 -0.749 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.419 18.335 -2.351 1.00 0.00 H new ATOM 1001 N ASN A 66 -2.440 16.986 1.535 1.00 0.00 N ATOM 1002 CA ASN A 66 -2.621 16.691 2.946 1.00 0.00 C ATOM 1003 C ASN A 66 -3.538 15.474 3.094 1.00 0.00 C ATOM 1004 O ASN A 66 -4.453 15.281 2.296 1.00 0.00 O ATOM 1005 CB ASN A 66 -3.274 17.866 3.676 1.00 0.00 C ATOM 1006 CG ASN A 66 -4.548 18.317 2.959 1.00 0.00 C ATOM 1007 OD1 ASN A 66 -5.595 17.525 3.167 1.00 0.00 O flip ATOM 1008 ND2 ASN A 66 -4.578 19.319 2.263 1.00 0.00 N flip ATOM 0 H ASN A 66 -3.197 17.522 1.111 1.00 0.00 H new ATOM 0 HA ASN A 66 -1.639 16.499 3.379 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -3.512 17.576 4.700 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -2.572 18.698 3.735 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -3.737 19.883 2.145 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -5.444 19.592 1.799 1.00 0.00 H new ATOM 1015 N PRO A 67 -3.253 14.665 4.150 1.00 0.00 N ATOM 1016 CA PRO A 67 -4.040 13.473 4.413 1.00 0.00 C ATOM 1017 C PRO A 67 -5.400 13.836 5.015 1.00 0.00 C ATOM 1018 O PRO A 67 -5.506 14.784 5.791 1.00 0.00 O ATOM 1019 CB PRO A 67 -3.183 12.633 5.346 1.00 0.00 C ATOM 1020 CG PRO A 67 -2.157 13.585 5.939 1.00 0.00 C ATOM 1021 CD PRO A 67 -2.176 14.863 5.116 1.00 0.00 C ATOM 0 HA PRO A 67 -4.279 12.918 3.506 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -3.789 12.176 6.128 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -2.696 11.822 4.805 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -2.393 13.799 6.982 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -1.164 13.135 5.922 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -2.362 15.735 5.743 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -1.221 15.027 4.617 1.00 0.00 H new ATOM 1029 N PRO A 68 -6.432 13.043 4.623 1.00 0.00 N ATOM 1030 CA PRO A 68 -7.780 13.271 5.115 1.00 0.00 C ATOM 1031 C PRO A 68 -7.922 12.800 6.563 1.00 0.00 C ATOM 1032 O PRO A 68 -6.925 12.607 7.258 1.00 0.00 O ATOM 1033 CB PRO A 68 -8.683 12.515 4.153 1.00 0.00 C ATOM 1034 CG PRO A 68 -7.787 11.517 3.438 1.00 0.00 C ATOM 1035 CD PRO A 68 -6.344 11.911 3.705 1.00 0.00 C ATOM 0 HA PRO A 68 -8.045 14.328 5.142 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -9.485 12.006 4.688 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -9.154 13.195 3.443 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -7.979 10.506 3.797 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -7.991 11.519 2.367 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.784 11.087 4.146 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -5.832 12.188 2.783 1.00 0.00 H new ATOM 1043 N SER A 69 -9.169 12.628 6.977 1.00 0.00 N ATOM 1044 CA SER A 69 -9.455 12.184 8.330 1.00 0.00 C ATOM 1045 C SER A 69 -10.745 11.362 8.350 1.00 0.00 C ATOM 1046 O SER A 69 -10.790 10.284 8.939 1.00 0.00 O ATOM 1047 CB SER A 69 -9.567 13.371 9.288 1.00 0.00 C ATOM 1048 OG SER A 69 -8.904 13.124 10.525 1.00 0.00 O ATOM 0 H SER A 69 -9.993 12.788 6.398 1.00 0.00 H new ATOM 0 HA SER A 69 -8.628 11.558 8.666 1.00 0.00 H new ATOM 0 HB2 SER A 69 -9.140 14.257 8.819 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.619 13.586 9.477 1.00 0.00 H new ATOM 0 HG SER A 69 -8.997 13.906 11.108 1.00 0.00 H new ATOM 1054 N MET A 70 -11.764 11.904 7.698 1.00 0.00 N ATOM 1055 CA MET A 70 -13.052 11.235 7.634 1.00 0.00 C ATOM 1056 C MET A 70 -12.881 9.743 7.340 1.00 0.00 C ATOM 1057 O MET A 70 -11.967 9.350 6.616 1.00 0.00 O ATOM 1058 CB MET A 70 -13.906 11.877 6.538 1.00 0.00 C ATOM 1059 CG MET A 70 -15.113 12.601 7.138 1.00 0.00 C ATOM 1060 SD MET A 70 -16.582 12.224 6.196 1.00 0.00 S ATOM 1061 CE MET A 70 -17.689 11.763 7.518 1.00 0.00 C ATOM 0 H MET A 70 -11.723 12.799 7.210 1.00 0.00 H new ATOM 0 HA MET A 70 -13.545 11.341 8.601 1.00 0.00 H new ATOM 0 HB2 MET A 70 -13.302 12.582 5.967 1.00 0.00 H new ATOM 0 HB3 MET A 70 -14.246 11.111 5.841 1.00 0.00 H new ATOM 0 HG2 MET A 70 -15.249 12.299 8.176 1.00 0.00 H new ATOM 0 HG3 MET A 70 -14.938 13.677 7.140 1.00 0.00 H new ATOM 0 HE1 MET A 70 -18.661 11.496 7.102 1.00 0.00 H new ATOM 0 HE2 MET A 70 -17.277 10.909 8.056 1.00 0.00 H new ATOM 0 HE3 MET A 70 -17.806 12.602 8.204 1.00 0.00 H new ATOM 1071 N VAL A 71 -13.774 8.953 7.917 1.00 0.00 N ATOM 1072 CA VAL A 71 -13.734 7.513 7.726 1.00 0.00 C ATOM 1073 C VAL A 71 -13.956 7.193 6.246 1.00 0.00 C ATOM 1074 O VAL A 71 -13.027 6.789 5.549 1.00 0.00 O ATOM 1075 CB VAL A 71 -14.752 6.834 8.644 1.00 0.00 C ATOM 1076 CG1 VAL A 71 -14.864 5.341 8.330 1.00 0.00 C ATOM 1077 CG2 VAL A 71 -14.400 7.060 10.115 1.00 0.00 C ATOM 0 H VAL A 71 -14.530 9.283 8.517 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.756 7.119 8.001 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.725 7.289 8.459 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -15.594 4.883 8.997 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -15.184 5.210 7.296 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.894 4.865 8.473 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -15.140 6.567 10.746 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -13.413 6.645 10.321 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -14.396 8.129 10.328 1.00 0.00 H new ATOM 1087 N PHE A 72 -15.192 7.385 5.811 1.00 0.00 N ATOM 1088 CA PHE A 72 -15.548 7.121 4.427 1.00 0.00 C ATOM 1089 C PHE A 72 -14.441 7.587 3.478 1.00 0.00 C ATOM 1090 O PHE A 72 -14.228 6.986 2.426 1.00 0.00 O ATOM 1091 CB PHE A 72 -16.822 7.916 4.134 1.00 0.00 C ATOM 1092 CG PHE A 72 -18.067 7.381 4.845 1.00 0.00 C ATOM 1093 CD1 PHE A 72 -18.374 7.815 6.097 1.00 0.00 C ATOM 1094 CD2 PHE A 72 -18.866 6.471 4.226 1.00 0.00 C ATOM 1095 CE1 PHE A 72 -19.529 7.318 6.757 1.00 0.00 C ATOM 1096 CE2 PHE A 72 -20.021 5.974 4.886 1.00 0.00 C ATOM 1097 CZ PHE A 72 -20.328 6.408 6.137 1.00 0.00 C ATOM 0 H PHE A 72 -15.960 7.720 6.392 1.00 0.00 H new ATOM 0 HA PHE A 72 -15.692 6.051 4.277 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -16.666 8.954 4.428 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -17.001 7.913 3.059 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -17.740 8.537 6.589 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -18.622 6.126 3.232 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -19.773 7.662 7.751 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -20.655 5.251 4.394 1.00 0.00 H new ATOM 0 HZ PHE A 72 -21.207 6.030 6.639 1.00 0.00 H new ATOM 1107 N LYS A 73 -13.767 8.652 3.885 1.00 0.00 N ATOM 1108 CA LYS A 73 -12.688 9.205 3.084 1.00 0.00 C ATOM 1109 C LYS A 73 -11.494 8.249 3.116 1.00 0.00 C ATOM 1110 O LYS A 73 -11.127 7.673 2.092 1.00 0.00 O ATOM 1111 CB LYS A 73 -12.351 10.624 3.545 1.00 0.00 C ATOM 1112 CG LYS A 73 -13.062 11.665 2.677 1.00 0.00 C ATOM 1113 CD LYS A 73 -12.350 11.837 1.334 1.00 0.00 C ATOM 1114 CE LYS A 73 -13.338 12.243 0.238 1.00 0.00 C ATOM 1115 NZ LYS A 73 -13.262 13.699 -0.014 1.00 0.00 N ATOM 0 H LYS A 73 -13.947 9.147 4.759 1.00 0.00 H new ATOM 0 HA LYS A 73 -12.996 9.298 2.043 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -12.645 10.751 4.587 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -11.273 10.780 3.497 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -14.095 11.359 2.509 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -13.094 12.620 3.201 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -11.571 12.594 1.425 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -11.857 10.905 1.057 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -13.117 11.697 -0.679 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -14.351 11.972 0.