USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 890 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 99 GLN : amide:sc= -2.4 X(o=-2.7,f=-2.2) USER MOD Set 1.2: A 102 TYR OH : rot 141:sc= -0.277 USER MOD Set 2.1: A 35 LYS NZ :NH3+ -160:sc= -0.166 (180deg=-0.598) USER MOD Set 2.2: A 75 MET CE :methyl -130:sc= -0.804 (180deg=-3.27!) USER MOD Set 3.1: A 69 SER OG : rot 60:sc= 0.73 USER MOD Set 3.2: A 73 GLN : amide:sc= 0.836 K(o=1.6,f=0.28) USER MOD Set 4.1: A 30 SER OG : rot 150:sc= 0.0193 USER MOD Set 4.2: A 33 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 39:sc= 0.0526 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.0169 K(o=-0.017,f=-1.3) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.0449 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -158:sc= -0.0368 (180deg=-0.317) USER MOD Single : A 31 GLN : amide:sc= -1.37! C(o=-1.4!,f=-1.6!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HD1:sc= -4.6! C(o=-4.6!,f=-8.8!) USER MOD Single : A 50 HIS : no HD1:sc= -0.182 X(o=-0.18,f=-0.011) USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 52 TYR OH : rot -114:sc= -1.74 USER MOD Single : A 53 GLN : amide:sc= -0.332 K(o=-0.33,f=-3.9!) USER MOD Single : A 57 LYS NZ :NH3+ 173:sc= 1.74 (180deg=1.65) USER MOD Single : A 61 SER OG : rot 180:sc= -0.366 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 74 THR OG1 : rot 137:sc= 0.923 USER MOD Single : A 79 ASN : amide:sc= -2.54! K(o=-2.5!,f=-1.2) USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 84 ASN : amide:sc= -1.37 K(o=-1.4,f=-3!) USER MOD Single : A 85 THR OG1 : rot 62:sc= 0.376 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 18:sc= 0.172 USER MOD Single : A 95 ASN : amide:sc= -10.8! C(o=-11!,f=-20!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot -55:sc= 0.611 USER MOD Single : A 104 LYS NZ :NH3+ 164:sc= 0.398 (180deg=0.0693) USER MOD Single : A 109 GLN : amide:sc= -0.0071 K(o=-0.0071,f=-0.79) USER MOD Single : A 110 THR OG1 : rot -159:sc= 0.896 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 34:sc= 0.908 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.955 -37.570 3.790 1.00 0.00 N ATOM 2 CA GLY A 1 -18.886 -37.306 2.845 1.00 0.00 C ATOM 3 C GLY A 1 -19.405 -36.827 1.503 1.00 0.00 C ATOM 4 O GLY A 1 -19.555 -37.616 0.570 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.550 -37.895 4.691 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.500 -36.699 3.949 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.582 -38.306 3.408 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.215 -36.555 3.261 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.299 -38.213 2.702 1.00 0.00 H new ATOM 8 N SER A 2 -19.679 -35.531 1.405 1.00 0.00 N ATOM 9 CA SER A 2 -20.189 -34.948 0.168 1.00 0.00 C ATOM 10 C SER A 2 -19.269 -33.837 -0.328 1.00 0.00 C ATOM 11 O SER A 2 -18.877 -32.954 0.434 1.00 0.00 O ATOM 12 CB SER A 2 -21.601 -34.400 0.382 1.00 0.00 C ATOM 13 OG SER A 2 -22.551 -35.449 0.449 1.00 0.00 O ATOM 0 H SER A 2 -19.557 -34.864 2.167 1.00 0.00 H new ATOM 0 HA SER A 2 -20.223 -35.732 -0.588 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.633 -33.817 1.303 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.859 -33.723 -0.433 1.00 0.00 H new ATOM 0 HG SER A 2 -23.445 -35.072 0.588 1.00 0.00 H new ATOM 19 N SER A 3 -18.930 -33.888 -1.612 1.00 0.00 N ATOM 20 CA SER A 3 -18.053 -32.889 -2.211 1.00 0.00 C ATOM 21 C SER A 3 -18.856 -31.887 -3.037 1.00 0.00 C ATOM 22 O SER A 3 -19.663 -32.268 -3.883 1.00 0.00 O ATOM 23 CB SER A 3 -17.001 -33.565 -3.092 1.00 0.00 C ATOM 24 OG SER A 3 -17.604 -34.450 -4.020 1.00 0.00 O ATOM 0 H SER A 3 -19.249 -34.610 -2.257 1.00 0.00 H new ATOM 0 HA SER A 3 -17.552 -32.352 -1.406 1.00 0.00 H new ATOM 0 HB2 SER A 3 -16.429 -32.807 -3.627 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.297 -34.114 -2.467 1.00 0.00 H new ATOM 0 HG SER A 3 -18.435 -34.055 -4.357 1.00 0.00 H new ATOM 30 N GLY A 4 -18.626 -30.603 -2.784 1.00 0.00 N ATOM 31 CA GLY A 4 -19.335 -29.565 -3.510 1.00 0.00 C ATOM 32 C GLY A 4 -20.807 -29.509 -3.152 1.00 0.00 C ATOM 33 O GLY A 4 -21.651 -30.023 -3.886 1.00 0.00 O ATOM 0 H GLY A 4 -17.961 -30.262 -2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.876 -28.599 -3.298 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.231 -29.739 -4.581 1.00 0.00 H new ATOM 37 N SER A 5 -21.116 -28.883 -2.021 1.00 0.00 N ATOM 38 CA SER A 5 -22.495 -28.767 -1.564 1.00 0.00 C ATOM 39 C SER A 5 -23.369 -28.120 -2.635 1.00 0.00 C ATOM 40 O SER A 5 -24.352 -28.709 -3.088 1.00 0.00 O ATOM 41 CB SER A 5 -22.561 -27.947 -0.274 1.00 0.00 C ATOM 42 OG SER A 5 -23.900 -27.793 0.166 1.00 0.00 O ATOM 0 H SER A 5 -20.429 -28.448 -1.404 1.00 0.00 H new ATOM 0 HA SER A 5 -22.872 -29.771 -1.368 1.00 0.00 H new ATOM 0 HB2 SER A 5 -21.974 -28.437 0.503 1.00 0.00 H new ATOM 0 HB3 SER A 5 -22.114 -26.967 -0.440 1.00 0.00 H new ATOM 0 HG SER A 5 -23.914 -27.267 0.993 1.00 0.00 H new ATOM 48 N SER A 6 -23.004 -26.907 -3.036 1.00 0.00 N ATOM 49 CA SER A 6 -23.756 -26.179 -4.052 1.00 0.00 C ATOM 50 C SER A 6 -22.831 -25.676 -5.156 1.00 0.00 C ATOM 51 O SER A 6 -21.615 -25.610 -4.980 1.00 0.00 O ATOM 52 CB SER A 6 -24.499 -25.001 -3.418 1.00 0.00 C ATOM 53 OG SER A 6 -25.771 -25.401 -2.937 1.00 0.00 O ATOM 0 H SER A 6 -22.192 -26.407 -2.673 1.00 0.00 H new ATOM 0 HA SER A 6 -24.481 -26.863 -4.493 1.00 0.00 H new ATOM 0 HB2 SER A 6 -23.908 -24.593 -2.598 1.00 0.00 H new ATOM 0 HB3 SER A 6 -24.618 -24.204 -4.152 1.00 0.00 H new ATOM 0 HG SER A 6 -26.226 -24.631 -2.535 1.00 0.00 H new ATOM 59 N GLY A 7 -23.417 -25.323 -6.295 1.00 0.00 N ATOM 60 CA GLY A 7 -22.633 -24.831 -7.412 1.00 0.00 C ATOM 61 C GLY A 7 -22.375 -23.340 -7.328 1.00 0.00 C ATOM 62 O GLY A 7 -21.224 -22.905 -7.288 1.00 0.00 O ATOM 0 H GLY A 7 -24.422 -25.369 -6.464 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.681 -25.360 -7.444 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -23.153 -25.055 -8.343 1.00 0.00 H new ATOM 66 N GLN A 8 -23.447 -22.556 -7.301 1.00 0.00 N ATOM 67 CA GLN A 8 -23.331 -21.104 -7.223 1.00 0.00 C ATOM 68 C GLN A 8 -22.619 -20.684 -5.941 1.00 0.00 C ATOM 69 O GLN A 8 -22.230 -19.526 -5.787 1.00 0.00 O ATOM 70 CB GLN A 8 -24.714 -20.456 -7.287 1.00 0.00 C ATOM 71 CG GLN A 8 -24.672 -18.957 -7.536 1.00 0.00 C ATOM 72 CD GLN A 8 -25.985 -18.274 -7.204 1.00 0.00 C ATOM 73 OE1 GLN A 8 -26.951 -18.922 -6.800 1.00 0.00 O ATOM 74 NE2 GLN A 8 -26.026 -16.957 -7.373 1.00 0.00 N ATOM 0 H GLN A 8 -24.406 -22.901 -7.332 1.00 0.00 H new ATOM 0 HA GLN A 8 -22.740 -20.766 -8.074 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -25.293 -20.931 -8.079 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -25.239 -20.646 -6.351 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -23.875 -18.515 -6.938 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -24.425 -18.773 -8.582 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -25.201 -16.460 -7.710 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -26.882 -16.443 -7.166 1.00 0.00 H new ATOM 83 N GLU A 9 -22.451 -21.632 -5.025 1.00 0.00 N ATOM 84 CA GLU A 9 -21.786 -21.358 -3.756 1.00 0.00 C ATOM 85 C GLU A 9 -20.462 -22.110 -3.662 1.00 0.00 C ATOM 86 O GLU A 9 -19.959 -22.369 -2.569 1.00 0.00 O ATOM 87 CB GLU A 9 -22.692 -21.749 -2.586 1.00 0.00 C ATOM 88 CG GLU A 9 -23.599 -20.625 -2.116 1.00 0.00 C ATOM 89 CD GLU A 9 -24.764 -21.124 -1.283 1.00 0.00 C ATOM 90 OE1 GLU A 9 -25.234 -22.252 -1.539 1.00 0.00 O ATOM 91 OE2 GLU A 9 -25.203 -20.388 -0.376 1.00 0.00 O ATOM 0 H GLU A 9 -22.766 -22.596 -5.137 1.00 0.00 H new ATOM 0 HA GLU A 9 -21.580 -20.289 -3.706 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -23.306 -22.600 -2.881 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -22.072 -22.077 -1.752 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -23.016 -19.914 -1.530 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -23.982 -20.086 -2.983 1.00 0.00 H new ATOM 98 N TYR A 10 -19.903 -22.457 -4.816 1.00 0.00 N ATOM 99 CA TYR A 10 -18.639 -23.182 -4.865 1.00 0.00 C ATOM 100 C TYR A 10 -17.535 -22.401 -4.159 1.00 0.00 C ATOM 101 O TYR A 10 -16.670 -22.981 -3.502 1.00 0.00 O ATOM 102 CB TYR A 10 -18.238 -23.454 -6.316 1.00 0.00 C ATOM 103 CG TYR A 10 -17.648 -22.252 -7.017 1.00 0.00 C ATOM 104 CD1 TYR A 10 -18.317 -21.035 -7.036 1.00 0.00 C ATOM 105 CD2 TYR A 10 -16.418 -22.332 -7.659 1.00 0.00 C ATOM 106 CE1 TYR A 10 -17.782 -19.935 -7.675 1.00 0.00 C ATOM 107 CE2 TYR A 10 -15.874 -21.237 -8.300 1.00 0.00 C ATOM 108 CZ TYR A 10 -16.560 -20.040 -8.306 1.00 0.00 C ATOM 109 OH TYR A 10 -16.021 -18.945 -8.943 1.00 0.00 O ATOM 0 H TYR A 10 -20.305 -22.248 -5.730 1.00 0.00 H new ATOM 0 HA TYR A 10 -18.775 -24.132 -4.348 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -17.514 -24.268 -6.337 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -19.114 -23.792 -6.869 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -19.273 -20.948 -6.542 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -15.878 -23.267 -7.656 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -18.317 -18.997 -7.681 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -14.917 -21.317 -8.794 1.00 0.00 H new ATOM 0 HH TYR A 10 -15.156 -19.188 -9.335 1.00 0.00 H new ATOM 119 N ILE A 11 -17.572 -21.079 -4.301 1.00 0.00 N ATOM 120 CA ILE A 11 -16.576 -20.218 -3.675 1.00 0.00 C ATOM 121 C ILE A 11 -17.236 -19.036 -2.972 1.00 0.00 C ATOM 122 O ILE A 11 -16.829 -18.645 -1.878 1.00 0.00 O ATOM 123 CB ILE A 11 -15.565 -19.685 -4.708 1.00 0.00 C ATOM 124 CG1 ILE A 11 -14.666 -20.820 -5.204 1.00 0.00 C ATOM 125 CG2 ILE A 11 -14.730 -18.566 -4.103 1.00 0.00 C ATOM 126 CD1 ILE A 11 -13.501 -20.344 -6.044 1.00 0.00 C ATOM 0 H ILE A 11 -18.279 -20.583 -4.843 1.00 0.00 H new ATOM 0 HA ILE A 11 -16.048 -20.827 -2.941 1.00 0.00 H new ATOM 0 HB ILE A 11 -16.114 -19.282 -5.559 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -14.283 -21.371 -4.345 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -15.265 -21.518 -5.790 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -14.020 -18.200 -4.845 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -15.384 -17.751 -3.793 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -14.187 -18.945 -3.237 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -12.907 -21.201 -6.361 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -13.876 -19.818 -6.922 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -12.879 -19.669 -5.455 1.00 0.00 H new ATOM 138 N LEU A 12 -18.258 -18.473 -3.607 1.00 0.00 N ATOM 139 CA LEU A 12 -18.977 -17.337 -3.040 1.00 0.00 C ATOM 140 C LEU A 12 -19.359 -17.602 -1.588 1.00 0.00 C ATOM 141 O LEU A 12 -19.594 -16.671 -0.818 1.00 0.00 O ATOM 142 CB LEU A 12 -20.233 -17.042 -3.864 1.00 0.00 C ATOM 143 CG LEU A 12 -20.015 -16.275 -5.169 1.00 0.00 C ATOM 144 CD1 LEU A 12 -21.303 -16.216 -5.975 1.00 0.00 C ATOM 145 CD2 LEU A 12 -19.496 -14.873 -4.884 1.00 0.00 C ATOM 0 H LEU A 12 -18.607 -18.784 -4.514 1.00 0.00 H new ATOM 0 HA LEU A 12 -18.317 -16.470 -3.069 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -20.719 -17.989 -4.099 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -20.925 -16.473 -3.243 1.00 0.00 H new ATOM 0 HG LEU A 12 -19.266 -16.804 -5.758 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -21.129 -15.666 -6.900 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -21.631 -17.228 -6.211 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -22.074 -15.711 -5.393 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -19.347 -14.342 -5.824 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -20.221 -14.334 -4.274 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -18.548 -14.938 -4.349 1.00 0.00 H new ATOM 157 N ALA A 13 -19.416 -18.878 -1.221 1.00 0.00 N ATOM 158 CA ALA A 13 -19.765 -19.265 0.141 1.00 0.00 C ATOM 159 C ALA A 13 -18.527 -19.318 1.030 1.00 0.00 C ATOM 160 O ALA A 13 -18.593 -19.011 2.221 1.00 0.00 O ATOM 161 CB ALA A 13 -20.475 -20.610 0.141 1.00 0.00 C ATOM 0 H ALA A 13 -19.225 -19.661 -1.847 1.00 0.00 H new ATOM 0 HA ALA A 13 -20.439 -18.511 0.546 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -20.730 -20.887 1.164 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -21.386 -20.541 -0.454 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -19.819 -21.368 -0.287 1.00 0.00 H new ATOM 167 N LEU A 14 -17.400 -19.711 0.446 1.00 0.00 N ATOM 168 CA LEU A 14 -16.147 -19.805 1.185 1.00 0.00 C ATOM 169 C LEU A 14 -15.294 -18.558 0.974 1.00 0.00 C ATOM 170 O LEU A 14 -14.152 -18.490 1.427 1.00 0.00 O ATOM 171 CB LEU A 14 -15.368 -21.048 0.752 1.00 0.00 C ATOM 172 CG LEU A 14 -16.144 -22.366 0.769 1.00 0.00 C ATOM 173 CD1 LEU A 14 -15.375 -23.448 0.027 1.00 0.00 C ATOM 174 CD2 LEU A 14 -16.430 -22.798 2.201 1.00 0.00 C ATOM 0 H LEU A 14 -17.329 -19.970 -0.538 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.386 -19.884 2.246 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -14.993 -20.883 -0.258 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -14.499 -21.153 1.402 1.00 0.00 H new ATOM 0 HG LEU A 14 -17.096 -22.212 0.260 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -15.943 -24.378 0.050 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.222 -23.141 -1.008 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -14.408 -23.601 0.507 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -16.983 -23.737 2.194 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.489 -22.934 2.735 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -17.023 -22.032 2.701 1.00 0.00 H new ATOM 186 N ALA A 15 -15.858 -17.572 0.283 1.00 0.00 N ATOM 187 CA ALA A 15 -15.151 -16.325 0.016 1.00 0.00 C ATOM 188 C ALA A 15 -15.494 -15.266 1.057 1.00 0.00 C ATOM 189 O ALA A 15 -16.650 -14.867 1.195 1.00 0.00 O ATOM 190 CB ALA A 15 -15.482 -15.822 -1.381 1.00 0.00 C ATOM 0 H ALA A 15 -16.802 -17.613 -0.102 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.081 -16.522 0.076 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -14.948 -14.890 -1.568 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.181 -16.567 -2.117 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.555 -15.647 -1.460 1.00 0.00 H new ATOM 196 N ASP A 16 -14.481 -14.816 1.790 1.00 0.00 N ATOM 197 CA ASP A 16 -14.675 -13.801 2.820 1.00 0.00 C ATOM 198 C ASP A 16 -14.123 -12.454 2.367 1.00 0.00 C ATOM 199 O ASP A 16 -14.879 -11.548 2.015 1.00 0.00 O ATOM 200 CB ASP A 16 -13.998 -14.231 4.122 1.00 0.00 C ATOM 201 CG ASP A 16 -14.758 -15.335 4.833 1.00 0.00 C ATOM 202 OD1 ASP A 16 -15.713 -15.017 5.571 1.00 0.00 O ATOM 203 OD2 ASP A 16 -14.398 -16.516 4.649 1.00 0.00 O ATOM 0 H ASP A 16 -13.518 -15.138 1.690 1.00 0.00 H new ATOM 0 HA ASP A 16 -15.746 -13.694 2.993 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.985 -14.572 3.906 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -13.910 -13.370 4.784 1.00 0.00 H new ATOM 208 N VAL A 17 -12.800 -12.327 2.378 1.00 0.00 N ATOM 209 CA VAL A 17 -12.145 -11.091 1.968 1.00 0.00 C ATOM 210 C VAL A 17 -10.672 -11.325 1.657 1.00 0.00 C ATOM 211 O VAL A 17 -10.061 -12.291 2.116 1.00 0.00 O ATOM 212 CB VAL A 17 -12.263 -10.006 3.056 1.00 0.00 C ATOM 213 CG1 VAL A 17 -13.559 -9.225 2.893 1.00 0.00 C ATOM 214 CG2 VAL A 17 -12.176 -10.629 4.441 1.00 0.00 C ATOM 0 H VAL A 17 -12.160 -13.067 2.667 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.653 -10.749 1.066 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.431 -9.310 2.943 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -13.625 -8.463 3.670 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -13.575 -8.747 1.914 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -14.407 -9.905 2.978 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -12.261 -9.848 5.197 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -12.986 -11.347 4.568 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.219 -11.138 4.551 1.00 0.00 H new ATOM 224 N PRO A 18 -10.084 -10.421 0.860 1.00 0.00 N ATOM 225 CA PRO A 18 -8.673 -10.507 0.470 1.00 0.00 C ATOM 226 C PRO A 18 -7.732 -10.233 1.638 1.00 0.00 C ATOM 227 O PRO A 18 -8.021 -9.403 2.500 1.00 0.00 O ATOM 228 CB PRO A 18 -8.533 -9.418 -0.596 1.00 0.00 C ATOM 229 CG PRO A 18 -9.612 -8.439 -0.284 1.00 0.00 C ATOM 230 CD PRO A 18 -10.752 -9.244 0.277 1.00 0.00 C ATOM 0 HA PRO A 18 -8.407 -11.504 0.118 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.550 -8.949 -0.556 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -8.649 -9.829 -1.599 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -9.268 -7.695 0.435 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.919 -7.898 -1.179 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -11.308 -8.684 1.029 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -11.463 -9.529 -0.499 1.00 0.00 H new ATOM 238 N SER A 19 -6.604 -10.937 1.660 1.00 0.00 N ATOM 239 CA SER A 19 -5.622 -10.772 2.725 1.00 0.00 C ATOM 240 C SER A 19 -4.757 -9.538 2.481 1.00 0.00 C ATOM 241 O SER A 19 -4.569 -9.116 1.340 1.00 0.00 O ATOM 242 CB SER A 19 -4.737 -12.016 2.828 1.00 0.00 C ATOM 243 OG SER A 19 -5.515 -13.178 3.053 1.00 0.00 O ATOM 0 H SER A 19 -6.348 -11.626 0.953 1.00 0.00 H new ATOM 0 HA SER A 19 -6.160 -10.638 3.664 1.00 0.00 H new ATOM 0 HB2 SER A 19 -4.160 -12.133 1.910 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.021 -11.891 3.641 1.00 0.00 H new ATOM 0 HG SER A 19 -4.926 -13.959 3.113 1.00 0.00 H new ATOM 249 N SER A 20 -4.235 -8.965 3.561 1.00 0.00 N ATOM 250 CA SER A 20 -3.395 -7.778 3.465 1.00 0.00 C ATOM 251 C SER A 20 -2.232 -8.011 2.504 1.00 0.00 C ATOM 252 O SER A 20 -1.656 -9.097 2.438 1.00 0.00 O ATOM 253 CB SER A 20 -2.861 -7.393 4.846 1.00 0.00 C ATOM 254 OG SER A 20 -2.075 -8.436 5.398 1.00 0.00 O ATOM 0 H SER A 20 -4.379 -9.304 4.512 1.00 0.00 H new ATOM 0 HA SER A 20 -4.005 -6.962 3.078 1.00 0.00 H new ATOM 0 HB2 SER A 20 -2.263 -6.485 4.768 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.694 -7.170 5.512 1.00 0.00 H new ATOM 0 HG SER A 20 -1.744 -8.165 6.280 1.00 0.00 H new ATOM 260 N PRO A 21 -1.879 -6.967 1.740 1.00 0.00 N ATOM 261 CA PRO A 21 -0.783 -7.031 0.769 1.00 0.00 C ATOM 262 C PRO A 21 0.582 -7.127 1.441 1.00 0.00 C ATOM 263 O PRO A 21 0.676 -7.266 2.661 1.00 0.00 O ATOM 264 CB PRO A 21 -0.911 -5.714 0.001 1.00 0.00 C ATOM 265 CG PRO A 21 -1.593 -4.788 0.949 1.00 0.00 C ATOM 266 CD PRO A 21 -2.522 -5.642 1.765 1.00 0.00 C ATOM 0 HA PRO A 21 -0.850 -7.916 0.136 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.066 -5.331 -0.293 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.491 -5.843 -0.913 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -0.870 -4.279 1.586 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.143 -4.015 0.412 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -2.625 -5.265 2.782 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.523 -5.673 1.334 1.00 0.00 H new ATOM 274 N TYR A 22 1.638 -7.049 0.639 1.00 0.00 N ATOM 275 CA TYR A 22 2.999 -7.129 1.157 1.00 0.00 C ATOM 276 C TYR A 22 3.984 -6.456 0.206 1.00 0.00 C ATOM 277 O TYR A 22 3.613 -6.021 -0.884 1.00 0.00 O ATOM 278 CB TYR A 22 3.399 -8.588 1.375 1.00 0.00 C ATOM 279 CG TYR A 22 3.225 -9.454 0.148 1.00 0.00 C ATOM 280 CD1 TYR A 22 1.997 -10.039 -0.145 1.00 0.00 C ATOM 281 CD2 TYR A 22 4.285 -9.690 -0.718 1.00 0.00 C ATOM 282 CE1 TYR A 22 1.833 -10.831 -1.264 1.00 0.00 C ATOM 283 CE2 TYR A 22 4.128 -10.479 -1.841 1.00 0.00 C ATOM 284 CZ TYR A 22 2.901 -11.048 -2.110 1.00 0.00 C ATOM 285 OH TYR A 22 2.742 -11.836 -3.227 1.00 0.00 O ATOM 0 H TYR A 22 1.578 -6.930 -0.372 1.00 0.00 H new ATOM 0 HA TYR A 22 3.029 -6.605 2.112 1.00 0.00 H new ATOM 0 HB2 TYR A 22 4.441 -8.627 1.692 1.00 0.00 H new ATOM 0 HB3 TYR A 22 2.803 -9.002 2.189 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.158 -9.871 0.514 1.00 0.00 H new ATOM 0 HD2 TYR A 22 5.249 -9.249 -0.510 1.00 0.00 H new ATOM 0 HE1 TYR A 22 0.873 -11.279 -1.476 1.00 0.00 H new ATOM 0 HE2 TYR A 22 4.962 -10.649 -2.505 1.00 0.00 H new ATOM 0 HH TYR A 22 3.590 -11.886 -3.715 1.00 0.00 H new ATOM 295 N GLY A 23 5.242 -6.374 0.628 1.00 0.00 N ATOM 296 CA GLY A 23 6.262 -5.753 -0.197 1.00 0.00 C ATOM 297 C GLY A 23 6.075 -4.254 -0.320 1.00 0.00 C ATOM 298 O GLY A 23 6.870 -3.573 -0.968 1.00 0.00 O ATOM 0 H GLY A 23 5.573 -6.726 1.526 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.244 -5.960 0.228 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.244 -6.201 -1.191 1.00 0.00 H new ATOM 302 N VAL A 24 5.019 -3.738 0.300 1.00 0.00 N ATOM 303 CA VAL A 24 4.729 -2.309 0.256 1.00 0.00 C ATOM 304 C VAL A 24 5.931 -1.491 0.714 1.00 0.00 C ATOM 305 O VAL A 24 6.320 -1.537 1.880 1.00 0.00 O ATOM 306 CB VAL A 24 3.516 -1.955 1.136 1.00 0.00 C ATOM 307 CG1 VAL A 24 3.640 -2.608 2.505 1.00 0.00 C ATOM 308 CG2 VAL A 24 3.374 -0.446 1.267 1.00 0.00 C ATOM 0 H VAL A 24 4.350 -4.288 0.839 1.00 0.00 H new ATOM 0 HA VAL A 24 4.500 -2.064 -0.781 1.00 0.00 H new ATOM 0 HB VAL A 24 2.617 -2.341 0.656 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.774 -2.346 3.113 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.688 -3.691 2.389 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.547 -2.255 2.996 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.512 -0.215 1.892 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.274 -0.034 1.723 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.234 -0.007 0.279 1.00 0.00 H new ATOM 318 N LYS A 25 6.515 -0.739 -0.213 1.00 0.00 N ATOM 319 CA LYS A 25 7.673 0.093 0.093 1.00 0.00 C ATOM 320 C LYS A 25 7.641 1.387 -0.713 1.00 0.00 C ATOM 321 O LYS A 25 7.146 1.415 -1.841 1.00 0.00 O ATOM 322 CB LYS A 25 8.967 -0.670 -0.197 1.00 0.00 C ATOM 323 CG LYS A 25 8.994 -1.322 -1.568 1.00 0.00 C ATOM 324 CD LYS A 25 9.562 -0.385 -2.621 1.00 0.00 C ATOM 325 CE LYS A 25 10.256 -1.152 -3.735 1.00 0.00 C ATOM 326 NZ LYS A 25 11.507 -1.806 -3.262 1.00 0.00 N ATOM 0 H LYS A 25 6.205 -0.689 -1.183 1.00 0.00 H new ATOM 0 HA LYS A 25 7.638 0.345 1.153 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.810 0.016 -0.113 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.104 -1.438 0.564 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.594 -2.231 -1.528 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.984 -1.619 -1.851 1.00 0.00 H new ATOM 0 HD2 LYS A 25 8.759 0.221 -3.041 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.269 0.301 -2.155 1.00 0.00 H new ATOM 0 HE2 LYS A 25 9.579 -1.908 -4.132 1.00 0.00 H new ATOM 0 HE3 LYS A 25 10.489 -0.471 -4.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.130 -1.991 -4.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.993 -1.180 -2.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 11.273 -2.704 -2.793 1.00 0.00 H new ATOM 340 N ILE A 26 8.174 2.456 -0.131 1.00 0.00 N ATOM 341 CA ILE A 26 8.209 3.752 -0.797 1.00 0.00 C ATOM 342 C ILE A 26 9.397 3.848 -1.748 1.00 0.00 C ATOM 343 O ILE A 26 10.548 3.922 -1.315 1.00 0.00 O ATOM 344 CB ILE A 26 8.284 4.906 0.219 1.00 0.00 C ATOM 345 CG1 ILE A 26 7.154 4.788 1.242 1.00 0.00 C ATOM 346 CG2 ILE A 26 8.220 6.247 -0.496 1.00 0.00 C ATOM 347 CD1 ILE A 26 5.797 4.544 0.618 1.00 0.00 C ATOM 0 H ILE A 26 8.588 2.450 0.801 1.00 0.00 H new ATOM 0 HA ILE A 26 7.283 3.840 -1.365 1.00 0.00 H new ATOM 0 HB ILE A 26 9.235 4.843 0.747 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.381 3.973 1.929 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.114 5.702 1.834 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.274 7.053 0.236 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.057 6.330 -1.189 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.283 6.321 -1.048 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.044 4.471 1.402 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.549 5.371 -0.048 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.820 3.614 0.049 1.00 0.00 H new ATOM 359 N ILE A 27 9.111 3.849 -3.046 1.00 0.00 N ATOM 360 CA ILE A 27 10.156 3.941 -4.059 1.00 0.00 C ATOM 361 C ILE A 27 10.493 5.395 -4.371 1.00 0.00 C ATOM 362 O ILE A 27 11.657 5.743 -4.568 1.00 0.00 O ATOM 363 CB ILE A 27 9.741 3.230 -5.360 1.00 0.00 C ATOM 364 CG1 ILE A 27 8.402 3.775 -5.860 1.00 0.00 C ATOM 365 CG2 ILE A 27 9.659 1.727 -5.141 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.984 3.214 -7.201 1.00 0.00 C ATOM 0 H ILE A 27 8.164 3.787 -3.421 1.00 0.00 H new ATOM 0 HA ILE A 27 11.037 3.447 -3.650 1.00 0.00 H new ATOM 0 HB ILE A 27 10.498 3.425 -6.120 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.630 3.550 -5.124 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.465 4.861 -5.933 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.364 1.239 -6.070 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.633 1.351 -4.827 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.921 1.512 -4.368 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.026 3.644 -7.493 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.736 3.462 -7.950 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.888 2.131 -7.128 1.00 0.00 H new ATOM 378 N GLU A 28 9.466 6.239 -4.413 1.00 0.00 N ATOM 379 CA GLU A 28 9.655 7.655 -4.700 1.00 0.00 C ATOM 380 C GLU A 28 9.138 8.517 -3.552 1.00 0.00 C ATOM 381 O GLU A 28 7.930 8.678 -3.377 1.00 0.00 O ATOM 382 CB GLU A 28 8.940 8.035 -5.998 1.00 0.00 C ATOM 383 CG GLU A 28 9.454 7.288 -7.218 1.00 0.00 C ATOM 384 CD GLU A 28 9.274 8.072 -8.503 1.00 0.00 C ATOM 385 OE1 GLU A 28 10.153 8.902 -8.820 1.00 0.00 O ATOM 386 OE2 GLU A 28 8.254 7.858 -9.191 1.00 0.00 O ATOM 0 H GLU A 28 8.496 5.966 -4.252 1.00 0.00 H new ATOM 0 HA GLU A 28 10.724 7.836 -4.815 1.00 0.00 H new ATOM 0 HB2 GLU A 28 7.873 7.840 -5.886 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.052 9.106 -6.164 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.511 7.061 -7.081 1.00 0.00 H new ATOM 0 HG3 GLU A 28 8.931 6.335 -7.302 1.00 0.00 H new ATOM 393 N LEU A 29 10.061 9.068 -2.773 1.00 0.00 N ATOM 394 CA LEU A 29 9.701 9.914 -1.640 1.00 0.00 C ATOM 395 C LEU A 29 10.074 11.370 -1.906 1.00 0.00 C ATOM 396 O LEU A 29 11.215 11.676 -2.248 1.00 0.00 O ATOM 397 CB LEU A 29 10.396 9.422 -0.369 1.00 0.00 C ATOM 398 CG LEU A 29 9.957 10.087 0.937 1.00 0.00 C ATOM 399 CD1 LEU A 29 8.486 9.812 1.207 1.00 0.00 C ATOM 400 CD2 LEU A 29 10.815 9.601 2.096 1.00 0.00 C ATOM 0 H LEU A 29 11.065 8.945 -2.905 1.00 0.00 H new ATOM 0 HA LEU A 29 8.621 9.854 -1.503 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.230 8.348 -0.280 1.00 0.00 H new ATOM 0 HB3 LEU A 29 11.470 9.570 -0.486 1.00 0.00 H new ATOM 0 HG LEU A 29 10.091 11.164 0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.191 10.293 2.140 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.885 10.209 0.389 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.325 8.737 1.286 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.489 10.084 3.017 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.712 8.521 2.197 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.859 9.850 1.905 1.00 0.00 H new ATOM 412 N SER A 30 9.103 12.262 -1.743 1.00 0.00 N ATOM 413 CA SER A 30 9.328 13.686 -1.967 1.00 0.00 C ATOM 414 C SER A 30 9.038 14.488 -0.703 1.00 0.00 C ATOM 415 O SER A 30 8.740 13.921 0.348 1.00 0.00 O ATOM 416 CB SER A 30 8.450 14.188 -3.116 1.00 0.00 C ATOM 417 OG SER A 30 8.652 13.416 -4.287 1.00 0.00 O ATOM 0 H SER A 30 8.153 12.025 -1.457 1.00 0.00 H new ATOM 0 HA SER A 30 10.376 13.825 -2.232 1.00 0.00 H new ATOM 0 HB2 SER A 30 7.401 14.142 -2.823 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.678 15.234 -3.322 1.00 0.00 H new ATOM 0 HG SER A 30 7.824 13.393 -4.810 1.00 0.00 H new ATOM 423 N GLN A 31 9.129 15.809 -0.813 1.00 0.00 N ATOM 424 CA GLN A 31 8.877 16.689 0.322 1.00 0.00 C ATOM 425 C GLN A 31 7.387 16.986 0.461 1.00 0.00 C ATOM 426 O GLN A 31 6.902 17.287 1.552 1.00 0.00 O ATOM 427 CB GLN A 31 9.658 17.995 0.164 1.00 0.00 C ATOM 428 CG GLN A 31 9.574 18.589 -1.233 1.00 0.00 C ATOM 429 CD GLN A 31 10.681 18.095 -2.144 1.00 0.00 C ATOM 430 OE1 GLN A 31 10.420 17.549 -3.217 1.00 0.00 O ATOM 431 NE2 GLN A 31 11.925 18.283 -1.720 1.00 0.00 N ATOM 0 H GLN A 31 9.375 16.294 -1.676 1.00 0.00 H new ATOM 0 HA GLN A 31 9.212 16.180 1.226 1.00 0.00 H new ATOM 0 HB2 GLN A 31 9.281 18.723 0.883 1.00 0.00 H new ATOM 0 HB3 GLN A 31 10.704 17.815 0.411 1.00 0.00 H new ATOM 0 HG2 GLN A 31 8.608 18.339 -1.672 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.622 19.676 -1.165 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.095 18.740 -0.824 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.711 17.970 -2.290 1.00 0.00 H new ATOM 440 N THR A 32 6.667 16.902 -0.653 1.00 0.00 N ATOM 441 CA THR A 32 5.232 17.164 -0.657 1.00 0.00 C ATOM 442 C THR A 32 4.452 15.942 -1.122 1.00 0.00 C ATOM 443 O THR A 32 3.307 15.731 -0.719 1.00 0.00 O ATOM 444 CB THR A 32 4.882 18.360 -1.563 1.00 0.00 C ATOM 445 OG1 THR A 32 5.551 18.232 -2.822 1.00 0.00 O ATOM 446 CG2 THR A 32 5.278 19.673 -0.904 1.00 0.00 C ATOM 0 H THR A 32 7.053 16.655 -1.564 1.00 0.00 H new ATOM 0 HA THR A 32 4.951 17.401 0.369 1.00 0.00 H new ATOM 0 HB THR A 32 3.804 18.363 -1.723 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.322 18.995 -3.393 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.021 20.503 -1.563 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.745 19.781 0.041 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.352 19.677 -0.717 1.00 0.00 H new ATOM 454 N THR A 33 5.077 15.135 -1.975 1.00 0.00 N ATOM 455 CA THR A 33 4.439 13.932 -2.496 1.00 0.00 C ATOM 456 C THR A 33 5.157 12.676 -2.014 1.00 0.00 C ATOM 457 O THR A 33 6.286 12.743 -1.529 1.00 0.00 O ATOM 458 CB THR A 33 4.411 13.934 -4.037 1.00 0.00 C ATOM 459 OG1 THR A 33 5.696 14.301 -4.549 1.00 0.00 O ATOM 460 CG2 THR A 33 3.357 14.900 -4.557 1.00 0.00 C ATOM 0 H THR A 33 6.024 15.293 -2.319 1.00 0.00 H new ATOM 0 HA THR A 33 3.416 13.929 -2.121 1.00 0.00 H new ATOM 0 HB THR A 33 4.159 12.929 -4.376 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.671 14.298 -5.529 1.00 0.00 H new ATOM 0 HG21 THR A 33 3.355 14.885 -5.647 1.00 0.00 H new ATOM 0 HG22 THR A 33 2.376 14.601 -4.188 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.584 15.908 -4.209 1.00 0.00 H new ATOM 468 N ALA A 34 4.495 11.532 -2.151 1.00 0.00 N ATOM 469 CA ALA A 34 5.072 10.262 -1.732 1.00 0.00 C ATOM 470 C ALA A 34 4.390 9.091 -2.433 1.00 0.00 C ATOM 471 O ALA A 34 3.187 8.876 -2.278 1.00 0.00 O ATOM 472 CB ALA A 34 4.969 10.107 -0.222 1.00 0.00 C ATOM 0 H ALA A 34 3.559 11.459 -2.549 1.00 0.00 H new ATOM 0 HA ALA A 34 6.124 10.259 -2.016 1.00 0.00 H new ATOM 0 HB1 ALA A 34 5.404 9.153 0.076 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.508 10.920 0.265 1.00 0.00 H new ATOM 0 HB3 ALA A 34 3.921 10.137 0.076 1.00 0.00 H new ATOM 478 N LYS A 35 5.163 8.338 -3.206 1.00 0.00 N ATOM 479 CA LYS A 35 4.635 7.187 -3.931 1.00 0.00 C ATOM 480 C LYS A 35 4.839 5.903 -3.136 1.00 0.00 C ATOM 481 O LYS A 35 5.845 5.742 -2.443 1.00 0.00 O ATOM 482 CB LYS A 35 5.311 7.067 -5.298 1.00 0.00 C ATOM 483 CG LYS A 35 4.659 6.042 -6.210 1.00 0.00 C ATOM 484 CD LYS A 35 5.388 5.935 -7.539 1.00 0.00 C ATOM 485 CE LYS A 35 4.898 6.981 -8.529 1.00 0.00 C ATOM 486 NZ LYS A 35 3.473 6.763 -8.907 1.00 0.00 N ATOM 0 H LYS A 35 6.159 8.503 -3.348 1.00 0.00 H new ATOM 0 HA LYS A 35 3.565 7.338 -4.074 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.295 8.040 -5.789 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.358 6.800 -5.154 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.651 5.069 -5.719 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.619 6.319 -6.385 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.459 6.058 -7.379 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.240 4.939 -7.957 1.00 0.00 H new ATOM 0 HE2 LYS A 35 5.010 7.974 -8.094 1.00 0.00 H new ATOM 0 HE3 LYS A 35 5.519 6.953 -9.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 3.272 7.253 -9.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 3.297 5.745 -9.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 2.854 7.139 -8.160 1.00 0.00 H new ATOM 500 N VAL A 36 3.880 4.989 -3.241 1.00 0.00 N ATOM 501 CA VAL A 36 3.956 3.715 -2.534 1.00 0.00 C ATOM 502 C VAL A 36 3.750 2.544 -3.488 1.00 0.00 C ATOM 503 O VAL A 36 2.723 2.452 -4.161 1.00 0.00 O ATOM 504 CB VAL A 36 2.910 3.636 -1.407 1.00 0.00 C ATOM 505 CG1 VAL A 36 1.504 3.777 -1.972 1.00 0.00 C ATOM 506 CG2 VAL A 36 3.054 2.331 -0.637 1.00 0.00 C ATOM 0 H VAL A 36 3.041 5.107 -3.809 1.00 0.00 H new ATOM 0 HA VAL A 36 4.953 3.653 -2.099 1.00 0.00 H new ATOM 0 HB VAL A 36 3.083 4.461 -0.716 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.778 3.719 -1.161 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.409 4.739 -2.475 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.316 2.974 -2.685 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.307 2.292 0.156 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.908 1.490 -1.315 1.00 0.00 H new ATOM 0 HG23 VAL A 36 4.051 2.275 -0.199 1.00 0.00 H new ATOM 516 N SER A 37 4.732 1.650 -3.540 1.00 0.00 N ATOM 517 CA SER A 37 4.661 0.486 -4.415 1.00 0.00 C ATOM 518 C SER A 37 4.549 -0.799 -3.600 1.00 0.00 C ATOM 519 O SER A 37 5.372 -1.066 -2.724 1.00 0.00 O ATOM 520 CB SER A 37 5.893 0.423 -5.319 1.00 0.00 C ATOM 521 OG SER A 37 5.895 -0.761 -6.098 1.00 0.00 O ATOM 0 H SER A 37 5.587 1.710 -2.986 1.00 0.00 H new ATOM 0 HA SER A 37 3.770 0.583 -5.035 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.911 1.293 -5.975 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.797 0.463 -4.711 1.00 0.00 H new ATOM 0 HG SER A 37 6.692 -0.776 -6.668 1.00 0.00 H new ATOM 527 N PHE A 38 3.523 -1.592 -3.893 1.00 0.00 N ATOM 528 CA PHE A 38 3.302 -2.849 -3.188 1.00 0.00 C ATOM 529 C PHE A 38 2.942 -3.964 -4.164 1.00 0.00 C ATOM 530 O PHE A 38 2.791 -3.730 -5.363 1.00 0.00 O ATOM 531 CB PHE A 38 2.190 -2.686 -2.150 1.00 0.00 C ATOM 532 CG PHE A 38 0.958 -2.018 -2.691 1.00 0.00 C ATOM 533 CD1 PHE A 38 0.935 -0.650 -2.910 1.00 0.00 C ATOM 534 CD2 PHE A 38 -0.177 -2.758 -2.979 1.00 0.00 C ATOM 535 CE1 PHE A 38 -0.197 -0.032 -3.407 1.00 0.00 C ATOM 536 CE2 PHE A 38 -1.312 -2.145 -3.478 1.00 0.00 C ATOM 537 CZ PHE A 38 -1.322 -0.781 -3.691 1.00 0.00 C ATOM 0 H PHE A 38 2.832 -1.386 -4.614 1.00 0.00 H new ATOM 0 HA PHE A 38 4.228 -3.120 -2.680 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.920 -3.668 -1.761 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.570 -2.104 -1.310 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.812 -0.060 -2.690 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.176 -3.825 -2.812 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.202 1.035 -3.573 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.190 -2.733 -3.701 1.00 0.00 H new ATOM 0 HZ PHE A 38 -2.208 -0.301 -4.079 1.00 0.00 H new ATOM 547 N ASN A 39 2.807 -5.179 -3.642 1.00 0.00 N ATOM 548 CA ASN A 39 2.466 -6.333 -4.467 1.00 0.00 C ATOM 549 C ASN A 39 1.123 -6.923 -4.048 1.00 0.00 C ATOM 550 O ASN A 39 0.806 -6.995 -2.861 1.00 0.00 O ATOM 551 CB ASN A 39 3.559 -7.399 -4.366 1.00 0.00 C ATOM 552 CG ASN A 39 4.912 -6.884 -4.815 1.00 0.00 C ATOM 553 OD1 ASN A 39 5.074 -6.441 -5.952 1.00 0.00 O ATOM 554 ND2 ASN A 39 5.893 -6.942 -3.923 1.00 0.00 N ATOM 0 H ASN A 39 2.928 -5.390 -2.652 1.00 0.00 H new ATOM 0 HA ASN A 39 2.389 -5.999 -5.502 1.00 0.00 H new ATOM 0 HB2 ASN A 39 3.629 -7.747 -3.335 1.00 0.00 H new ATOM 0 HB3 ASN A 39 3.281 -8.260 -4.974 1.00 0.00 H new ATOM 0 HD21 ASN A 39 6.826 -6.611 -4.169 1.00 0.00 H new ATOM 0 HD22 ASN A 39 5.714 -7.317 -2.992 1.00 0.00 H new ATOM 561 N LYS A 40 0.336 -7.345 -5.033 1.00 0.00 N ATOM 562 CA LYS A 40 -0.972 -7.933 -4.768 1.00 0.00 C ATOM 563 C LYS A 40 -0.872 -9.038 -3.723 1.00 0.00 C ATOM 564 O LYS A 40 0.147 -9.718 -3.600 1.00 0.00 O ATOM 565 CB LYS A 40 -1.575 -8.490 -6.060 1.00 0.00 C ATOM 566 CG LYS A 40 -1.672 -7.466 -7.177 1.00 0.00 C ATOM 567 CD LYS A 40 -2.705 -7.869 -8.216 1.00 0.00 C ATOM 568 CE LYS A 40 -4.119 -7.582 -7.737 1.00 0.00 C ATOM 569 NZ LYS A 40 -5.128 -8.401 -8.464 1.00 0.00 N ATOM 0 H LYS A 40 0.581 -7.291 -6.022 1.00 0.00 H new ATOM 0 HA LYS A 40 -1.622 -7.149 -4.379 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -0.970 -9.330 -6.400 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -2.571 -8.879 -5.848 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -1.935 -6.494 -6.759 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -0.699 -7.354 -7.655 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.518 -7.330 -9.145 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.604 -8.931 -8.438 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.189 -7.785 -6.668 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.342 -6.524 -7.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -6.079 -8.176 -8.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -5.079 -8.189 -9.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.931 -9.411 -8.311 1.00 0.00 H new ATOM 583 N PRO A 41 -1.954 -9.226 -2.952 1.00 0.00 N ATOM 584 CA PRO A 41 -2.011 -10.250 -1.906 1.00 0.00 C ATOM 585 C PRO A 41 -2.055 -11.663 -2.479 1.00 0.00 C ATOM 586 O PRO A 41 -2.452 -11.866 -3.626 1.00 0.00 O ATOM 587 CB PRO A 41 -3.315 -9.931 -1.170 1.00 0.00 C ATOM 588 CG PRO A 41 -4.156 -9.227 -2.177 1.00 0.00 C ATOM 589 CD PRO A 41 -3.202 -8.452 -3.043 1.00 0.00 C ATOM 0 HA PRO A 41 -1.128 -10.230 -1.267 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.801 -10.839 -0.814 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.134 -9.303 -0.297 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.732 -9.938 -2.770 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.871 -8.562 -1.692 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.558 -8.383 -4.071 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.070 -7.432 -2.682 1.00 0.00 H new ATOM 597 N ASP A 42 -1.644 -12.636 -1.673 1.00 0.00 N ATOM 598 CA ASP A 42 -1.637 -14.030 -2.100 1.00 0.00 C ATOM 599 C ASP A 42 -3.055 -14.592 -2.145 1.00 0.00 C ATOM 600 O ASP A 42 -3.321 -15.577 -2.832 1.00 0.00 O ATOM 601 CB ASP A 42 -0.772 -14.870 -1.159 1.00 0.00 C ATOM 602 CG ASP A 42 -1.354 -14.957 0.239 1.00 0.00 C ATOM 603 OD1 ASP A 42 -2.024 -13.993 0.664 1.00 0.00 O ATOM 604 OD2 ASP A 42 -1.139 -15.989 0.907 1.00 0.00 O ATOM 0 H ASP A 42 -1.311 -12.485 -0.721 1.00 0.00 H new ATOM 0 HA ASP A 42 -1.216 -14.074 -3.104 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.665 -15.875 -1.568 1.00 0.00 H new ATOM 0 HB3 ASP A 42 0.228 -14.439 -1.107 1.00 0.00 H new ATOM 609 N SER A 43 -3.960 -13.958 -1.406 1.00 0.00 N ATOM 610 CA SER A 43 -5.350 -14.397 -1.358 1.00 0.00 C ATOM 611 C SER A 43 -6.295 -13.247 -1.690 1.00 0.00 C ATOM 612 O SER A 43 -6.191 -12.159 -1.122 1.00 0.00 O ATOM 613 CB SER A 43 -5.680 -14.962 0.025 1.00 0.00 C ATOM 614 OG SER A 43 -6.930 -15.631 0.017 1.00 0.00 O ATOM 0 H SER A 43 -3.756 -13.139 -0.833 1.00 0.00 H new ATOM 0 HA SER A 43 -5.484 -15.180 -2.104 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.896 -15.653 0.336 1.00 0.00 H new ATOM 0 HB3 SER A 43 -5.701 -14.154 0.756 1.00 0.00 H new ATOM 0 HG SER A 43 -7.118 -15.985 0.912 1.00 0.00 H new ATOM 620 N HIS A 44 -7.218 -13.495 -2.613 1.00 0.00 N ATOM 621 CA HIS A 44 -8.183 -12.479 -3.020 1.00 0.00 C ATOM 622 C HIS A 44 -9.592 -12.857 -2.570 1.00 0.00 C ATOM 623 O HIS A 44 -10.572 -12.568 -3.256 1.00 0.00 O ATOM 624 CB HIS A 44 -8.153 -12.297 -4.538 1.00 0.00 C ATOM 625 CG HIS A 44 -8.384 -13.566 -5.300 1.00 0.00 C ATOM 626 ND1 HIS A 44 -9.343 -14.491 -4.946 1.00 0.00 N ATOM 627 CD2 HIS A 44 -7.774 -14.060 -6.402 1.00 0.00 C ATOM 628 CE1 HIS A 44 -9.313 -15.500 -5.798 1.00 0.00 C ATOM 629 NE2 HIS A 44 -8.370 -15.264 -6.691 1.00 0.00 N ATOM 0 H HIS A 44 -7.319 -14.389 -3.093 1.00 0.00 H new ATOM 0 HA HIS A 44 -7.907 -11.539 -2.542 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -8.912 -11.569 -4.823 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -7.188 -11.881 -4.826 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -6.969 -13.595 -6.952 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -9.952 -16.370 -5.769 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -8.124 -15.876 -7.469 1.00 0.00 H new ATOM 638 N GLY A 45 -9.684 -13.506 -1.413 1.00 0.00 N ATOM 639 CA GLY A 45 -10.976 -13.914 -0.892 1.00 