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -13.939 13.958 -0.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -13.495 14.215 0.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -12.299 13.949 -0.318 1.00 0.00 H new ATOM 1129 N GLN A 74 -10.919 8.109 4.302 1.00 0.00 N ATOM 1130 CA GLN A 74 -9.774 7.233 4.480 1.00 0.00 C ATOM 1131 C GLN A 74 -10.046 5.868 3.844 1.00 0.00 C ATOM 1132 O GLN A 74 -9.270 5.401 3.012 1.00 0.00 O ATOM 1133 CB GLN A 74 -9.421 7.087 5.962 1.00 0.00 C ATOM 1134 CG GLN A 74 -8.917 8.411 6.538 1.00 0.00 C ATOM 1135 CD GLN A 74 -7.470 8.678 6.116 1.00 0.00 C ATOM 1136 OE1 GLN A 74 -7.101 8.553 4.960 1.00 0.00 O ATOM 1137 NE2 GLN A 74 -6.675 9.050 7.115 1.00 0.00 N ATOM 0 H GLN A 74 -11.225 8.588 5.149 1.00 0.00 H new ATOM 0 HA GLN A 74 -8.916 7.681 3.978 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -10.298 6.755 6.517 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -8.657 6.319 6.084 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -9.555 9.226 6.197 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -8.984 8.387 7.626 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -7.049 9.135 8.060 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -5.691 9.250 6.936 1.00 0.00 H new ATOM 1146 N MET A 75 -11.151 5.266 4.261 1.00 0.00 N ATOM 1147 CA MET A 75 -11.535 3.964 3.743 1.00 0.00 C ATOM 1148 C MET A 75 -11.477 3.944 2.214 1.00 0.00 C ATOM 1149 O MET A 75 -11.000 2.978 1.620 1.00 0.00 O ATOM 1150 CB MET A 75 -12.954 3.629 4.205 1.00 0.00 C ATOM 1151 CG MET A 75 -12.948 3.055 5.623 1.00 0.00 C ATOM 1152 SD MET A 75 -14.038 1.644 5.715 1.00 0.00 S ATOM 1153 CE MET A 75 -13.090 0.590 6.800 1.00 0.00 C ATOM 0 H MET A 75 -11.792 5.656 4.952 1.00 0.00 H new ATOM 0 HA MET A 75 -10.835 3.221 4.124 1.00 0.00 H new ATOM 0 HB2 MET A 75 -13.571 4.527 4.175 1.00 0.00 H new ATOM 0 HB3 MET A 75 -13.403 2.910 3.520 1.00 0.00 H new ATOM 0 HG2 MET A 75 -11.936 2.762 5.901 1.00 0.00 H new ATOM 0 HG3 MET A 75 -13.266 3.817 6.334 1.00 0.00 H new ATOM 0 HE1 MET A 75 -13.297 -0.454 6.565 1.00 0.00 H new ATOM 0 HE2 MET A 75 -12.027 0.789 6.663 1.00 0.00 H new ATOM 0 HE3 MET A 75 -13.366 0.791 7.835 1.00 0.00 H new ATOM 1163 N GLU A 76 -11.970 5.021 1.621 1.00 0.00 N ATOM 1164 CA GLU A 76 -11.980 5.139 0.173 1.00 0.00 C ATOM 1165 C GLU A 76 -10.551 5.252 -0.361 1.00 0.00 C ATOM 1166 O GLU A 76 -10.206 4.623 -1.361 1.00 0.00 O ATOM 1167 CB GLU A 76 -12.828 6.332 -0.274 1.00 0.00 C ATOM 1168 CG GLU A 76 -14.281 5.914 -0.510 1.00 0.00 C ATOM 1169 CD GLU A 76 -14.806 6.481 -1.831 1.00 0.00 C ATOM 1170 OE1 GLU A 76 -15.141 7.685 -1.838 1.00 0.00 O ATOM 1171 OE2 GLU A 76 -14.862 5.697 -2.802 1.00 0.00 O ATOM 0 H GLU A 76 -12.365 5.820 2.117 1.00 0.00 H new ATOM 0 HA GLU A 76 -12.432 4.238 -0.242 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -12.789 7.114 0.484 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -12.414 6.754 -1.190 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -14.353 4.826 -0.523 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -14.903 6.265 0.314 1.00 0.00 H new ATOM 1178 N GLN A 77 -9.757 6.058 0.329 1.00 0.00 N ATOM 1179 CA GLN A 77 -8.373 6.261 -0.063 1.00 0.00 C ATOM 1180 C GLN A 77 -7.705 4.918 -0.367 1.00 0.00 C ATOM 1181 O GLN A 77 -7.075 4.756 -1.411 1.00 0.00 O ATOM 1182 CB GLN A 77 -7.603 7.024 1.017 1.00 0.00 C ATOM 1183 CG GLN A 77 -6.157 7.274 0.586 1.00 0.00 C ATOM 1184 CD GLN A 77 -6.062 8.485 -0.343 1.00 0.00 C ATOM 1185 OE1 GLN A 77 -6.281 9.620 0.049 1.00 0.00 O ATOM 1186 NE2 GLN A 77 -5.725 8.183 -1.594 1.00 0.00 N ATOM 0 H GLN A 77 -10.046 6.578 1.157 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.358 6.866 -0.970 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.096 7.975 1.217 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.616 6.456 1.947 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -5.535 7.437 1.466 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -5.767 6.391 0.079 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -5.555 7.212 -1.856 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.636 8.922 -2.291 1.00 0.00 H new ATOM 1195 N VAL A 78 -7.865 3.990 0.565 1.00 0.00 N ATOM 1196 CA VAL A 78 -7.285 2.666 0.410 1.00 0.00 C ATOM 1197 C VAL A 78 -7.982 1.941 -0.743 1.00 0.00 C ATOM 1198 O VAL A 78 -7.325 1.449 -1.659 1.00 0.00 O ATOM 1199 CB VAL A 78 -7.365 1.902 1.733 1.00 0.00 C ATOM 1200 CG1 VAL A 78 -6.816 0.482 1.580 1.00 0.00 C ATOM 1201 CG2 VAL A 78 -6.634 2.655 2.846 1.00 0.00 C ATOM 0 H VAL A 78 -8.388 4.128 1.430 1.00 0.00 H new ATOM 0 HA VAL A 78 -6.228 2.739 0.156 1.00 0.00 H new ATOM 0 HB VAL A 78 -8.416 1.827 2.013 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.884 -0.039 2.535 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.398 -0.055 0.831 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -5.773 0.527 1.265 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.706 2.090 3.776 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.585 2.776 2.575 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -7.089 3.636 2.981 1.00 0.00 H new ATOM 1211 N ALA A 79 -9.303 1.896 -0.659 1.00 0.00 N ATOM 1212 CA ALA A 79 -10.096 1.239 -1.684 1.00 0.00 C ATOM 1213 C ALA A 79 -9.583 1.654 -3.064 1.00 0.00 C ATOM 1214 O ALA A 79 -9.344 0.805 -3.923 1.00 0.00 O ATOM 1215 CB ALA A 79 -11.574 1.582 -1.485 1.00 0.00 C ATOM 0 H ALA A 79 -9.844 2.304 0.103 1.00 0.00 H new ATOM 0 HA ALA A 79 -9.999 0.156 -1.608 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -12.169 1.089 -2.254 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -11.898 1.241 -0.502 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -11.710 2.661 -1.557 1.00 0.00 H new ATOM 1221 N GLN A 80 -9.428 2.958 -3.236 1.00 0.00 N ATOM 1222 CA GLN A 80 -8.947 3.496 -4.497 1.00 0.00 C ATOM 1223 C GLN A 80 -7.669 2.773 -4.929 1.00 0.00 C ATOM 1224 O GLN A 80 -7.523 2.406 -6.094 1.00 0.00 O ATOM 1225 CB GLN A 80 -8.716 5.005 -4.398 1.00 0.00 C ATOM 1226 CG GLN A 80 -10.043 5.755 -4.270 1.00 0.00 C ATOM 1227 CD GLN A 80 -9.811 7.262 -4.144 1.00 0.00 C ATOM 1228 OE1 GLN A 80 -9.277 7.911 -5.029 1.00 0.00 O ATOM 1229 NE2 GLN A 80 -10.239 7.782 -2.997 1.00 0.00 N ATOM 0 H GLN A 80 -9.627 3.659 -2.522 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.711 3.328 -5.256 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.086 5.224 -3.536 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.181 5.353 -5.281 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.666 5.551 -5.141 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.587 5.393 -3.397 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -10.678 7.183 -2.298 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -10.129 8.780 -2.817 1.00 0.00 H new ATOM 1238 N PHE A 81 -6.777 2.590 -3.967 1.00 0.00 N ATOM 1239 CA PHE A 81 -5.516 1.918 -4.234 1.00 0.00 C ATOM 1240 C PHE A 81 -5.729 0.417 -4.442 1.00 0.00 C ATOM 1241 O PHE A 81 -5.184 -0.167 -5.378 1.00 0.00 O ATOM 1242 CB PHE A 81 -4.628 2.129 -3.007 1.00 0.00 C ATOM 1243 CG PHE A 81 -3.690 0.958 -2.708 1.00 0.00 C ATOM 1244 CD1 PHE A 81 -2.779 0.562 -3.637 1.00 0.00 C ATOM 1245 CD2 PHE A 81 -3.767 0.313 -1.513 1.00 0.00 C ATOM 1246 CE1 PHE A 81 -1.909 -0.525 -3.360 1.00 0.00 C ATOM 1247 CE2 PHE A 81 -2.897 -0.774 -1.236 1.00 0.00 C ATOM 1248 CZ PHE A 81 -1.986 -1.170 -2.165 1.00 0.00 C ATOM 0 H PHE A 81 -6.902 2.895 -3.002 1.00 0.00 H new ATOM 0 HA PHE A 81 -5.063 2.323 -5.139 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -4.032 3.030 -3.153 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -5.262 2.304 -2.138 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -2.717 1.075 -4.586 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -4.490 0.628 -0.775 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.186 -0.840 -4.098 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -2.959 -1.287 -0.287 1.00 0.00 H new ATOM 0 HZ PHE A 81 -1.324 -1.997 -1.954 1.00 0.00 H new ATOM 1258 N LEU A 82 -6.522 -0.165 -3.555 1.00 0.00 N ATOM 1259 CA LEU A 82 -6.814 -1.586 -3.629 1.00 0.00 C ATOM 1260 C LEU A 82 -7.212 -1.946 -5.062 1.00 0.00 C ATOM 1261 O LEU A 82 -6.629 -2.847 -5.664 1.00 0.00 O ATOM 1262 CB LEU A 82 -7.861 -1.974 -2.584 1.00 0.00 C ATOM 1263 CG LEU A 82 -7.361 -2.086 -1.142 1.00 0.00 C ATOM 1264 CD1 LEU A 82 -8.527 -2.269 -0.170 1.00 0.00 C ATOM 1265 CD2 LEU A 82 -6.322 -3.201 -1.008 1.00 0.00 C ATOM 0 H LEU A 82 -6.972 0.323 -2.780 1.00 0.00 H new ATOM 0 HA LEU A 82 -5.926 -2.170 -3.388 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -8.664 -1.238 -2.613 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.296 -2.931 -2.872 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.866 -1.151 -0.878 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.144 -2.346 0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -9.198 -1.413 -0.241 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -9.072 -3.179 -0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.983 -3.260 0.026 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -6.769 -4.152 -1.298 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.473 -2.987 -1.657 1.00 0.00 H new ATOM 1277 N LYS A 83 -8.202 -1.224 -5.566 1.00 0.00 N ATOM 1278 CA LYS A 83 -8.685 -1.456 -6.917 1.00 0.00 C ATOM 1279 C LYS A 83 -7.543 -1.226 -7.909 1.00 0.00 C ATOM 1280 O LYS A 83 -7.403 -1.965 -8.882 1.00 0.00 O ATOM 1281 CB LYS A 83 -9.924 -0.604 -7.197 1.00 0.00 C ATOM 1282 CG LYS A 83 -10.749 -1.194 -8.342 1.00 0.00 C ATOM 1283 CD LYS A 83 -12.159 -0.601 -8.365 1.00 0.00 C ATOM 1284 CE LYS A 83 -12.965 -1.148 -9.544 1.00 0.00 C ATOM 1285 NZ LYS A 83 -13.586 -0.042 -10.306 1.00 0.00 N ATOM 0 H LYS A 83 -8.683 -0.478 -5.063 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.006 -2.491 -7.034 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.537 -0.541 -6.298 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -9.621 0.412 -7.449 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.252 -0.997 -9.292 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.808 -2.277 -8.232 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.670 -0.834 -7.431 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.099 0.485 -8.433 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -12.315 -1.728 -10.199 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -13.738 -1.826 -9.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.129 -0.431 -11.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -14.222 0.495 -9.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.843 0.589 -10.669 1.00 0.00 H new ATOM 1299 N ALA A 84 -6.755 -0.199 -7.627 1.00 0.00 N ATOM 1300 CA ALA A 84 -5.630 0.138 -8.483 1.00 0.00 C ATOM 1301 C ALA A 84 -4.623 -1.015 -8.471 1.00 0.00 C ATOM 1302 O ALA A 84 -4.049 -1.352 -9.505 1.00 0.00 O ATOM 1303 CB ALA A 84 -5.011 1.457 -8.017 1.00 0.00 C ATOM 0 H ALA A 84 -6.873 0.411 -6.818 1.00 0.00 H new ATOM 0 HA ALA A 84 -5.959 0.278 -9.513 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.167 1.710 -8.659 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -5.758 2.249 -8.071 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.666 1.354 -6.988 1.00 0.00 H new ATOM 1309 N ALA A 85 -4.441 -1.587 -7.290 1.00 0.00 N ATOM 1310 CA ALA A 85 -3.515 -2.695 -7.131 1.00 0.00 C ATOM 1311 C ALA A 85 -4.018 -3.895 -7.935 1.00 0.00 C ATOM 1312 O ALA A 85 -3.224 -4.710 -8.403 1.00 0.00 O ATOM 1313 CB ALA A 85 -3.353 -3.016 -5.644 1.00 0.00 C ATOM 0 H ALA A 85 -4.919 -1.304 -6.434 1.00 0.00 H new ATOM 0 HA ALA A 85 -2.531 -2.430 -7.516 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.658 -3.847 -5.525 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.965 -2.141 -5.123 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -4.321 -3.289 -5.223 1.00 0.00 H new ATOM 1319 N GLU A 86 -5.334 -3.966 -8.071 1.00 0.00 N ATOM 1320 CA GLU A 86 -5.952 -5.053 -8.811 1.00 0.00 C ATOM 1321 C GLU A 86 -5.656 -4.914 -10.306 1.00 0.00 C ATOM 1322 O GLU A 86 -5.189 -5.858 -10.941 1.00 0.00 O ATOM 1323 CB GLU A 86 -7.459 -5.105 -8.552 1.00 0.00 C ATOM 1324 CG GLU A 86 -7.898 -6.514 -8.148 1.00 0.00 C ATOM 1325 CD GLU A 86 -8.644 -7.205 -9.290 1.00 0.00 C ATOM 1326 OE1 GLU A 86 -9.476 -6.519 -9.923 1.00 0.00 O ATOM 1327 OE2 GLU A 86 -8.366 -8.405 -9.506 1.00 0.00 O ATOM 0 H GLU A 86 -5.989 -3.288 -7.681 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.524 -5.993 -8.463 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -7.721 -4.399 -7.764 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -7.996 -4.796 -9.448 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.025 -7.105 -7.869 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -8.541 -6.460 -7.269 1.00 0.00 H new ATOM 1334 N ASP A 87 -5.942 -3.729 -10.825 1.00 0.00 N ATOM 1335 CA ASP A 87 -5.713 -3.453 -12.233 1.00 0.00 C ATOM 1336 C ASP A 87 -4.269 -3.815 -12.590 1.00 0.00 C ATOM 1337 O ASP A 87 -3.999 -4.289 -13.693 1.00 0.00 O ATOM 1338 CB ASP A 87 -5.920 -1.970 -12.545 1.00 0.00 C ATOM 1339 CG ASP A 87 -7.309 -1.609 -13.076 1.00 0.00 C ATOM 1340 OD1 ASP A 87 -7.855 -2.431 -13.843 1.00 0.00 O ATOM 1341 OD2 ASP A 87 -7.793 -0.519 -12.703 1.00 0.00 O ATOM 0 H ASP A 87 -6.330 -2.949 -10.295 1.00 0.00 H new ATOM 0 HA ASP A 87 -6.422 -4.045 -12.813 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.733 -1.394 -11.639 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.175 -1.661 -13.279 1.00 0.00 H new ATOM 1346 N TYR A 88 -3.380 -3.576 -11.638 1.00 0.00 N ATOM 1347 CA TYR A 88 -1.972 -3.870 -11.838 1.00 0.00 C ATOM 1348 C TYR A 88 -1.773 -5.317 -12.297 1.00 0.00 C ATOM 1349 O TYR A 88 -1.084 -5.570 -13.283 1.00 0.00 O ATOM 1350 CB TYR A 88 -1.303 -3.684 -10.474 1.00 0.00 C ATOM 1351 CG TYR A 88 0.155 -3.229 -10.553 1.00 0.00 C ATOM 1352 CD1 TYR A 88 0.487 -2.095 -11.266 1.00 0.00 C ATOM 1353 CD2 TYR A 88 1.139 -3.953 -9.911 1.00 0.00 C ATOM 1354 CE1 TYR A 88 1.860 -1.667 -11.340 1.00 0.00 C ATOM 1355 CE2 TYR A 88 2.512 -3.525 -9.985 1.00 0.00 C ATOM 1356 CZ TYR A 88 2.805 -2.403 -10.696 1.00 0.00 C ATOM 1357 OH TYR A 88 4.101 -1.999 -10.766 1.00 0.00 O ATOM 0 H TYR A 88 -3.608 -3.182 -10.725 1.00 0.00 H new ATOM 0 HA TYR A 88 -1.550 -3.218 -12.603 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -1.871 -2.952 -9.899 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -1.350 -4.625 -9.926 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.283 -1.528 -11.769 1.00 0.00 H new ATOM 0 HD2 TYR A 88 0.879 -4.841 -9.353 1.00 0.00 H new ATOM 0 HE1 TYR A 88 2.133 -0.781 -11.895 1.00 0.00 H new ATOM 0 HE2 TYR A 88 3.292 -4.082 -9.487 1.00 0.00 H new ATOM 0 HH TYR A 88 4.139 -1.076 -11.093 1.00 0.00 H new ATOM 1367 N GLY A 89 -2.390 -6.227 -11.559 1.00 0.00 N ATOM 1368 CA GLY A 89 -2.291 -7.642 -11.877 1.00 0.00 C ATOM 1369 C GLY A 89 -2.204 -8.486 -10.604 1.00 0.00 C ATOM 1370 O GLY A 89 -1.397 -9.410 -10.521 1.00 0.00 O ATOM 0 H GLY A 89 -2.961 -6.013 -10.741 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -3.158 -7.948 -12.462 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.411 -7.819 -12.495 1.00 0.00 H new ATOM 1374 N VAL A 90 -3.046 -8.137 -9.642 1.00 0.00 N ATOM 1375 CA VAL A 90 -3.075 -8.851 -8.377 1.00 0.00 C ATOM 1376 C VAL A 90 -4.336 -9.714 -8.312 1.00 0.00 C ATOM 1377 O VAL A 90 -5.429 -9.247 -8.628 1.00 0.00 O ATOM 1378 CB VAL A 90 -2.967 -7.861 -7.215 1.00 0.00 C ATOM 1379 CG1 VAL A 90 -3.181 -8.565 -5.874 1.00 0.00 C ATOM 1380 CG2 VAL A 90 -1.624 -7.128 -7.242 1.00 0.00 C ATOM 0 H VAL A 90 -3.713 -7.369 -9.713 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.219 -9.521 -8.297 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.756 -7.118 -7.333 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -3.099 -7.839 -5.065 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.172 -9.019 -5.855 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.425 -9.339 -5.745 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.573 -6.431 -6.406 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.813 -7.852 -7.161 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -1.528 -6.579 -8.179 1.00 0.00 H new ATOM 1390 N ILE A 91 -4.142 -10.958 -7.900 1.00 0.00 N ATOM 1391 CA ILE A 91 -5.251 -11.891 -7.789 1.00 0.00 C ATOM 1392 C ILE A 91 -6.296 -11.322 -6.828 1.00 0.00 C ATOM 1393 O ILE A 91 -6.193 -10.173 -6.401 1.00 0.00 O ATOM 1394 CB ILE A 91 -4.745 -13.280 -7.396 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -3.976 -13.230 -6.074 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -3.912 -13.899 -8.520 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -3.484 -14.622 -5.672 1.00 0.00 C ATOM 0 H ILE A 91 -3.234 -11.342 -7.639 1.00 0.00 H new ATOM 0 HA ILE A 91 -5.741 -12.017 -8.754 1.00 0.00 H new ATOM 0 HB ILE A 91 -5.609 -13.927 -7.242 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.127 -12.554 -6.169 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -4.618 -12.827 -5.291 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -3.565 -14.886 -8.214 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -4.524 -13.991 -9.418 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -3.053 -13.261 -8.730 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.941 -14.558 -4.729 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -4.338 -15.290 -5.554 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.823 -15.012 -6.446 1.00 0.00 H new ATOM 1409 N LYS A 92 -7.280 -12.153 -6.515 1.00 0.00 N ATOM 1410 CA LYS A 92 -8.344 -11.747 -5.612 1.00 0.00 C ATOM 1411 C LYS A 92 -8.175 -12.471 -4.274 1.00 0.00 C ATOM 1412 O LYS A 92 -8.940 -12.241 -3.339 1.00 0.00 O ATOM 1413 CB LYS A 92 -9.711 -11.967 -6.261 1.00 0.00 C ATOM 1414 CG LYS A 92 -9.994 -10.898 -7.319 1.00 0.00 C ATOM 1415 CD LYS A 92 -11.419 -10.357 -7.183 1.00 0.00 C ATOM 1416 CE LYS A 92 -12.405 -11.197 -7.997 1.00 0.00 C ATOM 1417 NZ LYS A 92 -12.342 -10.827 -9.429 1.00 0.00 N ATOM 0 H LYS A 92 -7.363 -13.105 -6.871 1.00 0.00 H new ATOM 0 HA LYS A 92 -8.283 -10.678 -5.407 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -9.745 -12.955 -6.719 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -10.488 -11.943 -5.497 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -9.280 -10.081 -7.216 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -9.855 -11.320 -8.314 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -11.714 -10.359 -6.134 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -11.452 -9.321 -7.521 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -12.174 -12.256 -7.878 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -13.417 -11.047 -7.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -13.064 -11.358 -9.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -12.517 -9.807 -9.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -11.400 -11.056 -9.806 1.00 0.00 H new ATOM 1431 N THR A 93 -7.167 -13.330 -4.226 1.00 0.00 N ATOM 1432 CA THR A 93 -6.888 -14.088 -3.018 1.00 0.00 C ATOM 1433 C THR A 93 -5.662 -13.518 -2.302 1.00 0.00 C ATOM 1434 O THR A 93 -5.227 -14.057 -1.285 1.00 0.00 O ATOM 1435 CB THR A 93 -6.734 -15.559 -3.409 1.00 0.00 C ATOM 1436 OG1 THR A 93 -5.438 -15.628 -3.998 1.00 0.00 O ATOM 1437 CG2 THR A 93 -7.680 -15.967 -4.540 1.00 0.00 C ATOM 0 H THR A 93 -6.534 -13.518 -5.004 1.00 0.00 H new ATOM 0 HA THR A 93 -7.708 -14.010 -2.304 1.00 0.00 H new ATOM 0 HB THR A 93 -6.919 -16.187 -2.538 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.190 -16.566 -4.133 1.00 0.00 H new ATOM 0 HG21 THR A 93 -7.529 -17.020 -4.778 1.00 0.00 H new ATOM 0 HG22 THR A 93 -8.712 -15.810 -4.226 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.474 -15.362 -5.423 1.00 0.00 H new ATOM 1445 N ASP A 94 -5.141 -12.435 -2.860 1.00 0.00 N ATOM 1446 CA ASP A 94 -3.974 -11.786 -2.287 1.00 0.00 C ATOM 1447 C ASP A 94 -4.381 -10.425 -1.718 1.00 0.00 C ATOM 1448 O ASP A 94 -3.633 -9.821 -0.950 1.00 0.00 O ATOM 1449 CB ASP A 94 -2.897 -11.553 -3.348 1.00 0.00 C ATOM 1450 CG ASP A 94 -1.704 -12.507 -3.280 1.00 0.00 C ATOM 1451 OD1 ASP A 94 -1.950 -13.730 -3.361 1.00 0.00 O ATOM 1452 OD2 ASP A 94 -0.572 -11.993 -3.149 1.00 0.00 O ATOM 0 H ASP A 94 -5.506 -11.991 -3.703 1.00 0.00 H new ATOM 0 HA ASP A 94 -3.576 -12.435 -1.506 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -3.355 -11.638 -4.333 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -2.531 -10.531 -3.254 1.00 0.00 H new ATOM 1457 N MET A 95 -5.564 -9.983 -2.117 1.00 0.00 N ATOM 1458 CA MET A 95 -6.079 -8.704 -1.657 1.00 0.00 C ATOM 1459 C MET A 95 -6.785 -8.852 -0.307 1.00 0.00 C ATOM 1460 O MET A 95 -7.202 -9.948 0.063 1.00 0.00 O ATOM 1461 CB MET A 95 -7.061 -8.148 -2.689 1.00 0.00 C ATOM 1462 CG MET A 95 -6.347 -7.810 -3.999 1.00 0.00 C ATOM 1463 SD MET A 95 -5.259 -6.415 -3.760 1.00 0.00 S ATOM 1464 CE MET A 95 -6.356 -5.084 -4.222 1.00 0.00 C ATOM 0 H MET A 95 -6.181 -10.487 -2.754 1.00 0.00 H new ATOM 0 HA MET A 95 -5.241 -8.018 -1.535 1.00 0.00 H new ATOM 0 HB2 MET A 95 -7.848 -8.878 -2.878 1.00 0.00 H new ATOM 0 HB3 MET A 95 -7.543 -7.255 -2.293 1.00 0.00 H new ATOM 0 HG2 MET A 95 -5.776 -8.672 -4.344 1.00 0.00 H new ATOM 0 HG3 MET A 95 -7.079 -7.582 -4.773 1.00 0.00 H new ATOM 0 HE1 MET A 95 -5.976 -4.144 -3.822 1.00 0.00 H new ATOM 0 HE2 MET A 95 -6.413 -5.020 -5.309 1.00 0.00 H new ATOM 0 HE3 MET A 95 -7.350 -5.275 -3.817 1.00 0.00 H new ATOM 1474 N PHE A 96 -6.897 -7.731 0.391 1.00 0.00 N ATOM 1475 CA PHE A 96 -7.545 -7.722 1.691 1.00 