0.00 C ATOM 640 C GLY A 45 -11.841 -14.580 -1.943 1.00 0.00 C ATOM 641 O GLY A 45 -13.056 -14.393 -1.968 1.00 0.00 O ATOM 0 H GLY A 45 -8.887 -13.756 -0.827 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.828 -14.601 -0.059 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.497 -13.042 -0.497 1.00 0.00 H new ATOM 645 N GLY A 46 -11.212 -15.362 -2.816 1.00 0.00 N ATOM 646 CA GLY A 46 -11.948 -16.047 -3.864 1.00 0.00 C ATOM 647 C GLY A 46 -12.331 -15.121 -5.002 1.00 0.00 C ATOM 648 O GLY A 46 -11.903 -15.315 -6.139 1.00 0.00 O ATOM 0 H GLY A 46 -10.207 -15.533 -2.816 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -11.343 -16.866 -4.253 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -12.849 -16.490 -3.441 1.00 0.00 H new ATOM 652 N VAL A 47 -13.141 -14.113 -4.696 1.00 0.00 N ATOM 653 CA VAL A 47 -13.583 -13.154 -5.701 1.00 0.00 C ATOM 654 C VAL A 47 -12.437 -12.249 -6.139 1.00 0.00 C ATOM 655 O VAL A 47 -11.522 -11.950 -5.371 1.00 0.00 O ATOM 656 CB VAL A 47 -14.740 -12.283 -5.177 1.00 0.00 C ATOM 657 CG1 VAL A 47 -15.938 -13.148 -4.813 1.00 0.00 C ATOM 658 CG2 VAL A 47 -14.286 -11.457 -3.983 1.00 0.00 C ATOM 0 H VAL A 47 -13.505 -13.939 -3.759 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.933 -13.732 -6.556 1.00 0.00 H new ATOM 0 HB VAL A 47 -15.044 -11.599 -5.969 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.745 -12.515 -4.445 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.276 -13.691 -5.696 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -15.652 -13.858 -4.038 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.116 -10.848 -3.626 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -13.954 -12.122 -3.186 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.462 -10.809 -4.281 1.00 0.00 H new ATOM 668 N PRO A 48 -12.488 -11.798 -7.401 1.00 0.00 N ATOM 669 CA PRO A 48 -11.462 -10.919 -7.969 1.00 0.00 C ATOM 670 C PRO A 48 -11.499 -9.519 -7.364 1.00 0.00 C ATOM 671 O PRO A 48 -12.566 -8.920 -7.230 1.00 0.00 O ATOM 672 CB PRO A 48 -11.821 -10.869 -9.456 1.00 0.00 C ATOM 673 CG PRO A 48 -13.281 -11.161 -9.503 1.00 0.00 C ATOM 674 CD PRO A 48 -13.550 -12.113 -8.371 1.00 0.00 C ATOM 0 HA PRO A 48 -10.455 -11.287 -7.772 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -11.599 -9.892 -9.884 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -11.252 -11.604 -10.026 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -13.865 -10.248 -9.392 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -13.560 -11.603 -10.459 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -14.542 -11.961 -7.945 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -13.500 -13.151 -8.699 1.00 0.00 H new ATOM 682 N ILE A 49 -10.328 -9.005 -7.003 1.00 0.00 N ATOM 683 CA ILE A 49 -10.228 -7.675 -6.415 1.00 0.00 C ATOM 684 C ILE A 49 -10.715 -6.606 -7.387 1.00 0.00 C ATOM 685 O ILE A 49 -10.711 -6.807 -8.602 1.00 0.00 O ATOM 686 CB ILE A 49 -8.781 -7.351 -5.998 1.00 0.00 C ATOM 687 CG1 ILE A 49 -8.359 -8.231 -4.819 1.00 0.00 C ATOM 688 CG2 ILE A 49 -8.650 -5.878 -5.641 1.00 0.00 C ATOM 689 CD1 ILE A 49 -6.867 -8.228 -4.568 1.00 0.00 C ATOM 0 H ILE A 49 -9.436 -9.489 -7.107 1.00 0.00 H new ATOM 0 HA ILE A 49 -10.863 -7.674 -5.529 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.120 -7.560 -6.839 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.872 -7.890 -3.919 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -8.686 -9.254 -5.004 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.622 -5.665 -5.348 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.915 -5.269 -6.505 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -9.319 -5.643 -4.813 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.640 -8.872 -3.719 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.348 -8.597 -5.453 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.537 -7.212 -4.351 1.00 0.00 H new ATOM 701 N HIS A 50 -11.135 -5.467 -6.843 1.00 0.00 N ATOM 702 CA HIS A 50 -11.623 -4.364 -7.663 1.00 0.00 C ATOM 703 C HIS A 50 -10.661 -3.182 -7.613 1.00 0.00 C ATOM 704 O HIS A 50 -10.328 -2.594 -8.643 1.00 0.00 O ATOM 705 CB HIS A 50 -13.011 -3.926 -7.191 1.00 0.00 C ATOM 706 CG HIS A 50 -14.130 -4.676 -7.846 1.00 0.00 C ATOM 707 ND1 HIS A 50 -15.241 -5.119 -7.161 1.00 0.00 N ATOM 708 CD2 HIS A 50 -14.305 -5.058 -9.133 1.00 0.00 C ATOM 709 CE1 HIS A 50 -16.051 -5.744 -7.998 1.00 0.00 C ATOM 710 NE2 HIS A 50 -15.507 -5.720 -9.201 1.00 0.00 N ATOM 0 H HIS A 50 -11.147 -5.285 -5.840 1.00 0.00 H new ATOM 0 HA HIS A 50 -11.690 -4.712 -8.694 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -13.078 -4.060 -6.111 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -13.134 -2.861 -7.388 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -13.626 -4.876 -9.953 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -16.997 -6.197 -7.742 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -15.913 -6.127 -10.044 1.00 0.00 H new ATOM 719 N HIS A 51 -10.216 -2.836 -6.408 1.00 0.00 N ATOM 720 CA HIS A 51 -9.292 -1.724 -6.224 1.00 0.00 C ATOM 721 C HIS A 51 -8.634 -1.785 -4.850 1.00 0.00 C ATOM 722 O HIS A 51 -8.965 -2.642 -4.030 1.00 0.00 O ATOM 723 CB HIS A 51 -10.022 -0.392 -6.394 1.00 0.00 C ATOM 724 CG HIS A 51 -11.056 -0.138 -5.340 1.00 0.00 C ATOM 725 ND1 HIS A 51 -12.307 -0.716 -5.359 1.00 0.00 N ATOM 726 CD2 HIS A 51 -11.018 0.637 -4.231 1.00 0.00 C ATOM 727 CE1 HIS A 51 -12.996 -0.307 -4.308 1.00 0.00 C ATOM 728 NE2 HIS A 51 -12.235 0.515 -3.607 1.00 0.00 N ATOM 0 H HIS A 51 -10.481 -3.311 -5.545 1.00 0.00 H new ATOM 0 HA HIS A 51 -8.514 -1.802 -6.983 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.292 0.418 -6.378 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -10.500 -0.371 -7.373 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -10.185 1.239 -3.899 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.008 -0.595 -4.064 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.507 0.983 -2.743 1.00 0.00 H new ATOM 737 N TYR A 52 -7.701 -0.872 -4.603 1.00 0.00 N ATOM 738 CA TYR A 52 -6.995 -0.825 -3.328 1.00 0.00 C ATOM 739 C TYR A 52 -7.357 0.437 -2.551 1.00 0.00 C ATOM 740 O TYR A 52 -7.664 1.473 -3.139 1.00 0.00 O ATOM 741 CB TYR A 52 -5.483 -0.880 -3.556 1.00 0.00 C ATOM 742 CG TYR A 52 -4.994 -2.224 -4.048 1.00 0.00 C ATOM 743 CD1 TYR A 52 -5.087 -2.571 -5.389 1.00 0.00 C ATOM 744 CD2 TYR A 52 -4.438 -3.146 -3.170 1.00 0.00 C ATOM 745 CE1 TYR A 52 -4.642 -3.797 -5.843 1.00 0.00 C ATOM 746 CE2 TYR A 52 -3.989 -4.374 -3.615 1.00 0.00 C ATOM 747 CZ TYR A 52 -4.093 -4.696 -4.952 1.00 0.00 C ATOM 748 OH TYR A 52 -3.646 -5.918 -5.400 1.00 0.00 O ATOM 0 H TYR A 52 -7.416 -0.154 -5.269 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.300 -1.692 -2.741 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.205 -0.114 -4.280 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.974 -0.637 -2.623 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -5.515 -1.870 -6.090 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.355 -2.898 -2.122 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -4.723 -4.051 -6.890 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -3.558 -5.079 -2.919 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.201 -6.630 -5.018 1.00 0.00 H new ATOM 758 N GLN A 53 -7.318 0.340 -1.226 1.00 0.00 N ATOM 759 CA GLN A 53 -7.643 1.473 -0.368 1.00 0.00 C ATOM 760 C GLN A 53 -6.421 1.922 0.426 1.00 0.00 C ATOM 761 O GLN A 53 -5.840 1.146 1.184 1.00 0.00 O ATOM 762 CB GLN A 53 -8.780 1.106 0.588 1.00 0.00 C ATOM 763 CG GLN A 53 -9.434 2.311 1.245 1.00 0.00 C ATOM 764 CD GLN A 53 -10.880 2.056 1.623 1.00 0.00 C ATOM 765 OE1 GLN A 53 -11.536 1.179 1.060 1.00 0.00 O ATOM 766 NE2 GLN A 53 -11.386 2.823 2.582 1.00 0.00 N ATOM 0 H GLN A 53 -7.065 -0.511 -0.724 1.00 0.00 H new ATOM 0 HA GLN A 53 -7.964 2.298 -1.004 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -9.537 0.545 0.040 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.393 0.445 1.363 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -8.871 2.583 2.138 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -9.385 3.162 0.566 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -10.807 3.538 3.022 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -12.354 2.697 2.879 1.00 0.00 H new ATOM 775 N VAL A 54 -6.035 3.181 0.245 1.00 0.00 N ATOM 776 CA VAL A 54 -4.881 3.735 0.944 1.00 0.00 C ATOM 777 C VAL A 54 -5.295 4.867 1.878 1.00 0.00 C ATOM 778 O VAL A 54 -6.016 5.782 1.478 1.00 0.00 O ATOM 779 CB VAL A 54 -3.824 4.261 -0.044 1.00 0.00 C ATOM 780 CG1 VAL A 54 -2.606 4.783 0.702 1.00 0.00 C ATOM 781 CG2 VAL A 54 -3.428 3.171 -1.030 1.00 0.00 C ATOM 0 H VAL A 54 -6.504 3.837 -0.380 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.448 2.924 1.530 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.258 5.089 -0.605 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.871 5.150 -0.014 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.905 5.596 1.364 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.168 3.978 1.292 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.680 3.560 -1.721 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.013 2.322 -0.487 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.307 2.850 -1.589 1.00 0.00 H new ATOM 791 N ASP A 55 -4.835 4.799 3.122 1.00 0.00 N ATOM 792 CA ASP A 55 -5.157 5.819 4.113 1.00 0.00 C ATOM 793 C ASP A 55 -3.886 6.406 4.721 1.00 0.00 C ATOM 794 O ASP A 55 -3.095 5.693 5.339 1.00 0.00 O ATOM 795 CB ASP A 55 -6.039 5.231 5.215 1.00 0.00 C ATOM 796 CG ASP A 55 -7.139 4.345 4.664 1.00 0.00 C ATOM 797 OD1 ASP A 55 -7.187 4.156 3.431 1.00 0.00 O ATOM 798 OD2 ASP A 55 -7.952 3.841 5.467 1.00 0.00 O ATOM 0 H ASP A 55 -4.238 4.048 3.468 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.702 6.618 3.611 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -5.421 4.653 5.902 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -6.484 6.042 5.792 1.00 0.00 H new ATOM 803 N VAL A 56 -3.697 7.708 4.540 1.00 0.00 N ATOM 804 CA VAL A 56 -2.522 8.392 5.070 1.00 0.00 C ATOM 805 C VAL A 56 -2.923 9.542 5.987 1.00 0.00 C ATOM 806 O VAL A 56 -3.912 10.232 5.739 1.00 0.00 O ATOM 807 CB VAL A 56 -1.632 8.938 3.938 1.00 0.00 C ATOM 808 CG1 VAL A 56 -2.321 10.092 3.226 1.00 0.00 C ATOM 809 CG2 VAL A 56 -0.280 9.369 4.486 1.00 0.00 C ATOM 0 H VAL A 56 -4.342 8.312 4.030 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.958 7.655 5.642 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.467 8.142 3.212 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.677 10.465 2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.263 9.746 2.799 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.518 10.893 3.938 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.337 9.752 3.673 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.422 10.150 5.233 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.216 8.514 4.945 1.00 0.00 H new ATOM 819 N LYS A 57 -2.147 9.744 7.046 1.00 0.00 N ATOM 820 CA LYS A 57 -2.419 10.812 8.002 1.00 0.00 C ATOM 821 C LYS A 57 -1.222 11.039 8.919 1.00 0.00 C ATOM 822 O LYS A 57 -0.446 10.120 9.179 1.00 0.00 O ATOM 823 CB LYS A 57 -3.657 10.476 8.836 1.00 0.00 C ATOM 824 CG LYS A 57 -3.777 11.301 10.105 1.00 0.00 C ATOM 825 CD LYS A 57 -4.827 10.730 11.044 1.00 0.00 C ATOM 826 CE LYS A 57 -4.295 9.531 11.812 1.00 0.00 C ATOM 827 NZ LYS A 57 -3.284 9.929 12.831 1.00 0.00 N ATOM 0 H LYS A 57 -1.324 9.182 7.265 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.604 11.728 7.441 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.548 10.630 8.227 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.631 9.419 9.101 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -2.813 11.333 10.612 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -4.036 12.328 9.849 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.146 11.500 11.746 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.707 10.436 10.472 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -5.122 9.018 12.302 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.848 8.822 11.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -3.033 9.104 13.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -2.433 10.288 12.