0.00 C ATOM 1476 C PHE A 96 -8.673 -6.688 1.734 1.00 0.00 C ATOM 1477 O PHE A 96 -8.872 -5.942 0.777 1.00 0.00 O ATOM 1478 CB PHE A 96 -6.479 -7.339 2.720 1.00 0.00 C ATOM 1479 CG PHE A 96 -5.883 -5.946 2.510 1.00 0.00 C ATOM 1480 CD1 PHE A 96 -6.511 -4.853 3.022 1.00 0.00 C ATOM 1481 CD2 PHE A 96 -4.726 -5.799 1.811 1.00 0.00 C ATOM 1482 CE1 PHE A 96 -5.958 -3.560 2.826 1.00 0.00 C ATOM 1483 CE2 PHE A 96 -4.173 -4.506 1.616 1.00 0.00 C ATOM 1484 CZ PHE A 96 -4.801 -3.414 2.128 1.00 0.00 C ATOM 0 H PHE A 96 -6.550 -6.823 0.081 1.00 0.00 H new ATOM 0 HA PHE A 96 -7.977 -8.701 1.898 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -6.917 -7.389 3.717 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -5.676 -8.075 2.687 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -7.430 -4.969 3.577 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.227 -6.666 1.404 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -6.457 -2.692 3.232 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -3.254 -4.390 1.061 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.380 -2.430 1.980 1.00 0.00 H new ATOM 1494 N GLN A 97 -9.381 -6.678 2.854 1.00 0.00 N ATOM 1495 CA GLN A 97 -10.483 -5.749 3.034 1.00 0.00 C ATOM 1496 C GLN A 97 -10.003 -4.491 3.762 1.00 0.00 C ATOM 1497 O GLN A 97 -9.260 -4.580 4.739 1.00 0.00 O ATOM 1498 CB GLN A 97 -11.640 -6.410 3.786 1.00 0.00 C ATOM 1499 CG GLN A 97 -12.629 -7.055 2.813 1.00 0.00 C ATOM 1500 CD GLN A 97 -14.058 -6.587 3.093 1.00 0.00 C ATOM 1501 OE1 GLN A 97 -14.819 -7.222 3.805 1.00 0.00 O ATOM 1502 NE2 GLN A 97 -14.380 -5.444 2.494 1.00 0.00 N ATOM 0 H GLN A 97 -9.213 -7.299 3.646 1.00 0.00 H new ATOM 0 HA GLN A 97 -10.852 -5.458 2.050 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -11.250 -7.166 4.468 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -12.155 -5.666 4.394 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -12.354 -6.803 1.789 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.574 -8.140 2.900 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -13.695 -4.963 1.911 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -15.312 -5.048 2.618 1.00 0.00 H new ATOM 1511 N THR A 98 -10.448 -3.349 3.259 1.00 0.00 N ATOM 1512 CA THR A 98 -10.073 -2.075 3.849 1.00 0.00 C ATOM 1513 C THR A 98 -9.990 -2.197 5.371 1.00 0.00 C ATOM 1514 O THR A 98 -8.993 -1.804 5.976 1.00 0.00 O ATOM 1515 CB THR A 98 -11.078 -1.022 3.377 1.00 0.00 C ATOM 1516 OG1 THR A 98 -11.184 -1.248 1.974 1.00 0.00 O ATOM 1517 CG2 THR A 98 -10.528 0.401 3.485 1.00 0.00 C ATOM 0 H THR A 98 -11.065 -3.279 2.450 1.00 0.00 H new ATOM 0 HA THR A 98 -9.080 -1.765 3.525 1.00 0.00 H new ATOM 0 HB THR A 98 -11.992 -1.103 3.965 1.00 0.00 H new ATOM 0 HG1 THR A 98 -11.818 -0.609 1.587 1.00 0.00 H new ATOM 0 HG21 THR A 98 -11.280 1.109 3.138 1.00 0.00 H new ATOM 0 HG22 THR A 98 -10.279 0.617 4.524 1.00 0.00 H new ATOM 0 HG23 THR A 98 -9.632 0.493 2.870 1.00 0.00 H new ATOM 1525 N VAL A 99 -11.051 -2.742 5.948 1.00 0.00 N ATOM 1526 CA VAL A 99 -11.111 -2.920 7.389 1.00 0.00 C ATOM 1527 C VAL A 99 -9.890 -3.719 7.851 1.00 0.00 C ATOM 1528 O VAL A 99 -9.167 -3.290 8.749 1.00 0.00 O ATOM 1529 CB VAL A 99 -12.437 -3.575 7.781 1.00 0.00 C ATOM 1530 CG1 VAL A 99 -12.463 -5.049 7.372 1.00 0.00 C ATOM 1531 CG2 VAL A 99 -12.705 -3.416 9.279 1.00 0.00 C ATOM 0 H VAL A 99 -11.876 -3.066 5.444 1.00 0.00 H new ATOM 0 HA VAL A 99 -11.079 -1.955 7.895 1.00 0.00 H new ATOM 0 HB VAL A 99 -13.235 -3.064 7.242 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -13.416 -5.490 7.662 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -12.340 -5.129 6.292 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -11.651 -5.579 7.870 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -13.653 -3.890 9.531 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -11.902 -3.888 9.844 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -12.751 -2.356 9.530 1.00 0.00 H new ATOM 1541 N ASP A 100 -9.699 -4.866 7.217 1.00 0.00 N ATOM 1542 CA ASP A 100 -8.579 -5.729 7.551 1.00 0.00 C ATOM 1543 C ASP A 100 -7.343 -4.869 7.825 1.00 0.00 C ATOM 1544 O ASP A 100 -6.488 -5.242 8.627 1.00 0.00 O ATOM 1545 CB ASP A 100 -8.249 -6.677 6.396 1.00 0.00 C ATOM 1546 CG ASP A 100 -9.406 -7.570 5.943 1.00 0.00 C ATOM 1547 OD1 ASP A 100 -10.474 -7.485 6.586 1.00 0.00 O ATOM 1548 OD2 ASP A 100 -9.195 -8.318 4.964 1.00 0.00 O ATOM 0 H ASP A 100 -10.301 -5.218 6.473 1.00 0.00 H new ATOM 0 HA ASP A 100 -8.854 -6.314 8.429 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -7.912 -6.085 5.545 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -7.415 -7.312 6.694 1.00 0.00 H new ATOM 1553 N LEU A 101 -7.288 -3.735 7.142 1.00 0.00 N ATOM 1554 CA LEU A 101 -6.170 -2.819 7.301 1.00 0.00 C ATOM 1555 C LEU A 101 -6.576 -1.687 8.247 1.00 0.00 C ATOM 1556 O LEU A 101 -5.987 -1.524 9.315 1.00 0.00 O ATOM 1557 CB LEU A 101 -5.676 -2.334 5.937 1.00 0.00 C ATOM 1558 CG LEU A 101 -4.665 -1.187 5.959 1.00 0.00 C ATOM 1559 CD1 LEU A 101 -3.482 -1.516 6.872 1.00 0.00 C ATOM 1560 CD2 LEU A 101 -4.213 -0.827 4.542 1.00 0.00 C ATOM 0 H LEU A 101 -7.999 -3.429 6.477 1.00 0.00 H new ATOM 0 HA LEU A 101 -5.321 -3.328 7.758 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -5.226 -3.178 5.414 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.540 -2.020 5.351 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.156 -0.307 6.374 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -2.778 -0.684 6.869 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -3.842 -1.684 7.887 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -2.982 -2.415 6.511 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.494 -0.009 4.586 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.746 -1.695 4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.076 -0.520 3.952 1.00 0.00 H new ATOM 1572 N TYR A 102 -7.578 -0.933 7.820 1.00 0.00 N ATOM 1573 CA TYR A 102 -8.069 0.180 8.615 1.00 0.00 C ATOM 1574 C TYR A 102 -8.226 -0.222 10.083 1.00 0.00 C ATOM 1575 O TYR A 102 -7.670 0.423 10.970 1.00 0.00 O ATOM 1576 CB TYR A 102 -9.444 0.532 8.045 1.00 0.00 C ATOM 1577 CG TYR A 102 -9.924 1.940 8.400 1.00 0.00 C ATOM 1578 CD1 TYR A 102 -9.139 3.034 8.096 1.00 0.00 C ATOM 1579 CD2 TYR A 102 -11.142 2.117 9.025 1.00 0.00 C ATOM 1580 CE1 TYR A 102 -9.590 4.360 8.431 1.00 0.00 C ATOM 1581 CE2 TYR A 102 -11.593 3.443 9.360 1.00 0.00 C ATOM 1582 CZ TYR A 102 -10.795 4.499 9.046 1.00 0.00 C ATOM 1583 OH TYR A 102 -11.221 5.751 9.363 1.00 0.00 O ATOM 0 H TYR A 102 -8.063 -1.071 6.934 1.00 0.00 H new ATOM 0 HA TYR A 102 -7.373 1.018 8.573 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -9.412 0.433 6.960 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -10.173 -0.192 8.410 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -8.186 2.895 7.607 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -11.757 1.261 9.263 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -8.985 5.224 8.199 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -12.543 3.596 9.850 1.00 0.00 H new ATOM 0 HH TYR A 102 -10.858 6.393 8.718 1.00 0.00 H new ATOM 1593 N GLU A 103 -8.986 -1.286 10.293 1.00 0.00 N ATOM 1594 CA GLU A 103 -9.223 -1.782 11.638 1.00 0.00 C ATOM 1595 C GLU A 103 -8.317 -2.980 11.930 1.00 