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -3.679 10.674 13.440 1.00 0.00 H new ATOM 841 N GLU A 58 -1.079 12.268 9.405 1.00 0.00 N ATOM 842 CA GLU A 58 0.025 12.614 10.293 1.00 0.00 C ATOM 843 C GLU A 58 -0.040 11.800 11.583 1.00 0.00 C ATOM 844 O GLU A 58 -1.116 11.589 12.143 1.00 0.00 O ATOM 845 CB GLU A 58 -0.003 14.109 10.618 1.00 0.00 C ATOM 846 CG GLU A 58 0.794 14.958 9.642 1.00 0.00 C ATOM 847 CD GLU A 58 0.231 16.359 9.493 1.00 0.00 C ATOM 848 OE1 GLU A 58 -0.516 16.796 10.393 1.00 0.00 O ATOM 849 OE2 GLU A 58 0.537 17.016 8.476 1.00 0.00 O ATOM 0 H GLU A 58 -1.713 13.040 9.199 1.00 0.00 H new ATOM 0 HA GLU A 58 0.958 12.378 9.781 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.038 14.452 10.624 1.00 0.00 H new ATOM 0 HB3 GLU A 58 0.389 14.261 11.624 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.828 15.020 9.981 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.806 14.470 8.668 1.00 0.00 H new ATOM 856 N VAL A 59 1.120 11.347 12.048 1.00 0.00 N ATOM 857 CA VAL A 59 1.196 10.557 13.271 1.00 0.00 C ATOM 858 C VAL A 59 0.566 11.299 14.445 1.00 0.00 C ATOM 859 O VAL A 59 0.261 10.703 15.477 1.00 0.00 O ATOM 860 CB VAL A 59 2.654 10.208 13.624 1.00 0.00 C ATOM 861 CG1 VAL A 59 3.538 11.442 13.525 1.00 0.00 C ATOM 862 CG2 VAL A 59 2.735 9.595 15.013 1.00 0.00 C ATOM 0 H VAL A 59 2.019 11.513 11.597 1.00 0.00 H new ATOM 0 HA VAL A 59 0.643 9.636 13.087 1.00 0.00 H new ATOM 0 HB VAL A 59 3.016 9.472 12.906 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.564 11.176 13.778 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.505 11.833 12.508 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.179 12.203 14.218 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.773 9.355 15.245 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.354 10.305 15.747 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.136 8.685 15.044 1.00 0.00 H new ATOM 872 N ALA A 60 0.370 12.603 14.277 1.00 0.00 N ATOM 873 CA ALA A 60 -0.227 13.426 15.321 1.00 0.00 C ATOM 874 C ALA A 60 -1.705 13.677 15.044 1.00 0.00 C ATOM 875 O ALA A 60 -2.531 13.645 15.956 1.00 0.00 O ATOM 876 CB ALA A 60 0.520 14.746 15.445 1.00 0.00 C ATOM 0 H ALA A 60 0.616 13.112 13.428 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.147 12.886 16.265 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.063 15.350 16.229 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.562 14.552 15.698 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.470 15.283 14.497 1.00 0.00 H new ATOM 882 N SER A 61 -2.031 13.926 13.780 1.00 0.00 N ATOM 883 CA SER A 61 -3.410 14.187 13.384 1.00 0.00 C ATOM 884 C SER A 61 -4.312 13.013 13.751 1.00 0.00 C ATOM 885 O SER A 61 -3.837 11.964 14.184 1.00 0.00 O ATOM 886 CB SER A 61 -3.489 14.455 11.880 1.00 0.00 C ATOM 887 OG SER A 61 -4.831 14.639 11.464 1.00 0.00 O ATOM 0 H SER A 61 -1.359 13.953 13.013 1.00 0.00 H new ATOM 0 HA SER A 61 -3.755 15.070 13.922 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.904 15.341 11.634 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.047 13.621 11.335 1.00 0.00 H new ATOM 0 HG SER A 61 -4.854 14.810 10.499 1.00 0.00 H new ATOM 893 N GLU A 62 -5.617 13.199 13.575 1.00 0.00 N ATOM 894 CA GLU A 62 -6.585 12.155 13.888 1.00 0.00 C ATOM 895 C GLU A 62 -7.450 11.831 12.672 1.00 0.00 C ATOM 896 O GLU A 62 -8.086 10.779 12.613 1.00 0.00 O ATOM 897 CB GLU A 62 -7.474 12.588 15.057 1.00 0.00 C ATOM 898 CG GLU A 62 -6.711 12.807 16.352 1.00 0.00 C ATOM 899 CD GLU A 62 -7.601 12.720 17.576 1.00 0.00 C ATOM 900 OE1 GLU A 62 -8.040 11.600 17.911 1.00 0.00 O ATOM 901 OE2 GLU A 62 -7.858 13.771 18.199 1.00 0.00 O ATOM 0 H GLU A 62 -6.027 14.062 13.218 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.034 11.258 14.170 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.990 13.510 14.788 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.240 11.830 15.220 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.917 12.064 16.431 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.231 13.785 16.325 1.00 0.00 H new ATOM 908 N ILE A 63 -7.465 12.743 11.705 1.00 0.00 N ATOM 909 CA ILE A 63 -8.248 12.553 10.491 1.00 0.00 C ATOM 910 C ILE A 63 -7.480 11.729 9.463 1.00 0.00 C ATOM 911 O ILE A 63 -6.343 12.051 9.120 1.00 0.00 O ATOM 912 CB ILE A 63 -8.642 13.902 9.860 1.00 0.00 C ATOM 913 CG1 ILE A 63 -9.515 14.706 10.824 1.00 0.00 C ATOM 914 CG2 ILE A 63 -9.368 13.678 8.541 1.00 0.00 C ATOM 915 CD1 ILE A 63 -8.725 15.596 11.758 1.00 0.00 C ATOM 0 H ILE A 63 -6.944 13.619 11.739 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.152 12.017 10.779 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.734 14.472 9.661 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -10.206 15.321 10.248 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.118 14.017 11.416 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -9.640 14.640 8.107 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -8.715 13.141 7.853 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.270 13.092 8.717 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -9.410 16.136 12.412 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -8.053 14.985 12.361 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.143 16.309 11.175 1.00 0.00 H new ATOM 927 N TRP A 64 -8.110 10.667 8.975 1.00 0.00 N ATOM 928 CA TRP A 64 -7.487 9.797 7.984 1.00 0.00 C ATOM 929 C TRP A 64 -7.926 10.175 6.574 1.00 0.00 C ATOM 930 O TRP A 64 -9.120 10.271 6.289 1.00 0.00 O ATOM 931 CB TRP A 64 -7.837 8.335 8.266 1.00 0.00 C ATOM 932 CG TRP A 64 -7.087 7.757 9.428 1.00 0.00 C ATOM 933 CD1 TRP A 64 -7.484 7.746 10.735 1.00 0.00 C ATOM 934 CD2 TRP A 64 -5.811 7.110 9.388 1.00 0.00 C ATOM 935 NE1 TRP A 64 -6.530 7.130 11.510 1.00 0.00 N ATOM 936 CE2 TRP A 64 -5.495 6.731 10.707 1.00 0.00 C ATOM 937 CE3 TRP A 64 -4.906 6.812 8.366 1.00 0.00 C ATOM 938 CZ2 TRP A 64 -4.312 6.070 11.029 1.00 0.00 C ATOM 939 CZ3 TRP A 64 -3.732 6.156 8.687 1.00 0.00 C ATOM 940 CH2 TRP A 64 -3.444 5.790 10.008 1.00 0.00 C ATOM 0 H TRP A 64 -9.052 10.387 9.249 1.00 0.00 H new ATOM 0 HA TRP A 64 -6.407 9.924 8.054 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -8.907 8.256 8.458 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.628 7.741 7.376 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -8.410 8.160 11.105 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.584 6.993 12.519 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -5.120 7.089 7.344 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -4.088 5.789 12.047 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.025 5.922 7.905 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -2.519 5.277 10.225 1.00 0.00 H new ATOM 951 N LYS A 65 -6.954 10.390 5.694 1.00 0.00 N ATOM 952 CA LYS A 65 -7.240 10.756 4.312 1.00 0.00 C ATOM 953 C LYS A 65 -7.217 9.528 3.407 1.00 0.00 C ATOM 954 O LYS A 65 -6.183 8.876 3.257 1.00 0.00 O ATOM 955 CB LYS A 65 -6.224 11.787 3.815 1.00 0.00 C ATOM 956 CG LYS A 65 -6.313 13.124 4.533 1.00 0.00 C ATOM 957 CD LYS A 65 -5.109 14.001 4.229 1.00 0.00 C ATOM 958 CE LYS A 65 -3.866 13.514 4.958 1.00 0.00 C ATOM 959 NZ LYS A 65 -2.837 14.583 5.074 1.00 0.00 N ATOM 0 H LYS A 65 -5.961 10.317 5.914 1.00 0.00 H new ATOM 0 HA LYS A 65 -8.238 11.192 4.278 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.219 11.384 3.939 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.374 11.947 2.747 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.225 13.640 4.232 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.381 12.957 5.608 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -4.923 14.006 3.155 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.324 15.029 4.521 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -4.142 13.166 5.953 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.445 12.660 4.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.006 14.212 5.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.555 14.898 4.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -3.230 15.388 5.603 1.00 0.00 H new ATOM 973 N ILE A 66 -8.361 9.219 2.807 1.00 0.00 N ATOM 974 CA ILE A 66 -8.470 8.071 1.915 1.00 0.00 C ATOM 975 C ILE A 66 -8.240 8.479 0.465 1.00 0.00 C ATOM 976 O ILE A 66 -8.737 9.510 0.011 1.00 0.00 O ATOM 977 CB ILE A 66 -9.849 7.396 2.034 1.00 0.00 C ATOM 978 CG1 ILE A 66 -10.175 7.108 3.501 1.00 0.00 C ATOM 979 CG2 ILE A 66 -9.883 6.113 1.217 1.00 0.00 C ATOM 980 CD1 ILE A 66 -9.262 6.082 4.134 1.00 0.00 C ATOM 0 H ILE A 66 -9.226 9.747 2.922 1.00 0.00 H new ATOM 0 HA ILE A 66 -7.700 7.361 2.217 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.605 8.075 1.640 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -10.112 8.037 4.068 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.205 6.760 3.574 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.864 5.648 1.311 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.690 6.344 0.169 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.119 5.427 1.584 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.552 5.929 5.173 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.342 5.140 3.592 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -8.232 6.437 4.093 1.00 0.00 H new ATOM 992 N VAL A 67 -7.483 7.661 -0.260 1.00 0.00 N ATOM 993 CA VAL A 67 -7.188 7.934 -1.662 1.00 0.00 C ATOM 994 C VAL A 67 -7.379 6.686 -2.517 1.00 0.00 C ATOM 995 O VAL A 67 -6.556 5.770 -2.490 1.00 0.00 O ATOM 996 CB VAL A 67 -5.748 8.451 -1.843 1.00 0.00 C ATOM 997 CG1 VAL A 67 -5.416 8.599 -3.320 1.00 0.00 C ATOM 998 CG2 VAL A 67 -5.561 9.771 -1.111 1.00 0.00 C ATOM 0 H VAL A 67 -7.063 6.804 0.100 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.886 8.705 -1.988 1.00 0.00 H new ATOM 0 HB VAL A 67 -5.061 7.722 -1.412 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -4.395 8.965 -3.429 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -5.509 7.631 -3.813 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -6.106 9.307 -3.779 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.538 10.122 -1.249 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -6.255 10.510 -1.510 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -5.755 9.628 -0.048 1.00 0.00 H new ATOM 1008 N ARG A 68 -8.470 6.656 -3.276 1.00 0.00 N ATOM 1009 CA ARG A 68 -8.769 5.520 -4.139 1.00 0.00 C ATOM 1010 C ARG A 68 -8.116 5.689 -5.508 1.00 0.00 C ATOM 1011 O ARG A 68 -8.086 6.789 -6.060 1.00 0.00 O ATOM 1012 CB ARG A 68 -10.283 5.360 -4.300 1.00 0.00 C ATOM 1013 CG ARG A 68 -10.989 4.928 -3.026 1.00 0.00 C ATOM 1014 CD ARG A 68 -12.495 5.106 -3.135 1.00 0.00 C ATOM 1015 NE ARG A 68 -13.154 5.004 -1.836 1.00 0.00 N ATOM 1016 CZ ARG A 68 -14.459 4.805 -1.688 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -15.241 4.689 -2.753 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -14.985 4.722 -0.473 1.00 0.00 N ATOM 0 H ARG A 68 -9.161 7.405 -3.311 1.00 0.00 H new ATOM 0 HA ARG A 68 -8.363 4.623 -3.671 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -10.706 6.307 -4.636 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -10.481 4.627 -5.082 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -10.759 3.883 -2.818 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -10.613 5.510 -2.185 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -12.714 6.078 -3.577 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -12.901 4.351 -3.808 1.00 0.00 H new ATOM 0 HE ARG A 68 -12.581 5.090 -0.997 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -14.841 4.753 -3.689 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -16.243 4.536 -2.636 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -14.387 4.811 0.349 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -15.987 4.569 -0.360 1.00 0.00 H new ATOM 1032 N SER A 69 -7.595 4.592 -6.048 1.00 0.00 N ATOM 1033 CA SER A 69 -6.938 4.620 -7.349 1.00 0.00 C ATOM 1034 C SER A 69 -7.947 4.398 -8.472 1.00 0.00 C ATOM 1035 O SER A 69 -9.128 4.156 -8.222 1.00 0.00 O ATOM 1036 CB SER A 69 -5.843 3.555 -7.415 1.00 0.00 C ATOM 1037 OG SER A 69 -4.938 3.817 -8.474 1.00 0.00 O ATOM 0 H SER A 69 -7.615 3.673 -5.605 1.00 0.00 H new ATOM 0 HA SER A 69 -6.486 5.603 -7.478 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.302 3.526 -6.469 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.295 2.573 -7.554 1.00 0.00 H new ATOM 0 HG SER A 69 -4.517 4.691 -8.336 1.00 0.00 H new ATOM 1043 N HIS A 70 -7.473 4.483 -9.711 1.00 0.00 N ATOM 1044 CA HIS A 70 -8.332 4.291 -10.874 1.00 0.00 C ATOM 1045 C HIS A 70 -8.484 2.808 -11.199 1.00 0.00 C ATOM 1046 O HIS A 70 -9.571 2.244 -11.085 1.00 0.00 O ATOM 1047 CB HIS A 70 -7.765 5.036 -12.083 1.00 0.00 C ATOM 1048 CG HIS A 70 -8.615 4.919 -13.310 1.00 0.00 C ATOM 1049 ND1 HIS A 70 -8.350 4.026 -14.327 1.00 0.00 N ATOM 1050 CD2 HIS A 70 -9.732 5.589 -13.681 1.00 0.00 C ATOM 1051 CE1 HIS A 70 -9.265 4.153 -15.271 1.00 0.00 C ATOM 1052 NE2 HIS A 70 -10.117 5.094 -14.903 1.00 0.00 N ATOM 0 H HIS A 70 -6.498 4.684 -9.935 1.00 0.00 H new ATOM 0 HA HIS A 70 -9.316 4.695 -10.638 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -7.651 6.090 -11.829 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -6.769 4.651 -12.303 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -10.228 6.368 -13.120 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -9.309 3.584 -16.188 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -10.928 5.402 -15.439 1.00 0.00 H new ATOM 1061 N GLY A 71 -7.383 2.182 -11.606 1.00 0.00 N ATOM 1062 CA GLY A 71 -7.415 0.771 -11.943 1.00 0.00 C ATOM 1063 C GLY A 71 -6.958 -0.109 -10.796 1.00 0.00 C ATOM 1064 O GLY A 71 -6.795 0.361 -9.670 1.00 0.00 O ATOM 0 H GLY A 71 -6.471 2.627 -11.708 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.429 0.492 -12.230 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -6.778 0.593 -12.810 1.00 0.00 H new ATOM 1068 N VAL A 72 -6.754 -1.392 -11.081 1.00 0.00 N ATOM 1069 CA VAL A 72 -6.315 -2.340 -10.064 1.00 0.00 C ATOM 1070 C VAL A 72 -4.798 -2.315 -9.907 1.00 0.00 C ATOM 1071 O VAL A 72 -4.166 -3.356 -9.736 1.00 0.00 O ATOM 1072 CB VAL A 72 -6.760 -3.775 -10.405 1.00 0.00 C ATOM 1073 CG1 VAL A 72 -8.278 -3.862 -10.466 1.00 0.00 C ATOM 1074 CG2 VAL A 72 -6.140 -4.228 -11.717 1.00 0.00 C ATOM 0 H VAL A 72 -6.886 -1.798 -12.007 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.780 -2.036 -9.126 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.412 -4.442 -9.616 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.575 -4.883 -10.708 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.698 -3.582 -9.500 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.651 -3.184 -11.234 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.465 -5.244 -11.942 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.456 -3.560 -12.518 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.053 -4.205 -11.633 1.00 0.00 H new ATOM 1084 N GLN A 73 -4.223 -1.118 -9.967 1.00 0.00 N ATOM 1085 CA GLN A 73 -2.780 -0.957 -9.832 1.00 0.00 C ATOM 1086 C GLN A 73 -2.381 -0.837 -8.364 1.00 0.00 C ATOM 1087 O GLN A 73 -3.148 -0.338 -7.540 1.00 0.00 O ATOM 1088 CB GLN A 73 -2.309 0.276 -10.603 1.00 0.00 C ATOM 1089 CG GLN A 73 -2.905 1.578 -10.094 1.00 0.00 C ATOM 1090 CD GLN A 73 -3.049 2.621 -11.184 1.00 0.00 C ATOM 1091 OE1 GLN A 73 -2.237 2.684 -12.109 1.00 0.00 O ATOM 1092 NE2 GLN A 73 -4.083 3.447 -11.082 1.00 0.00 N ATOM 0 H GLN A 73 -4.734 -0.246 -10.108 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.300 -1.842 -10.249 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.222 0.337 -10.545 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.566 0.156 -11.655 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -3.883 1.378 -9.656 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.275 1.975 -9.298 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.731 3.359 -10.299 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -4.230 4.170 -11.787 1.00 0.00 H new ATOM 1101 N THR A 74 -1.176 -1.298 -8.043 1.00 0.00 N ATOM 1102 CA THR A 74 -0.677 -1.243 -6.676 1.00 0.00 C ATOM 1103 C THR A 74 0.342 -0.121 -6.507 1.00 0.00 C ATOM 1104 O THR A 74 1.142 -0.131 -5.572 1.00 0.00 O ATOM 1105 CB THR A 74 -0.026 -2.577 -6.262 1.00 0.00 C ATOM 1106 OG1 THR A 74 0.898 -3.005 -7.267 1.00 0.00 O ATOM 1107 CG2 THR A 74 -1.083 -3.651 -6.048 1.00 0.00 C ATOM 0 H THR A 74 -0.528 -1.714 -8.712 1.00 0.00 H new ATOM 0 HA THR A 74 -1.536 -1.050 -6.034 1.00 0.00 H new ATOM 0 HB THR A 74 0.506 -2.420 -5.324 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.717 -3.332 -6.840 1.00 0.00 H new ATOM 0 HG21 THR A 74 -0.600 -4.584 -5.756 1.00 0.00 H new ATOM 0 HG22 THR A 74 -1.768 -3.336 -5.261 1.00 0.00 H new ATOM 0 HG23 THR A 74 -1.639 -3.804 -6.973 1.00 0.00 H new ATOM 1115 N MET A 75 0.306 0.847 -7.418 1.00 0.00 N ATOM 1116 CA MET A 75 1.225 1.978 -7.367 1.00 0.00 C ATOM 1117 C MET A 75 0.473 3.297 -7.512 1.00 0.00 C ATOM 1118 O MET A 75 -0.284 3.490 -8.463 1.00 0.00 O ATOM 1119 CB MET A 75 2.278 1.854 -8.470 1.00 0.00 C ATOM 1120 CG MET A 75 3.557 2.623 -8.176 1.00 0.00 C ATOM 1121 SD MET A 75 4.967 2.012 -9.119 1.00 0.00 S ATOM 1122 CE MET A 75 5.353 3.447 -10.119 1.00 0.00 C ATOM 0 H MET A 75 -0.349 0.870 -8.199 1.00 0.00 H new ATOM 0 HA MET A 75 1.721 1.969 -6.396 1.00 0.00 H new ATOM 0 HB2 MET A 75 2.521 0.801 -8.613 1.00 0.00 H new ATOM 0 HB3 MET A 75 1.855 2.213 -9.408 1.00 0.00 H new ATOM 0 HG2 MET A 75 3.403 3.678 -8.403 1.00 0.00 H new ATOM 0 HG3 MET A 75 3.780 2.556 -7.111 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.442 3.149 -11.164 1.00 0.00 H new ATOM 0 HE2 MET A 75 4.557 4.185 -10.019 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.295 3.881 -9.784 1.00 0.00 H new ATOM 1132 N VAL A 76 0.685 4.201 -6.562 1.00 0.00 N ATOM 1133 CA VAL A 76 0.028 5.502 -6.584 1.00 0.00 C ATOM 1134 C VAL A 76 0.860 6.550 -5.854 1.00 0.00 C ATOM 1135 O VAL A 76 1.600 6.234 -4.924 1.00 0.00 O ATOM 1136 CB VAL A 76 -1.372 5.435 -5.943 1.00 0.00 C ATOM 1137 CG1 VAL A 76 -1.965 6.829 -5.810 1.00 0.00 C ATOM 1138 CG2 VAL A 76 -2.286 4.532 -6.756 1.00 0.00 C ATOM 0 H VAL A 76 1.307 4.056 -5.767 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.073 5.788 -7.631 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.276 5.011 -4.943 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.953 6.762 -5.356 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.318 7.441 -5.182 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.049 7.284 -6.797 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.270 4.496 -6.290 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.378 4.925 -7.769 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.865 3.527 -6.794 1.00 0.00 H new ATOM 1148 N VAL A 77 0.731 7.803 -6.282 1.00 0.00 N ATOM 1149 CA VAL A 77 1.470 8.900 -5.668 1.00 0.00 C ATOM 1150 C VAL A 77 0.553 9.770 -4.814 1.00 0.00 C ATOM 1151 O VAL A 77 -0.568 10.086 -5.213 1.00 0.00 O ATOM 1152 CB VAL A 77 2.152 9.781 -6.731 1.00 0.00 C ATOM 1153 CG1 VAL A 77 1.134 10.686 -7.407 1.00 0.00 C ATOM 1154 CG2 VAL A 77 3.272 10.600 -6.104 1.00 0.00 C ATOM 0 H VAL A 77 0.122 8.083 -7.051 1.00 0.00 H new ATOM 0 HA VAL A 77 2.235 8.451 -5.034 1.00 0.00 H new ATOM 0 HB VAL A 77 2.588 9.133 -7.491 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.634 11.301 -8.155 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.370 10.077 -7.890 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.667 11.329 -6.661 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.744 11.217 -6.869 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.861 11.240 -5.323 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.014 9.930 -5.670 1.00 0.00 H new ATOM 1164 N LEU A 78 1.038 10.154 -3.639 1.00 0.00 N ATOM 1165 CA LEU A 78 0.262 10.988 -2.727 1.00 0.00 C ATOM 1166 C LEU A 78 0.664 12.455 -2.857 1.00 0.00 C ATOM 1167 O LEU A 78 1.802 12.768 -3.203 1.00 0.00 O ATOM 1168 CB LEU A 78 0.457 10.521 -1.284 1.00 0.00 C ATOM 1169 CG LEU A 78 -0.101 9.138 -0.946 1.00 0.00 C ATOM 1170 CD1 LEU A 78 0.403 8.677 0.413 1.00 0.00 C ATOM 1171 CD2 LEU A 78 -1.622 9.155 -0.975 1.00 0.00 C ATOM 0 H LEU A 78 1.964 9.902 -3.295 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.791 10.892 -2.993 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.524 10.524 -1.063 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.008 11.251 -0.621 1.00 0.00 H new ATOM 0 HG LEU A 78 0.249 8.432 -1.699 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.004 7.691 0.637 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.492 8.625 0.399 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.083 9.384 1.179 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.002 8.163 -0.732 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.992 9.874 -0.244 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.964 9.441 -1.970 1.00 0.00 H new ATOM 1183 N ASN A 79 -0.279 13.348 -2.575 1.00 0.00 N ATOM 1184 CA ASN A 79 -0.023 14.782 -2.658 1.00 0.00 C ATOM 1185 C ASN A 79 -0.687 15.521 -1.501 1.00 0.00 C ATOM 1186 O ASN A 79 -1.485 14.948 -0.761 1.00 0.00 O ATOM 1187 CB ASN A 79 -0.531 15.335 -3.991 1.00 0.00 C ATOM 1188 CG ASN A 79 -0.472 14.307 -5.104 1.00 0.00 C ATOM 1189 OD1 ASN A 79 0.291 14.454 -6.059 1.00 0.00 O ATOM 1190 ND2 ASN A 79 -1.279 13.260 -4.986 1.00 0.00 N ATOM 0 H ASN A 79 -1.227 13.105 -2.287 1.00 0.00 H new ATOM 0 HA ASN A 79 1.054 14.938 -2.594 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -1.559 15.678 -3.871 1.00 0.00 H new ATOM 0 HB3 ASN A 79 0.064 16.204 -4.271 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -1.283 12.536 -5.704 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.895 13.179 -4.177 1.00 0.00 H new ATOM 1197 N ASN A 80 -0.351 16.798 -1.350 1.00 0.00 N ATOM 1198 CA ASN A 80 -0.914 17.617 -0.283 1.00 0.00 C ATOM 1199 C ASN A 80 -0.304 17.247 1.066 1.00 0.00 C ATOM 1200 O ASN A 80 -1.017 17.071 2.054 1.00 0.00 O ATOM 1201 CB ASN A 80 -2.433 17.448 -0.232 1.00 0.00 C ATOM 1202 CG ASN A 80 -3.136 18.695 0.272 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -2.672 19.348 1.207 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -4.262 19.030 -0.348 1.00 0.00 N ATOM 0 H ASN A 80 0.309 17.288 -1.954 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.677 18.660 -0.495 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.802 17.203 -1.228 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -2.681 16.607 0.416 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -4.779 19.858 -0.054 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -4.609 18.459 -1.119 1.00 0.00 H new ATOM 1211 N LEU A 81 1.020 17.131 1.098 1.00 0.00 N ATOM 1212 CA LEU A 81 1.727 16.783 2.326 1.00 0.00 C ATOM 1213 C LEU A 81 2.771 17.841 2.672 1.00 0.00 C ATOM 1214 O LEU A 81 3.349 18.468 1.786 1.00 0.00 O ATOM 1215 CB LEU A 81 2.399 15.416 2.181 1.00 0.00 C ATOM 1216 CG LEU A 81 1.594 14.348 1.438 1.00 0.00 C ATOM 1217 CD1 LEU A 81 2.490 13.185 1.042 1.00 0.00 C ATOM 1218 CD2 LEU A 81 0.433 13.864 2.293 1.00 0.00 C ATOM 0 H LEU A 81 1.624 17.273 0.289 1.00 0.00 H new ATOM 0 HA LEU A 81 0.998 16.739 3.136 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.348 15.553 1.663 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.631 15.040 3.177 1.00 0.00 H new ATOM 0 HG LEU A 81 1.188 14.792 0.529 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.901 12.435 0.515 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.286 13.545 0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 81 2.926 12.741 1.937 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -0.128 13.105 1.748 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.817 13.437 3.219 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.223 14.703 2.525 1.00 0.00 H new ATOM 1230 N GLU A 82 3.006 18.030 3.966 1.00 0.00 N ATOM 1231 CA GLU A 82 3.981 19.011 4.428 1.00 0.00 C ATOM 1232 C GLU A 82 5.366 18.384 4.556 1.00 0.00 C ATOM 1233 O GLU A 82 5.517 17.224 4.942 1.00 0.00 O ATOM 1234 CB GLU A 82 3.550 19.597 5.775 1.00 0.00 C ATOM 1235 CG GLU A 82 2.148 20.183 5.761 1.00 0.00 C ATOM 1236 CD GLU A 82 1.794 20.879 7.061 1.00 0.00 C ATOM 1237 OE1 GLU A 82 2.676 21.555 7.631 1.00 0.00 O ATOM 1238 OE2 GLU A 82 0.635 20.748 7.508 1.00 0.00 O ATOM 0 H GLU A 82 2.536 17.518 4.712 1.00 0.00 H new ATOM 0 HA GLU A 82 4.029 19.811 3.689 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.602 18.817 6.535 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.257 20.374 6.067 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.063 20.893 4.938 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.428 19.387 5.571 1.00 0.00 H new ATOM 1245 N PRO A 83 6.403 19.165 4.221 1.00 0.00 N ATOM 1246 CA PRO A 83 7.795 18.708 4.289 1.00 0.00 C ATOM 1247 C PRO A 83 8.273 18.520 5.725 1.00 0.00 C ATOM 1248 O PRO A 83 7.676 19.047 6.663 1.00 0.00 O ATOM 1249 CB PRO A 83 8.573 19.838 3.611 1.00 0.00 C ATOM 1250 CG PRO A 83 7.719 21.046 3.787 1.00 0.00 C ATOM 1251 CD PRO A 83 6.297 20.558 3.752 1.00 0.00 C ATOM 0 HA PRO A 83 7.929 17.736 3.815 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.552 19.975 4.070 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.743 19.624 2.556 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.937 21.544 4.732 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.902 21.772 2.995 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.652 21.152 4.400 1.00 0.00 H new ATOM 0 HD3 PRO A 83 5.878 20.613 2.747 1.00 0.00 H new ATOM 1259 N ASN A 84 9.354 17.764 5.890 1.00 0.00 N ATOM 1260 CA ASN A 84 9.912 17.506 7.212 1.00 0.00 C ATOM 1261 C ASN A 84 8.834 17.015 8.171 1.00 0.00 C ATOM 1262 O ASN A 84 8.843 17.348 9.357 1.00 0.00 O ATOM 1263 CB ASN A 84 10.568 18.772 7.767 1.00 0.00 C ATOM 1264 CG ASN A 84 11.447 18.489 8.971 1.00 0.00 C ATOM 1265 OD1 ASN A 84 11.255 17.495 9.672 1.00 0.00 O ATOM 1266 ND2 ASN A 84 12.416 19.364 9.214 1.00 0.00 N ATOM 0 H ASN A 84 9.861 17.320 5.124 1.00 0.00 H new ATOM 0 HA ASN A 84 10.668 16.726 7.115 1.00 0.00 H new ATOM 0 HB2 ASN A 84 11.167 19.240 6.986 1.00 0.00 H new ATOM 0 HB3 ASN A 84 9.794 19.487 8.046 1.00 0.00 H new ATOM 0 HD21 ASN A 84 13.039 19.227 10.010 1.00 0.00 H new ATOM 0 HD22 ASN A 84 12.537 20.173 8.605 1.00 0.00 H new ATOM 1273 N THR A 85 7.903 16.221 7.651 1.00 0.00 N ATOM 1274 CA THR A 85 6.817 15.684 8.461 1.00 0.00 C ATOM 1275 C THR A 85 6.683 14.177 8.271 1.00 0.00 C ATOM 1276 O THR A 85 7.102 13.629 7.250 1.00 0.00 O ATOM 1277 CB THR A 85 5.475 16.355 8.115 1.00 0.00 C ATOM 1278 OG1 THR A 85 5.539 17.756 8.402 1.00 0.00 O ATOM 1279 CG2 THR A 85 4.336 15.723 8.902 1.00 0.00 C ATOM 0 H THR A 85 7.880 15.936 6.672 1.00 0.00 H new ATOM 0 HA THR A 85 7.063 15.896 9.502 1.00 0.00 H new ATOM 0 HB THR A 85 5.286 16.211 7.051 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.228 18.173 7.844 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.398 16.213 8.641 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.271 14.662 8.660 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.522 15.840 9.970 1.00 0.00 H new ATOM 1287 N THR A 86 6.095 13.511 9.259 1.00 0.00 N ATOM 1288 CA THR A 86 5.905 12.067 9.202 1.00 0.00 C ATOM 1289 C THR A 86 4.429 11.710 9.075 1.00 0.00 C ATOM 1290 O THR A 86 3.591 12.220 9.819 1.00 0.00 O ATOM 1291 CB THR A 86 6.484 11.374 10.449 1.00 0.00 C ATOM 1292 OG1 THR A 86 7.891 11.621 10.539 1.00 0.00 O ATOM 1293 CG2 THR A 86 6.229 9.874 10.403 1.00 0.00 C ATOM 0 H THR A 86 5.742 13.949 10.110 1.00 0.00 H new ATOM 0 HA THR A 86 6.438 11.714 8.319 1.00 0.00 H new ATOM 0 HB THR A 86 5.987 11.784 11.328 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.251 11.178 11.336 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.647 9.406 11.294 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.156 9.688 10.365 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.701 9.452 9.516 1.00 0.00 H new ATOM 1301 N TYR A 87 4.116 10.832 8.129 1.00 0.00 N ATOM 1302 CA TYR A 87 2.739 10.408 7.904 1.00 0.00 C ATOM 1303 C TYR A 87 2.635 8.887 7.874 1.00 0.00 C ATOM 1304 O TYR A 87 3.500 8.206 7.325 1.00 0.00 