0.00 C ATOM 1596 O GLU A 103 -8.618 -3.793 12.803 1.00 0.00 O ATOM 1597 CB GLU A 103 -10.696 -2.148 11.836 1.00 0.00 C ATOM 1598 CG GLU A 103 -11.605 -0.964 11.501 1.00 0.00 C ATOM 1599 CD GLU A 103 -11.598 0.069 12.630 1.00 0.00 C ATOM 1600 OE1 GLU A 103 -11.745 -0.362 13.794 1.00 0.00 O ATOM 1601 OE2 GLU A 103 -11.447 1.266 12.304 1.00 0.00 O ATOM 0 H GLU A 103 -9.446 -1.819 9.555 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.981 -0.988 12.344 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.952 -2.998 11.203 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -10.862 -2.458 12.868 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -11.273 -0.497 10.574 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -12.622 -1.318 11.333 1.00 0.00 H new ATOM 1608 N GLY A 104 -7.225 -3.051 11.184 1.00 0.00 N ATOM 1609 CA GLY A 104 -6.273 -4.135 11.351 1.00 0.00 C ATOM 1610 C GLY A 104 -6.990 -5.454 11.647 1.00 0.00 C ATOM 1611 O GLY A 104 -6.495 -6.275 12.417 1.00 0.00 O ATOM 0 H GLY A 104 -6.978 -2.375 10.462 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.672 -4.238 10.447 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.587 -3.899 12.165 1.00 0.00 H new ATOM 1615 N LYS A 105 -8.145 -5.616 11.018 1.00 0.00 N ATOM 1616 CA LYS A 105 -8.935 -6.821 11.204 1.00 0.00 C ATOM 1617 C LYS A 105 -8.148 -8.027 10.689 1.00 0.00 C ATOM 1618 O LYS A 105 -8.327 -9.143 11.174 1.00 0.00 O ATOM 1619 CB LYS A 105 -10.313 -6.664 10.556 1.00 0.00 C ATOM 1620 CG LYS A 105 -11.383 -6.367 11.608 1.00 0.00 C ATOM 1621 CD LYS A 105 -12.711 -7.032 11.241 1.00 0.00 C ATOM 1622 CE LYS A 105 -13.824 -5.991 11.099 1.00 0.00 C ATOM 1623 NZ LYS A 105 -15.063 -6.465 11.755 1.00 0.00 N ATOM 0 H LYS A 105 -8.552 -4.933 10.379 1.00 0.00 H new ATOM 0 HA LYS A 105 -9.124 -6.992 12.264 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -10.284 -5.857 9.823 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -10.571 -7.575 10.017 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -11.050 -6.725 12.582 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -11.523 -5.290 11.695 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -12.601 -7.582 10.306 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -12.983 -7.758 12.007 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -13.507 -5.048 11.545 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -14.016 -5.796 10.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -15.808 -5.747 11.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.373 -7.353 11.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -14.880 -6.628 12.766 1.00 0.00 H new ATOM 1637 N ASP A 106 -7.292 -7.762 9.712 1.00 0.00 N ATOM 1638 CA ASP A 106 -6.476 -8.811 9.126 1.00 0.00 C ATOM 1639 C ASP A 106 -5.254 -8.185 8.452 1.00 0.00 C ATOM 1640 O ASP A 106 -5.348 -7.678 7.335 1.00 0.00 O ATOM 1641 CB ASP A 106 -7.257 -9.587 8.063 1.00 0.00 C ATOM 1642 CG ASP A 106 -7.369 -11.092 8.312 1.00 0.00 C ATOM 1643 OD1 ASP A 106 -6.393 -11.797 7.978 1.00 0.00 O ATOM 1644 OD2 ASP A 106 -8.429 -11.504 8.831 1.00 0.00 O ATOM 0 H ASP A 106 -7.146 -6.835 9.312 1.00 0.00 H new ATOM 0 HA ASP A 106 -6.178 -9.492 9.924 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -8.262 -9.170 7.995 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -6.780 -9.429 7.096 1.00 0.00 H new ATOM 1649 N MET A 107 -4.135 -8.241 9.159 1.00 0.00 N ATOM 1650 CA MET A 107 -2.895 -7.685 8.643 1.00 0.00 C ATOM 1651 C MET A 107 -2.159 -8.704 7.771 1.00 0.00 C ATOM 1652 O MET A 107 -1.606 -8.351 6.730 1.00 0.00 O ATOM 1653 CB MET A 107 -1.998 -7.268 9.810 1.00 0.00 C ATOM 1654 CG MET A 107 -0.521 -7.334 9.416 1.00 0.00 C ATOM 1655 SD MET A 107 0.351 -5.924 10.079 1.00 0.00 S ATOM 1656 CE MET A 107 -0.701 -4.606 9.493 1.00 0.00 C ATOM 0 H MET A 107 -4.061 -8.663 10.085 1.00 0.00 H new ATOM 0 HA MET A 107 -3.135 -6.816 8.030 1.00 0.00 H new ATOM 0 HB2 MET A 107 -2.250 -6.255 10.123 1.00 0.00 H new ATOM 0 HB3 MET A 107 -2.180 -7.920 10.664 1.00 0.00 H new ATOM 0 HG2 MET A 107 -0.077 -8.256 9.791 1.00 0.00 H new ATOM 0 HG3 MET A 107 -0.426 -7.353 8.330 1.00 0.00 H new ATOM 0 HE1 MET A 107 -0.104 -3.709 9.330 1.00 0.00 H new ATOM 0 HE2 MET A 107 -1.171 -4.905 8.556 1.00 0.00 H new ATOM 0 HE3 MET A 107 -1.472 -4.398 10.235 1.00 0.00 H new ATOM 1666 N ALA A 108 -2.176 -9.948 8.227 1.00 0.00 N ATOM 1667 CA ALA A 108 -1.516 -11.020 7.502 1.00 0.00 C ATOM 1668 C ALA A 108 -1.865 -10.914 6.016 1.00 0.00 C ATOM 1669 O ALA A 108 -1.074 -11.308 5.160 1.00 0.00 O ATOM 1670 CB ALA A 108 -1.923 -12.368 8.102 1.00 0.00 C ATOM 0 H ALA A 108 -2.637 -10.237 9.090 1.00 0.00 H new ATOM 0 HA ALA A 108 -0.433 -10.936 7.593 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -1.428 -13.173 7.558 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -1.628 -12.403 9.151 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.003 -12.489 8.025 1.00 0.00 H new ATOM 1676 N ALA A 109 -3.049 -10.380 5.755 1.00 0.00 N ATOM 1677 CA ALA A 109 -3.511 -10.218 4.387 1.00 0.00 C ATOM 1678 C ALA A 109 -2.823 -9.003 3.762 1.00 0.00 C ATOM 1679 O ALA A 109 -2.265 -9.096 2.669 1.00 0.00 O ATOM 1680 CB ALA A 109 -5.036 -10.094 4.375 1.00 0.00 C ATOM 0 H ALA A 109 -3.702 -10.054 6.467 1.00 0.00 H new ATOM 0 HA ALA A 109 -3.250 -11.090 3.787 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -5.383 -9.972 3.349 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -5.478 -10.994 4.803 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -5.335 -9.227 4.964 1.00 0.00 H new ATOM 1686 N VAL A 110 -2.884 -7.892 4.481 1.00 0.00 N ATOM 1687 CA VAL A 110 -2.273 -6.661 4.011 1.00 0.00 C ATOM 1688 C VAL A 110 -0.918 -6.980 3.374 1.00 0.00 C ATOM 1689 O VAL A 110 -0.473 -6.276 2.469 1.00 0.00 O ATOM 1690 CB VAL A 110 -2.172 -5.655 5.159 1.00 0.00 C ATOM 1691 CG1 VAL A 110 -1.337 -4.439 4.750 1.00 0.00 C ATOM 1692 CG2 VAL A 110 -3.561 -5.230 5.638 1.00 0.00 C ATOM 0 H VAL A 110 -3.348 -7.819 5.387 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.892 -6.196 3.243 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.666 -6.145 5.991 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.281 -3.739 5.584 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.332 -4.762 4.479 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.803 -3.948 3.895 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -3.461 -4.515 6.454 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -4.104 -4.767 4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.109 -6.105 5.987 1.00 0.00 H new ATOM 1702 N GLN A 111 -0.301 -8.041 3.873 1.00 0.00 N ATOM 1703 CA GLN A 111 0.994 -8.461 3.365 1.00 0.00 C ATOM 1704 C GLN A 111 0.830 -9.173 2.021 1.00 0.00 C ATOM 1705 O GLN A 111 1.459 -8.795 1.033 1.00 0.00 O ATOM 1706 CB GLN A 111 1.716 -9.355 4.375 1.00 0.00 C ATOM 1707 CG GLN A 111 2.119 -8.561 5.619 1.00 0.00 C ATOM 1708 CD GLN A 111 2.450 -9.498 6.783 1.00 0.00 C ATOM 1709 OE1 GLN A 111 1.877 -10.563 6.939 1.00 0.00 O ATOM 1710 NE2 GLN A 111 3.404 -9.042 7.590 1.00 0.00 N ATOM 0 H GLN A 111 -0.674 -8.622 4.624 1.00 0.00 H new ATOM 0 HA GLN A 111 1.608 -7.574 3.212 1.00 0.00 H new ATOM 0 HB2 GLN A 111 1.068 -10.183 4.662 1.00 0.00 H new ATOM 0 HB3 GLN A 111 2.603 -9.789 3.913 1.00 0.00 H new ATOM 0 HG2 GLN A 111 2.983 -7.937 5.392 1.00 0.00 H new ATOM 0 HG3 GLN A 111 1.309 -7.891 5.906 1.00 0.00 H new ATOM 0 HE21 GLN A 111 3.843 -8.141 7.402 1.00 0.00 H new ATOM 0 HE22 GLN A 111 3.696 -9.593 8.397 1.00 0.00 H new ATOM 1719 N ARG A 112 -0.017 -10.192 2.026 1.00 0.00 N ATOM 1720 CA ARG A 112 -0.270 -10.961 0.819 1.00 0.00 C ATOM 1721 C ARG A 112 -0.403 -10.028 -0.386 1.00 0.00 C ATOM 1722 O ARG A 112 0.047 -10.357 -1.483 1.00 0.00 O ATOM 1723 CB ARG A 112 -1.547 -11.792 0.955 1.00 0.00 C ATOM 1724 CG ARG A 112 -1.388 -13.156 0.278 1.00 0.00 C ATOM 1725 CD ARG A 112 -2.138 -14.242 1.052 1.00 0.00 C ATOM 1726 NE ARG A 112 -1.199 -14.982 1.924 1.00 0.00 N ATOM 1727 CZ ARG A 112 -1.568 -15.664 3.017 1.00 0.00 C ATOM 1728 NH1 ARG A 112 -2.857 -15.704 3.378 1.00 0.00 N ATOM 1729 NH2 ARG A 112 -0.647 -16.306 3.749 1.00 0.00 N ATOM 0 H ARG A 112 -0.537 -10.503 2.847 1.00 0.00 H new ATOM 0 HA ARG A 112 0.575 -11.634 0.670 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -1.784 -11.931 2.010 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.384 -11.255 0.508 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -1.766 -13.106 -0.743 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -0.331 -13.414 0.215 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.928 -13.792 1.653 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -2.620 -14.929 0.356 1.00 0.00 H new ATOM 0 HE ARG A 112 -0.209 -14.972 1.678 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -3.558 -15.215 2.821 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -3.138 -16.223 4.210 1.00 0.00 H new ATOM 0 HH21 ARG A 112 0.335 -16.275 3.474 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.928 -16.825 4.581 1.00 0.00 H new ATOM 1743 N THR A 113 -1.021 -8.882 -0.142 1.00 0.00 N ATOM 1744 CA THR A 113 -1.218 -7.899 -1.194 1.00 0.00 C ATOM 1745 C THR A 113 0.129 -7.357 -1.677 1.00 0.00 C ATOM 1746 O THR A 113 0.514 -7.575 -2.824 1.00 0.00 O ATOM 1747 CB THR A 113 -2.153 -6.813 -0.658 1.00 0.00 C ATOM 1748 OG1 THR A 113 -3.391 -7.490 -0.456 1.00 0.00 O ATOM 1749 CG2 THR A 113 -2.478 -5.749 -1.708 1.00 0.00 C ATOM 0 H THR A 113 -1.392 -8.612 0.769 1.00 0.00 H new ATOM 0 HA THR A 113 -1.686 -8.347 -2.071 1.00 0.00 H new ATOM 0 HB THR A 113 -1.697 -6.338 0.211 1.00 0.00 H new ATOM 0 HG1 THR A 113 -3.240 -8.458 -0.464 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.145 -5.003 -1.276 1.00 0.00 H new ATOM 0 HG22 THR A 113 -1.557 -5.267 -2.035 1.00 0.00 H new ATOM 0 HG23 THR A 113 -2.965 -6.218 -2.563 1.00 0.00 H new ATOM 1757 N LEU A 114 0.807 -6.662 -0.776 1.00 0.00 N ATOM 1758 CA LEU A 114 2.103 -6.087 -1.096 1.00 0.00 C ATOM 1759 C LEU A 114 2.993 -7.163 -1.721 1.00 0.00 C ATOM 1760 O LEU A 114 3.537 -6.969 -2.808 1.00 0.00 O ATOM 1761 CB LEU A 114 2.715 -5.425 0.140 1.00 0.00 C ATOM 1762 CG LEU A 114 1.946 -4.233 0.713 1.00 0.00 C ATOM 1763 CD1 LEU A 114 2.082 -4.172 2.235 1.00 0.00 C ATOM 1764 CD2 LEU A 114 2.382 -2.927 0.045 1.00 0.00 C ATOM 0 H LEU A 114 0.484 -6.484 0.175 1.00 0.00 H new ATOM 0 HA LEU A 114 1.996 -5.293 -1.835 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.812 -6.179 0.921 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.723 -5.095 -0.111 1.00 0.00 H new ATOM 0 HG LEU A 114 0.888 -4.371 0.491 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.526 -3.315 2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.684 -5.087 2.673 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.134 -4.070 2.503 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.820 -2.095 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.447 -2.770 0.214 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.190 -2.984 -1.026 1.00 0.00 H new ATOM 1776 N MET A 115 3.114 -8.273 -1.009 1.00 0.00 N ATOM 1777 CA MET A 115 3.929 -9.380 -1.481 1.00 0.00 C ATOM 1778 C MET A 115 3.707 -9.627 -2.974 1.00 0.00 C ATOM 1779 O MET A 115 4.590 -10.139 -3.660 1.00 0.00 O ATOM 1780 CB MET A 115 3.576 -10.645 -0.695 1.00 0.00 C ATOM 1781 CG MET A 115 4.357 -10.710 0.619 1.00 0.00 C ATOM 1782 SD MET A 115 5.325 -12.208 0.680 1.00 0.00 S ATOM 1783 CE MET A 115 6.881 -11.549 1.255 1.00 0.00 C ATOM 0 H MET A 115 2.661 -8.430 -0.109 1.00 0.00 H new ATOM 0 HA MET A 115 4.978 -9.127 -1.327 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.506 -10.662 -0.487 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.798 -11.526 -1.298 1.00 0.00 H new ATOM 0 HG2 MET A 115 5.010 -9.842 0.707 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.668 -10.678 1.463 1.00 0.00 H new ATOM 0 HE1 MET A 115 7.700 -12.040 0.730 1.00 0.00 H new ATOM 0 HE2 MET A 115 6.916 -10.477 1.061 1.00 0.00 H new ATOM 0 HE3 MET A 115 6.978 -11.727 2.326 1.00 0.00 H new ATOM 1793 N ALA A 116 2.522 -9.251 -3.433 1.00 0.00 N ATOM 1794 CA ALA A 116 2.172 -9.426 -4.833 1.00 0.00 C ATOM 1795 C ALA A 116 2.510 -8.147 -5.601 1.00 0.00 C ATOM 1796 O ALA A 116 3.278 -8.180 -6.562 1.00 0.00 O ATOM 1797 CB ALA A 116 0.693 -9.801 -4.947 1.00 0.00 C ATOM 0 H ALA A 116 1.792 -8.826 -2.861 1.00 0.00 H new ATOM 0 HA ALA A 116 2.749 -10.239 -5.275 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.431 -9.932 -5.997 1.00 0.00 H new ATOM 0 HB2 ALA A 116 0.511 -10.731 -4.409 1.00 0.00 H new ATOM 0 HB3 ALA A 116 0.082 -9.007 -4.517 1.00 0.00 H new ATOM 1803 N LEU A 117 1.919 -7.050 -5.150 1.00 0.00 N ATOM 1804 CA LEU A 117 2.147 -5.762 -5.784 1.00 0.00 C ATOM 1805 C LEU A 117 3.634 -5.617 -6.113 1.00 0.00 C ATOM 1806 O LEU A 117 4.007 -5.497 -7.280 1.00 0.00 O ATOM 1807 CB LEU A 117 1.598 -4.631 -4.912 1.00 0.00 C ATOM 1808 CG LEU A 117 1.424 -3.277 -5.602 1.00 0.00 C ATOM 1809 CD1 LEU A 117 0.315 -3.336 -6.655 1.00 0.00 C ATOM 1810 CD2 LEU A 117 1.181 -2.167 -4.577 1.00 0.00 C ATOM 0 H LEU A 117 1.283 -7.026 -4.353 1.00 0.00 H new ATOM 0 HA LEU A 117 1.603 -5.700 -6.727 1.00 0.00 H new ATOM 0 HB2 LEU A 117 0.631 -4.941 -4.515 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.265 -4.499 -4.060 1.00 0.00 H new ATOM 0 HG LEU A 117 2.351 -3.038 -6.123 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.212 -2.360 -7.130 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.568 -4.082 -7.409 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.626 -3.608 -6.177 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.061 -1.215 -5.094 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.278 -2.388 -4.008 1.00 0.00 H new ATOM 0 HD23 LEU A 117 2.031 -2.106 -3.898 1.00 0.00 H new ATOM 1822 N GLY A 118 4.444 -5.634 -5.065 1.00 0.00 N ATOM 1823 CA GLY A 118 5.883 -5.506 -5.228 1.00 0.00 C ATOM 1824 C GLY A 118 6.384 -6.384 -6.377 1.00 0.00 C ATOM 1825 O GLY A 118 6.877 -5.875 -7.382 1.00 0.00 O ATOM 0 H GLY A 118 4.132 -5.734 -4.099 1.00 0.00 H new ATOM 0 HA2 GLY A 118 6.140 -4.465 -5.423 1.00 0.00 H new ATOM 0 HA3 GLY A 118 6.384 -5.790 -4.303 1.00 0.00 H new ATOM 1829 N SER A 119 6.241 -7.687 -6.189 1.00 0.00 N ATOM 1830 CA SER A 119 6.673 -8.641 -7.196 1.00 0.00 C ATOM 1831 C SER A 119 6.193 -8.195 -8.579 1.00 0.00 C ATOM 1832 O SER A 119 6.931 -8.293 -9.558 1.00 0.00 O ATOM 1833 CB SER A 119 6.156 -10.046 -6.882 1.00 0.00 C ATOM 1834 OG SER A 119 7.218 -10.987 -6.744 1.00 0.00 O ATOM 0 H SER A 119 5.832 -8.105 -5.354 1.00 0.00 H new ATOM 0 HA SER A 119 7.762 -8.675 -7.190 