O ATOM 1305 CB TYR A 87 2.212 10.992 6.592 1.00 0.00 C ATOM 1306 CG TYR A 87 2.447 12.480 6.454 1.00 0.00 C ATOM 1307 CD1 TYR A 87 3.710 12.978 6.158 1.00 0.00 C ATOM 1308 CD2 TYR A 87 1.406 13.386 6.618 1.00 0.00 C ATOM 1309 CE1 TYR A 87 3.930 14.336 6.031 1.00 0.00 C ATOM 1310 CE2 TYR A 87 1.618 14.745 6.492 1.00 0.00 C ATOM 1311 CZ TYR A 87 2.880 15.216 6.198 1.00 0.00 C ATOM 1312 OH TYR A 87 3.095 16.569 6.072 1.00 0.00 O ATOM 0 H TYR A 87 4.797 10.400 7.505 1.00 0.00 H new ATOM 0 HA TYR A 87 2.132 10.779 8.730 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.689 10.478 5.758 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.143 10.793 6.519 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.533 12.292 6.025 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.416 13.022 6.848 1.00 0.00 H new ATOM 0 HE1 TYR A 87 4.918 14.707 5.802 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.798 15.436 6.623 1.00 0.00 H new ATOM 0 HH TYR A 87 3.937 16.723 5.595 1.00 0.00 H new ATOM 1322 N GLU A 88 1.568 8.361 8.469 1.00 0.00 N ATOM 1323 CA GLU A 88 1.350 6.920 8.511 1.00 0.00 C ATOM 1324 C GLU A 88 0.403 6.480 7.398 1.00 0.00 C ATOM 1325 O GLU A 88 -0.735 6.941 7.320 1.00 0.00 O ATOM 1326 CB GLU A 88 0.784 6.507 9.871 1.00 0.00 C ATOM 1327 CG GLU A 88 1.565 7.062 11.049 1.00 0.00 C ATOM 1328 CD GLU A 88 1.110 6.483 12.375 1.00 0.00 C ATOM 1329 OE1 GLU A 88 0.784 5.279 12.417 1.00 0.00 O ATOM 1330 OE2 GLU A 88 1.082 7.235 13.372 1.00 0.00 O ATOM 0 H GLU A 88 0.842 8.911 8.928 1.00 0.00 H new ATOM 0 HA GLU A 88 2.311 6.428 8.361 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.251 6.842 9.941 1.00 0.00 H new ATOM 0 HB3 GLU A 88 0.771 5.419 9.935 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.625 6.851 10.909 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.456 8.146 11.074 1.00 0.00 H new ATOM 1337 N ILE A 89 0.883 5.586 6.540 1.00 0.00 N ATOM 1338 CA ILE A 89 0.080 5.084 5.432 1.00 0.00 C ATOM 1339 C ILE A 89 -0.109 3.574 5.531 1.00 0.00 C ATOM 1340 O ILE A 89 0.796 2.851 5.945 1.00 0.00 O ATOM 1341 CB ILE A 89 0.721 5.422 4.073 1.00 0.00 C ATOM 1342 CG1 ILE A 89 0.215 4.464 2.993 1.00 0.00 C ATOM 1343 CG2 ILE A 89 2.238 5.363 4.174 1.00 0.00 C ATOM 1344 CD1 ILE A 89 0.554 4.904 1.587 1.00 0.00 C ATOM 0 H ILE A 89 1.824 5.195 6.591 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.891 5.575 5.498 1.00 0.00 H new ATOM 0 HB ILE A 89 0.434 6.436 3.795 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.640 3.476 3.168 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.867 4.367 3.083 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.677 5.604 3.206 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.581 6.082 4.917 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.544 4.360 4.471 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.164 4.177 0.874 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.106 5.879 1.393 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.636 4.974 1.479 1.00 0.00 H new ATOM 1356 N ARG A 90 -1.292 3.106 5.145 1.00 0.00 N ATOM 1357 CA ARG A 90 -1.600 1.681 5.189 1.00 0.00 C ATOM 1358 C ARG A 90 -2.292 1.234 3.905 1.00 0.00 C ATOM 1359 O ARG A 90 -3.258 1.855 3.460 1.00 0.00 O ATOM 1360 CB ARG A 90 -2.486 1.366 6.396 1.00 0.00 C ATOM 1361 CG ARG A 90 -3.780 2.164 6.424 1.00 0.00 C ATOM 1362 CD ARG A 90 -4.563 1.909 7.704 1.00 0.00 C ATOM 1363 NE ARG A 90 -5.940 2.386 7.607 1.00 0.00 N ATOM 1364 CZ ARG A 90 -6.722 2.590 8.660 1.00 0.00 C ATOM 1365 NH1 ARG A 90 -6.266 2.362 9.884 1.00 0.00 N ATOM 1366 NH2 ARG A 90 -7.964 3.025 8.491 1.00 0.00 N ATOM 0 H ARG A 90 -2.052 3.692 4.799 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.661 1.135 5.284 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.724 0.302 6.394 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.926 1.565 7.310 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.555 3.227 6.339 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.392 1.898 5.562 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.564 0.841 7.922 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.066 2.404 8.538 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.322 2.573 6.680 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.311 2.029 10.019 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.870 2.520 10.691 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -8.319 3.203 7.551 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.564 3.181 9.301 1.00 0.00 H new ATOM 1380 N VAL A 91 -1.792 0.154 3.314 1.00 0.00 N ATOM 1381 CA VAL A 91 -2.362 -0.376 2.081 1.00 0.00 C ATOM 1382 C VAL A 91 -3.271 -1.567 2.364 1.00 0.00 C ATOM 1383 O VAL A 91 -2.922 -2.457 3.138 1.00 0.00 O ATOM 1384 CB VAL A 91 -1.261 -0.807 1.093 1.00 0.00 C ATOM 1385 CG1 VAL A 91 -1.859 -1.111 -0.272 1.00 0.00 C ATOM 1386 CG2 VAL A 91 -0.190 0.266 0.988 1.00 0.00 C ATOM 0 H VAL A 91 -0.993 -0.371 3.669 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.948 0.426 1.632 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.794 -1.717 1.470 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.067 -1.414 -0.957 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.586 -1.917 -0.179 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.353 -0.220 -0.660 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.579 -0.055 0.286 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.639 1.194 0.635 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.258 0.430 1.968 1.00 0.00 H new ATOM 1396 N ALA A 92 -4.439 -1.577 1.730 1.00 0.00 N ATOM 1397 CA ALA A 92 -5.398 -2.660 1.911 1.00 0.00 C ATOM 1398 C ALA A 92 -6.031 -3.061 0.583 1.00 0.00 C ATOM 1399 O ALA A 92 -6.021 -2.291 -0.377 1.00 0.00 O ATOM 1400 CB ALA A 92 -6.472 -2.251 2.909 1.00 0.00 C ATOM 0 H ALA A 92 -4.744 -0.847 1.086 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.863 -3.525 2.303 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.182 -3.069 3.035 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.009 -2.021 3.869 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.996 -1.370 2.539 1.00 0.00 H new ATOM 1406 N ALA A 93 -6.581 -4.269 0.536 1.00 0.00 N ATOM 1407 CA ALA A 93 -7.220 -4.771 -0.675 1.00 0.00 C ATOM 1408 C ALA A 93 -8.736 -4.818 -0.516 1.00 0.00 C ATOM 1409 O ALA A 93 -9.253 -5.415 0.428 1.00 0.00 O ATOM 1410 CB ALA A 93 -6.681 -6.150 -1.022 1.00 0.00 C ATOM 0 H ALA A 93 -6.597 -4.919 1.322 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.987 -4.086 -1.490 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -7.166 -6.513 -1.928 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -5.605 -6.089 -1.186 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.885 -6.837 -0.201 1.00 0.00 H new ATOM 1416 N VAL A 94 -9.444 -4.183 -1.445 1.00 0.00 N ATOM 1417 CA VAL A 94 -10.901 -4.153 -1.408 1.00 0.00 C ATOM 1418 C VAL A 94 -11.496 -4.903 -2.594 1.00 0.00 C ATOM 1419 O VAL A 94 -11.254 -4.554 -3.748 1.00 0.00 O ATOM 1420 CB VAL A 94 -11.432 -2.707 -1.410 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -12.931 -2.689 -1.671 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -11.104 -2.017 -0.095 1.00 0.00 C ATOM 0 H VAL A 94 -9.032 -3.682 -2.232 1.00 0.00 H new ATOM 0 HA VAL A 94 -11.205 -4.643 -0.483 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.940 -2.159 -2.214 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -13.288 -1.659 -1.669 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.137 -3.142 -2.641 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.443 -3.252 -0.891 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.487 -0.997 -0.114 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -11.567 -2.563 0.727 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.023 -1.997 0.046 1.00 0.00 H new ATOM 1432 N ASN A 95 -12.277 -5.938 -2.301 1.00 0.00 N ATOM 1433 CA ASN A 95 -12.907 -6.740 -3.343 1.00 0.00 C ATOM 1434 C ASN A 95 -14.424 -6.751 -3.177 1.00 0.00 C ATOM 1435 O ASN A 95 -14.964 -6.135 -2.259 1.00 0.00 O ATOM 1436 CB ASN A 95 -12.368 -8.171 -3.312 1.00 0.00 C ATOM 1437 CG ASN A 95 -13.008 -9.006 -2.220 1.00 0.00 C ATOM 1438 OD1 ASN A 95 -13.772 -8.496 -1.401 1.00 0.00 O ATOM 1439 ND2 ASN A 95 -12.696 -10.297 -2.203 1.00 0.00 N ATOM 0 H ASN A 95 -12.489 -6.241 -1.350 1.00 0.00 H new ATOM 0 HA ASN A 95 -12.668 -6.291 -4.307 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -12.545 -8.644 -4.278 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -11.289 -8.147 -3.162 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -13.095 -10.909 -1.491 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -12.058 -10.677 -2.902 1.00 0.00 H new ATOM 1446 N GLY A 96 -15.106 -7.461 -4.072 1.00 0.00 N ATOM 1447 CA GLY A 96 -16.554 -7.541 -4.007 1.00 0.00 C ATOM 1448 C GLY A 96 -17.063 -7.687 -2.586 1.00 0.00 C ATOM 1449 O GLY A 96 -18.026 -7.027 -2.193 1.00 0.00 O ATOM 0 H GLY A 96 -14.682 -7.981 -4.840 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -16.985 -6.645 -4.454 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -16.895 -8.389 -4.601 1.00 0.00 H new ATOM 1453 N LYS A 97 -16.418 -8.554 -1.814 1.00 0.00 N ATOM 1454 CA LYS A 97 -16.810 -8.785 -0.429 1.00 0.00 C ATOM 1455 C LYS A 97 -16.716 -7.499 0.385 1.00 0.00 C ATOM 1456 O LYS A 97 -17.692 -7.069 0.998 1.00 0.00 O ATOM 1457 CB LYS A 97 -15.926 -9.866 0.199 1.00 0.00 C ATOM 1458 CG LYS A 97 -15.867 -11.150 -0.609 1.00 0.00 C ATOM 1459 CD LYS A 97 -17.025 -12.075 -0.273 1.00 0.00 C ATOM 1460 CE LYS A 97 -18.307 -11.638 -0.962 1.00 0.00 C ATOM 1461 NZ LYS A 97 -19.250 -12.775 -1.153 1.00 0.00 N ATOM 0 H LYS A 97 -15.620 -9.109 -2.124 1.00 0.00 H new ATOM 0 HA LYS A 97 -17.846 -9.123 -0.422 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -14.916 -9.474 0.316 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -16.298 -10.092 1.198 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -15.887 -10.913 -1.673 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -14.924 -11.661 -0.414 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -16.778 -13.093 -0.574 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -17.178 -12.090 0.806 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -18.791 -10.861 -0.370 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -18.067 -11.199 -1.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -20.112 -12.436 -1.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -18.798 -13.506 -1.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -19.499 -13.179 -0.227 1.00 0.00 H new ATOM 1475 N GLY A 98 -15.535 -6.889 0.386 1.00 0.00 N ATOM 1476 CA GLY A 98 -15.337 -5.658 1.127 1.00 0.00 C ATOM 1477 C GLY A 98 -13.872 -5.371 1.394 1.00 0.00 C ATOM 1478 O GLY A 98 -13.013 -5.684 0.572 1.00 0.00 O ATOM 0 H GLY A 98 -14.712 -7.226 -0.113 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -15.771 -4.828 0.569 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -15.871 -5.718 2.075 1.00 0.00 H new ATOM 1482 N GLN A 99 -13.589 -4.773 2.547 1.00 0.00 N ATOM 1483 CA GLN A 99 -12.217 -4.443 2.919 1.00 0.00 C ATOM 1484 C GLN A 99 -11.668 -5.451 3.923 1.00 0.00 C ATOM 1485 O GLN A 99 -12.062 -5.458 5.089 1.00 0.00 O ATOM 1486 CB GLN A 99 -12.152 -3.032 3.506 1.00 0.00 C ATOM 1487 CG GLN A 99 -10.741 -2.475 3.597 1.00 0.00 C ATOM 1488 CD GLN A 99 -10.716 -1.004 3.960 1.00 0.00 C ATOM 1489 OE1 GLN A 99 -11.572 -0.521 4.701 1.00 0.00 O ATOM 1490 NE2 GLN A 99 -9.731 -0.281 3.439 1.00 0.00 N ATOM 0 H GLN A 99 -14.290 -4.507 3.239 1.00 0.00 H new ATOM 0 HA GLN A 99 -11.603 -4.483 2.020 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -12.758 -2.365 2.894 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -12.595 -3.041 4.502 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -10.180 -3.039 4.342 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.236 -2.618 2.642 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -9.042 -0.722 2.829 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.663 0.715 3.649 1.00 0.00 H new ATOM 1499 N GLY A 100 -10.756 -6.301 3.462 1.00 0.00 N ATOM 1500 CA GLY A 100 -10.167 -7.302 4.332 1.00 0.00 C ATOM 1501 C GLY A 100 -9.429 -6.688 5.505 1.00 0.00 C ATOM 1502 O GLY A 100 -10.043 -6.096 6.393 1.00 0.00 O ATOM 0 H GLY A 100 -10.414 -6.314 2.501 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.951 -7.962 4.705 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.478 -7.920 3.756 1.00 0.00 H new ATOM 1506 N ASP A 101 -8.108 -6.831 5.510 1.00 0.00 N ATOM 1507 CA ASP A 101 -7.284 -6.286 6.583 1.00 0.00 C ATOM 1508 C ASP A 101 -6.341 -5.211 6.052 1.00 0.00 C ATOM 1509 O ASP A 101 -6.069 -5.147 4.854 1.00 0.00 O ATOM 1510 CB ASP A 101 -6.481 -7.401 7.254 1.00 0.00 C ATOM 1511 CG ASP A 101 -6.106 -7.064 8.685 1.00 0.00 C ATOM 1512 OD1 ASP A 101 -5.064 -6.408 8.886 1.00 0.00 O ATOM 1513 OD2 ASP A 101 -6.856 -7.459 9.603 1.00 0.00 O ATOM 0 H ASP A 101 -7.585 -7.320 4.783 1.00 0.00 H new ATOM 0 HA ASP A 101 -7.945 -5.831 7.320 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -7.063 -8.322 7.241 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.575 -7.589 6.679 1.00 0.00 H new ATOM 1518 N TYR A 102 -5.847 -4.367 6.952 1.00 0.00 N ATOM 1519 CA TYR A 102 -4.938 -3.293 6.574 1.00 0.00 C ATOM 1520 C TYR A 102 -3.484 -3.729 6.730 1.00 0.00 C ATOM 1521 O TYR A 102 -3.081 -4.219 7.785 1.00 0.00 O ATOM 1522 CB TYR A 102 -5.203 -2.049 7.424 1.00 0.00 C ATOM 1523 CG TYR A 102 -6.402 -1.249 6.970 