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.572 -10.020 -5.962 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.484 -10.371 -7.676 1.00 0.00 H new ATOM 0 HG SER A 119 6.847 -11.871 -6.542 1.00 0.00 H new ATOM 1840 N LEU A 120 4.959 -7.715 -8.615 1.00 0.00 N ATOM 1841 CA LEU A 120 4.371 -7.254 -9.861 1.00 0.00 C ATOM 1842 C LEU A 120 5.187 -6.076 -10.400 1.00 0.00 C ATOM 1843 O LEU A 120 5.550 -6.054 -11.575 1.00 0.00 O ATOM 1844 CB LEU A 120 2.887 -6.936 -9.669 1.00 0.00 C ATOM 1845 CG LEU A 120 1.907 -8.036 -10.082 1.00 0.00 C ATOM 1846 CD1 LEU A 120 0.540 -7.826 -9.427 1.00 0.00 C ATOM 1847 CD2 LEU A 120 1.804 -8.135 -11.605 1.00 0.00 C ATOM 0 H LEU A 120 4.350 -7.635 -7.801 1.00 0.00 H new ATOM 0 HA LEU A 120 4.410 -8.041 -10.614 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.719 -6.703 -8.618 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.652 -6.036 -10.237 1.00 0.00 H new ATOM 0 HG LEU A 120 2.293 -8.990 -9.723 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.138 -8.621 -9.737 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.649 -7.844 -8.343 1.00 0.00 H new ATOM 0 HD13 LEU A 120 0.133 -6.862 -9.734 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.101 -8.924 -11.872 1.00 0.00 H new ATOM 0 HD22 LEU A 120 1.453 -7.185 -12.008 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.784 -8.366 -12.022 1.00 0.00 H new ATOM 1859 N ALA A 121 5.451 -5.126 -9.515 1.00 0.00 N ATOM 1860 CA ALA A 121 6.217 -3.949 -9.886 1.00 0.00 C ATOM 1861 C ALA A 121 7.628 -4.373 -10.299 1.00 0.00 C ATOM 1862 O ALA A 121 8.217 -3.785 -11.204 1.00 0.00 O ATOM 1863 CB ALA A 121 6.223 -2.956 -8.723 1.00 0.00 C ATOM 0 H ALA A 121 5.148 -5.148 -8.541 1.00 0.00 H new ATOM 0 HA ALA A 121 5.761 -3.448 -10.740 1.00 0.00 H new ATOM 0 HB1 ALA A 121 6.798 -2.073 -9.002 1.00 0.00 H new ATOM 0 HB2 ALA A 121 5.199 -2.664 -8.489 1.00 0.00 H new ATOM 0 HB3 ALA A 121 6.676 -3.423 -7.848 1.00 0.00 H new ATOM 1869 N VAL A 122 8.129 -5.391 -9.615 1.00 0.00 N ATOM 1870 CA VAL A 122 9.460 -5.901 -9.899 1.00 0.00 C ATOM 1871 C VAL A 122 9.448 -6.622 -11.248 1.00 0.00 C ATOM 1872 O VAL A 122 10.281 -6.348 -12.110 1.00 0.00 O ATOM 1873 CB VAL A 122 9.935 -6.792 -8.749 1.00 0.00 C ATOM 1874 CG1 VAL A 122 11.224 -7.527 -9.123 1.00 0.00 C ATOM 1875 CG2 VAL A 122 10.120 -5.979 -7.466 1.00 0.00 C ATOM 0 H VAL A 122 7.637 -5.877 -8.865 1.00 0.00 H new ATOM 0 HA VAL A 122 10.175 -5.082 -9.975 1.00 0.00 H new ATOM 0 HB VAL A 122 9.164 -7.540 -8.563 1.00 0.00 H new ATOM 0 HG11 VAL A 122 11.541 -8.153 -8.289 1.00 0.00 H new ATOM 0 HG12 VAL A 122 11.046 -8.151 -9.999 1.00 0.00 H new ATOM 0 HG13 VAL A 122 12.005 -6.801 -9.348 1.00 0.00 H new ATOM 0 HG21 VAL A 122 10.458 -6.636 -6.665 1.00 0.00 H new ATOM 0 HG22 VAL A 122 10.863 -5.199 -7.633 1.00 0.00 H new ATOM 0 HG23 VAL A 122 9.171 -5.522 -7.185 1.00 0.00 H new ATOM 1885 N THR A 123 8.494 -7.531 -11.389 1.00 0.00 N ATOM 1886 CA THR A 123 8.362 -8.294 -12.618 1.00 0.00 C ATOM 1887 C THR A 123 8.480 -7.371 -13.833 1.00 0.00 C ATOM 1888 O THR A 123 9.253 -7.643 -14.751 1.00 0.00 O ATOM 1889 CB THR A 123 7.038 -9.058 -12.562 1.00 0.00 C ATOM 1890 OG1 THR A 123 7.274 -10.093 -11.611 1.00 0.00 O ATOM 1891 CG2 THR A 123 6.738 -9.808 -13.861 1.00 0.00 C ATOM 0 H THR A 123 7.805 -7.756 -10.672 1.00 0.00 H new ATOM 0 HA THR A 123 9.168 -9.021 -12.721 1.00 0.00 H new ATOM 0 HB THR A 123 6.227 -8.361 -12.350 1.00 0.00 H new ATOM 0 HG1 THR A 123 7.214 -9.724 -10.705 1.00 0.00 H new ATOM 0 HG21 THR A 123 5.787 -10.333 -13.767 1.00 0.00 H new ATOM 0 HG22 THR A 123 6.680 -9.098 -14.686 1.00 0.00 H new ATOM 0 HG23 THR A 123 7.532 -10.528 -14.057 1.00 0.00 H new ATOM 2020 N ASP A 132 15.488 -2.094 -4.674 1.00 0.00 N ATOM 2021 CA ASP A 132 16.042 -3.276 -5.313 1.00 0.00 C ATOM 2022 C ASP A 132 14.917 -4.275 -5.590 1.00 0.00 C ATOM 2023 O ASP A 132 13.979 -4.393 -4.804 1.00 0.00 O ATOM 2024 CB ASP A 132 17.070 -3.960 -4.409 1.00 0.00 C ATOM 2025 CG ASP A 132 18.531 -3.699 -4.779 1.00 0.00 C ATOM 2026 OD1 ASP A 132 18.765 -2.711 -5.508 1.00 0.00 O ATOM 2027 OD2 ASP A 132 19.383 -4.493 -4.323 1.00 0.00 O ATOM 0 HA ASP A 132 16.526 -2.964 -6.238 1.00 0.00 H new ATOM 0 HB2 ASP A 132 16.906 -3.630 -3.383 1.00 0.00 H new ATOM 0 HB3 ASP A 132 16.892 -5.035 -4.430 1.00 0.00 H new ATOM 2032 N PRO A 133 15.052 -4.988 -6.741 1.00 0.00 N ATOM 2033 CA PRO A 133 14.058 -5.973 -7.132 1.00 0.00 C ATOM 2034 C PRO A 133 14.185 -7.244 -6.289 1.00 0.00 C ATOM 2035 O PRO A 133 13.181 -7.845 -5.911 1.00 0.00 O ATOM 2036 CB PRO A 133 14.305 -6.215 -8.612 1.00 0.00 C ATOM 2037 CG PRO A 133 15.712 -5.712 -8.887 1.00 0.00 C ATOM 2038 CD PRO A 133 16.150 -4.875 -7.696 1.00 0.00 C ATOM 0 HA PRO A 133 13.037 -5.631 -6.963 1.00 0.00 H new ATOM 0 HB2 PRO A 133 14.214 -7.274 -8.855 1.00 0.00 H new ATOM 0 HB3 PRO A 133 13.574 -5.684 -9.222 1.00 0.00 H new ATOM 0 HG2 PRO A 133 16.394 -6.549 -9.037 1.00 0.00 H new ATOM 0 HG3 PRO A 133 15.733 -5.117 -9.800 1.00 0.00 H new ATOM 0 HD2 PRO A 133 17.083 -5.246 -7.273 1.00 0.00 H new ATOM 0 HD3 PRO A 133 16.321 -3.837 -7.982 1.00 0.00 H new ATOM 2046 N ASN A 134 15.428 -7.615 -6.019 1.00 0.00 N ATOM 2047 CA ASN A 134 15.699 -8.803 -5.228 1.00 0.00 C ATOM 2048 C ASN A 134 14.765 -8.829 -4.017 1.00 0.00 C ATOM 2049 O ASN A 134 14.443 -9.897 -3.499 1.00 0.00 O ATOM 2050 CB ASN A 134 17.140 -8.806 -4.714 1.00 0.00 C ATOM 2051 CG ASN A 134 18.120 -8.426 -5.826 1.00 0.00 C ATOM 2052 OD1 ASN A 134 18.514 -7.282 -5.977 1.00 0.00 O ATOM 2053 ND2 ASN A 134 18.489 -9.447 -6.594 1.00 0.00 N ATOM 0 H ASN A 134 16.259 -7.114 -6.334 1.00 0.00 H new ATOM 0 HA ASN A 134 15.541 -9.674 -5.864 1.00 0.00 H new ATOM 0 HB2 ASN A 134 17.236 -8.105 -3.885 1.00 0.00 H new ATOM 0 HB3 ASN A 134 17.390 -9.794 -4.326 1.00 0.00 H new ATOM 0 HD21 ASN A 134 19.140 -9.296 -7.365 1.00 0.00 H new ATOM 0 HD22 ASN A 134 18.121 -10.381 -6.412 1.00 0.00 H new ATOM 2060 N TRP A 135 14.355 -7.639 -3.601 1.00 0.00 N ATOM 2061 CA TRP A 135 13.464 -7.512 -2.461 1.00 0.00 C ATOM 2062 C TRP A 135 12.290 -8.472 -2.667 1.00 0.00 C ATOM 2063 O TRP A 135 11.981 -9.278 -1.791 1.00 0.00 O ATOM 2064 CB TRP A 135 13.021 -6.059 -2.270 1.00 0.00 C ATOM 2065 CG TRP A 135 14.101 -5.153 -1.675 1.00 0.00 C ATOM 2066 CD1 TRP A 135 15.260 -5.514 -1.108 1.00 0.00 C ATOM 2067 CD2 TRP A 135 14.074 -3.712 -1.611 1.00 0.00 C ATOM 2068 NE1 TRP A 135 15.980 -4.414 -0.685 1.00 0.00 N ATOM 2069 CE2 TRP A 135 15.235 -3.284 -1.001 1.00 0.00 C ATOM 2070 CE3 TRP A 135 13.100 -2.799 -2.055 1.00 0.00 C ATOM 2071 CZ2 TRP A 135 15.532 -1.934 -0.778 1.00 0.00 C ATOM 2072 CZ3 TRP A 135 13.412 -1.454 -1.825 1.00 0.00 C ATOM 2073 CH2 TRP A 135 14.576 -1.007 -1.212 1.00 0.00 C ATOM 0 H TRP A 135 14.624 -6.755 -4.033 1.00 0.00 H new ATOM 0 HA TRP A 135 13.978 -7.784 -1.539 1.00 0.00 H new ATOM 0 HB2 TRP A 135 12.712 -5.654 -3.234 1.00 0.00 H new ATOM 0 HB3 TRP A 135 12.146 -6.039 -1.621 1.00 0.00 H new ATOM 0 HD1 TRP A 135 15.590 -6.536 -0.996 1.00 0.00 H new ATOM 0 HE1 TRP A 135 16.891 -4.428 -0.225 1.00 0.00 H new ATOM 0 HE3 TRP A 135 12.184 -3.111 -2.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 16.448 -1.624 -0.298 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 12.697 -0.711 -2.147 1.00 0.00 H new ATOM 0 HH2 TRP A 135 14.743 0.051 -1.071 1.00 0.00 H new