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -6.331 -0.428 5.852 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -7.607 -1.315 7.658 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -7.424 0.306 5.433 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -8.706 -0.587 7.246 1.00 0.00 C ATOM 1528 CZ TYR A 102 -8.610 0.223 6.133 1.00 0.00 C ATOM 1529 OH TYR A 102 -9.702 0.952 5.718 1.00 0.00 O ATOM 0 H TYR A 102 -6.061 -4.407 7.948 1.00 0.00 H new ATOM 0 HA TYR A 102 -5.116 -3.053 5.526 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -5.351 -2.352 8.460 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -4.321 -1.409 7.402 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -5.405 -0.362 5.300 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.686 -1.947 8.530 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -7.350 0.941 4.563 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -9.636 -0.651 7.792 1.00 0.00 H new ATOM 0 HH TYR A 102 -10.514 0.414 5.825 1.00 0.00 H new ATOM 1539 N SER A 103 -2.702 -3.547 5.671 1.00 0.00 N ATOM 1540 CA SER A 103 -1.293 -3.923 5.688 1.00 0.00 C ATOM 1541 C SER A 103 -0.571 -3.275 6.864 1.00 0.00 C ATOM 1542 O SER A 103 -1.026 -2.269 7.409 1.00 0.00 O ATOM 1543 CB SER A 103 -0.620 -3.519 4.375 1.00 0.00 C ATOM 1544 OG SER A 103 -0.720 -2.122 4.160 1.00 0.00 O ATOM 0 H SER A 103 -3.020 -3.142 4.791 1.00 0.00 H new ATOM 0 HA SER A 103 -1.233 -5.005 5.801 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.429 -3.813 4.395 1.00 0.00 H new ATOM 0 HB3 SER A 103 -1.085 -4.052 3.545 1.00 0.00 H new ATOM 0 HG SER A 103 -1.661 -1.851 4.204 1.00 0.00 H new ATOM 1550 N LYS A 104 0.558 -3.859 7.251 1.00 0.00 N ATOM 1551 CA LYS A 104 1.347 -3.338 8.362 1.00 0.00 C ATOM 1552 C LYS A 104 1.541 -1.831 8.233 1.00 0.00 C ATOM 1553 O LYS A 104 2.247 -1.361 7.341 1.00 0.00 O ATOM 1554 CB LYS A 104 2.708 -4.036 8.419 1.00 0.00 C ATOM 1555 CG LYS A 104 3.368 -3.971 9.786 1.00 0.00 C ATOM 1556 CD LYS A 104 4.229 -2.729 9.930 1.00 0.00 C ATOM 1557 CE LYS A 104 5.669 -2.998 9.521 1.00 0.00 C ATOM 1558 NZ LYS A 104 5.896 -2.718 8.076 1.00 0.00 N ATOM 0 H LYS A 104 0.947 -4.693 6.812 1.00 0.00 H new ATOM 0 HA LYS A 104 0.804 -3.538 9.286 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.583 -5.081 8.134 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.371 -3.582 7.683 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.602 -3.976 10.562 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.981 -4.859 9.938 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.819 -1.928 9.316 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.202 -2.384 10.964 1.00 0.00 H new ATOM 0 HE2 LYS A 104 6.338 -2.381 10.120 1.00 0.00 H new ATOM 0 HE3 LYS A 104 5.919 -4.038 9.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 6.917 -2.648 7.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 5.494 -3.489 7.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 5.436 -1.821 7.820 1.00 0.00 H new ATOM 1572 N ILE A 105 0.912 -1.079 9.130 1.00 0.00 N ATOM 1573 CA ILE A 105 1.019 0.375 9.118 1.00 0.00 C ATOM 1574 C ILE A 105 2.417 0.820 8.701 1.00 0.00 C ATOM 1575 O ILE A 105 3.412 0.401 9.290 1.00 0.00 O ATOM 1576 CB ILE A 105 0.690 0.975 10.497 1.00 0.00 C ATOM 1577 CG1 ILE A 105 -0.748 0.637 10.895 1.00 0.00 C ATOM 1578 CG2 ILE A 105 0.900 2.482 10.481 1.00 0.00 C ATOM 1579 CD1 ILE A 105 -1.789 1.282 10.008 1.00 0.00 C ATOM 0 H ILE A 105 0.323 -1.452 9.874 1.00 0.00 H new ATOM 0 HA ILE A 105 0.293 0.739 8.391 1.00 0.00 H new ATOM 0 HB ILE A 105 1.363 0.541 11.236 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.879 -0.445 10.867 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.915 0.952 11.925 1.00 0.00 H new ATOM 0 HG21 ILE A 105 0.664 2.893 11.463 1.00 0.00 H new ATOM 0 HG22 ILE A 105 1.939 2.702 10.236 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.248 2.932 9.733 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.784 0.998 10.349 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.685 2.366 10.054 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.649 0.947 8.980 1.00 0.00 H new ATOM 1591 N GLU A 106 2.482 1.673 7.684 1.00 0.00 N ATOM 1592 CA GLU A 106 3.759 2.176 7.191 1.00 0.00 C ATOM 1593 C GLU A 106 3.978 3.623 7.622 1.00 0.00 C ATOM 1594 O GLU A 106 3.037 4.416 7.671 1.00 0.00 O ATOM 1595 CB GLU A 106 3.817 2.073 5.665 1.00 0.00 C ATOM 1596 CG GLU A 106 3.867 0.643 5.153 1.00 0.00 C ATOM 1597 CD GLU A 106 5.236 0.011 5.318 1.00 0.00 C ATOM 1598 OE1 GLU A 106 5.615 -0.292 6.468 1.00 0.00 O ATOM 1599 OE2 GLU A 106 5.927 -0.181 4.295 1.00 0.00 O ATOM 0 H GLU A 106 1.667 2.030 7.186 1.00 0.00 H new ATOM 0 HA GLU A 106 4.552 1.564 7.621 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.945 2.571 5.242 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.695 2.609 5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 106 3.128 0.044 5.686 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.589 0.629 4.099 1.00 0.00 H new ATOM 1606 N ILE A 107 5.225 3.958 7.934 1.00 0.00 N ATOM 1607 CA ILE A 107 5.567 5.310 8.361 1.00 0.00 C ATOM 1608 C ILE A 107 6.662 5.903 7.482 1.00 0.00 C ATOM 1609 O ILE A 107 7.793 5.417 7.467 1.00 0.00 O ATOM 1610 CB ILE A 107 6.031 5.335 9.829 1.00 0.00 C ATOM 1611 CG1 ILE A 107 4.960 4.728 10.737 1.00 0.00 C ATOM 1612 CG2 ILE A 107 6.354 6.759 10.258 1.00 0.00 C ATOM 1613 CD1 ILE A 107 5.440 4.472 12.149 1.00 0.00 C ATOM 0 H ILE A 107 6.015 3.313 7.899 1.00 0.00 H new ATOM 0 HA ILE A 107 4.663 5.911 8.264 1.00 0.00 H new ATOM 0 HB ILE A 107 6.937 4.735 9.918 1.00 0.00 H new ATOM 0 HG12 ILE A 107 4.101 5.398 10.770 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.616 3.789 10.303 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.681 6.760 11.298 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.149 7.158 9.628 1.00 0.00 H new ATOM 0 HG23 ILE A 107 5.464 7.380 10.156 1.00 0.00 H new ATOM 0 HD11 ILE A 107 4.629 4.041 12.737 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.280 3.778 12.127 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.757 5.412 12.602 1.00 0.00 H new ATOM 1625 N PHE A 108 6.319 6.958 6.751 1.00 0.00 N ATOM 1626 CA PHE A 108 7.274 7.620 5.868 1.00 0.00 C ATOM 1627 C PHE A 108 7.350 9.113 6.172 1.00 0.00 C ATOM 1628 O PHE A 108 6.326 9.776 6.341 1.00 0.00 O ATOM 1629 CB PHE A 108 6.882 7.405 4.405 1.00 0.00 C ATOM 1630 CG PHE A 108 5.653 8.166 3.995 1.00 0.00 C ATOM 1631 CD1 PHE A 108 5.685 9.545 3.876 1.00 0.00 C ATOM 1632 CD2 PHE A 108 4.467 7.501 3.730 1.00 0.00 C ATOM 1633 CE1 PHE A 108 4.557 10.249 3.498 1.00 0.00 C ATOM 1634 CE2 PHE A 108 3.336 8.199 3.353 1.00 0.00 C ATOM 1635 CZ PHE A 108 3.380 9.575 3.237 1.00 0.00 C ATOM 0 H PHE A 108 5.387 7.373 6.752 1.00 0.00 H new ATOM 0 HA PHE A 108 8.257 7.181 6.042 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.714 7.703 3.767 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.715 6.341 4.235 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.602 10.077 4.081 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.426 6.425 3.819 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.596 11.324 3.407 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.417 7.669 3.149 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.496 10.122 2.943 1.00 0.00 H new ATOM 1645 N GLN A 109 8.570 9.636 6.240 1.00 0.00 N ATOM 1646 CA GLN A 109 8.780 11.050 6.524 1.00 0.00 C ATOM 1647 C GLN A 109 9.226 11.797 5.272 1.00 0.00 C ATOM 1648 O GLN A 109 10.271 11.494 4.694 1.00 0.00 O ATOM 1649 CB GLN A 109 9.822 11.220 7.632 1.00 0.00 C ATOM 1650 CG GLN A 109 10.244 12.664 7.854 1.00 0.00 C ATOM 1651 CD GLN A 109 11.486 12.783 8.716 1.00 0.00 C ATOM 1652 OE1 GLN A 109 12.410 11.979 8.607 1.00 0.00 O ATOM 1653 NE2 GLN A 109 11.511 13.791 9.579 1.00 0.00 N ATOM 0 H GLN A 109 9.428 9.101 6.102 1.00 0.00 H new ATOM 0 HA GLN A 109 7.832 11.472 6.858 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.419 10.821 8.563 1.00 0.00 H new ATOM 0 HB3 GLN A 109 10.702 10.627 7.385 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.429 13.137 6.890 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.426 13.209 8.325 1.00 0.00 H new ATOM 0 HE21 GLN A 109 10.721 14.434 9.635 1.00 0.00 H new ATOM 0 HE22 GLN A 109 12.320 13.923 10.186 1.00 0.00 H new ATOM 1662 N THR A 110 8.427 12.775 4.855 1.00 0.00 N ATOM 1663 CA THR A 110 8.739 13.565 3.670 1.00 0.00 C ATOM 1664 C THR A 110 10.121 14.197 3.779 1.00 0.00 C ATOM 1665 O THR A 110 10.680 14.311 4.871 1.00 0.00 O ATOM 1666 CB THR A 110 7.695 14.675 3.445 1.00 0.00 C ATOM 1667 OG1 THR A 110 7.658 15.550 4.577 1.00 0.00 O ATOM 1668 CG2 THR A 110 6.315 14.079 3.212 1.00 0.00 C ATOM 0 H THR A 110 7.559 13.039 5.321 1.00 0.00 H new ATOM 0 HA THR A 110 8.721 12.882 2.821 1.00 0.00 H new ATOM 0 HB THR A 110 7.983 15.241 2.559 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.804 16.030 4.591 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.594 14.881 3.056 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.340 13.437 2.332 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.021 13.491 4.082 1.00 0.00 H new ATOM 1676 N LEU A 111 10.669 14.608 2.641 1.00 0.00 N ATOM 1677 CA LEU A 111 11.988 15.231 2.608 1.00 0.00 C ATOM 1678 C LEU A 111 11.903 16.705 2.990 1.00 0.00 C ATOM 1679 O LEU A 111 10.963 17.413 2.629 1.00 0.00 O ATOM 1680 CB LEU A 111 12.607 15.088 1.216 1.00 0.00 C ATOM 1681 CG LEU A 111 12.890 13.659 0.752 1.00 0.00 C ATOM 1682 CD1 LEU A 111 13.350 13.650 -0.698 1.00 0.00 C ATOM 1683 CD2 LEU A 111 13.931 13.003 1.649 1.00 0.00 C ATOM 0 H LEU A 111 10.221 14.521 1.729 1.00 0.00 H new ATOM 0 HA LEU A 111 12.621 14.722 3.334 1.00 0.00 H new ATOM 0 HB2 LEU A 111 11.940 15.558 0.493 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.543 15.647 1.197 1.00 0.00 H new ATOM 0 HG LEU A 111 11.966 13.085 0.822 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.547 12.625 -1.011 1.00 0.00 H new ATOM 0 HD12 LEU A 111 12.572 14.079 -1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 111 14.262 14.240 -0.794 1.00 0.00 H new ATOM 0 HD21 LEU A 111 14.120 11.986 1.304 1.00 0.00 H new ATOM 0 HD22 LEU A 111 14.857 13.577 1.612 1.00 0.00 H new ATOM 0 HD23 LEU A 111 13.562 12.975 2.674 1.00 0.00 H new ATOM 1695 N PRO A 112 12.911 17.183 3.737 1.00 0.00 N ATOM 1696 CA PRO A 112 12.975 18.578 4.181 1.00 0.00 C ATOM 1697 C PRO A 112 13.241 19.542 3.030 1.00 0.00 C ATOM 1698 O PRO A 112 14.278 19.465 2.370 1.00 0.00 O ATOM 1699 CB PRO A 112 14.147 18.583 5.165 1.00 0.00 C ATOM 1700 CG PRO A 112 15.004 17.442 4.740 1.00 0.00 C ATOM 1701 CD PRO A 112 14.065 16.397 4.203 1.00 0.00 C ATOM 0 HA PRO A 112 12.033 18.911 4.617 1.00 0.00 H new ATOM 0 HB2 PRO A 112 14.694 19.525 5.125 1.00 0.00 H new ATOM 0 HB3 PRO A 112 13.802 18.458 6.192 1.00 0.00 H new ATOM 0 HG2 PRO A 112 15.719 17.753 3.978 1.00 0.00 H new ATOM 0 HG3 PRO A 112 15.581 17.054 5.579 1.00 0.00 H new ATOM 0 HD2 PRO A 112 14.518 15.829 3.391 1.00 0.00 H new ATOM 0 HD3 PRO A 112 13.779 15.680 4.973 1.00 0.00 H new ATOM 1709 N VAL A 113 12.300 20.450 2.794 1.00 0.00 N ATOM 1710 CA VAL A 113 12.434 21.431 1.723 1.00 0.00 C ATOM 1711 C VAL A 113 13.889 21.847 1.539 1.00 0.00 C ATOM 1712 O VAL A 113 14.562 22.228 2.496 1.00 0.00 O ATOM 1713 CB VAL A 113 11.584 22.684 2.000 1.00 0.00 C ATOM 1714 CG1 VAL A 113 11.770 23.712 0.894 1.00 0.00 C ATOM 1715 CG2 VAL A 113 10.117 22.311 2.150 1.00 0.00 C ATOM 0 H VAL A 113 11.436 20.527 3.330 1.00 0.00 H new ATOM 0 HA VAL A 113 12.077 20.954 0.810 1.00 0.00 H new ATOM 0 HB VAL A 113 11.920 23.129 2.937 1.00 0.00 H new ATOM 0 HG11 VAL A 113 11.161 24.590 1.108 1.00 0.00 H new ATOM 0 HG12 VAL A 113 12.819 24.002 0.840 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.463 23.281 -0.059 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.531 23.209 2.345 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.765 21.841 1.231 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.002 21.615 2.981 1.00 0.00 H new ATOM 1725 N SER A 114 14.368 21.771 0.302 1.00 0.00 N ATOM 1726 CA SER A 114 15.745 22.138 -0.009 1.00 0.00 C ATOM 1727 C SER A 114 15.788 23.308 -0.986 1.00 0.00 C ATOM 1728 O SER A 114 14.920 23.447 -1.845 1.00 0.00 O ATOM 1729 CB SER A 114 16.493 20.940 -0.597 1.00 0.00 C ATOM 1730 OG SER A 114 17.886 21.193 -0.668 1.00 0.00 O ATOM 0 H SER A 114 13.823 21.459 -0.502 1.00 0.00 H new ATOM 0 HA SER A 114 16.232 22.443 0.917 1.00 0.00 H new ATOM 0 HB2 SER A 114 16.311 20.057 0.016 1.00 0.00 H new ATOM 0 HB3 SER A 114 16.109 20.721 -1.593 1.00 0.00 H new ATOM 0 HG SER A 114 18.342 20.412 -1.045 1.00 0.00 H new ATOM 1736 N GLY A 115 16.809 24.149 -0.848 1.00 0.00 N ATOM 1737 CA GLY A 115 16.949 25.297 -1.725 1.00 0.00 C ATOM 1738 C GLY A 115 18.395 25.587 -2.074 1.00 0.00 C ATOM 1739 O GLY A 115 19.323 25.106 -1.422 1.00 0.00 O ATOM 0 H GLY A 115 17.542 24.056 -0.144 1.00 0.00 H new ATOM 0 HA2 GLY A 115 16.386 25.121 -2.641 1.00 0.00 H new ATOM 0 HA3 GLY A 115 16.512 26.172 -1.245 1.00 0.00 H new ATOM 1743 N PRO A 116 18.604 26.388 -3.129 1.00 0.00 N ATOM 1744 CA PRO A 116 19.945 26.759 -3.590 1.00 0.00 C ATOM 1745 C PRO A 116 20.655 27.692 -2.616 1.00 0.00 C ATOM 1746 O PRO A 116 21.862 27.912 -2.720 1.00 0.00 O ATOM 1747 CB PRO A 116 19.680 27.472 -4.918 1.00 0.00 C ATOM 1748 CG PRO A 116 18.290 27.994 -4.796 1.00 0.00 C ATOM 1749 CD PRO A 116 17.545 26.997 -3.953 1.00 0.00 C ATOM 0 HA PRO A 116 20.599 25.892 -3.680 1.00 0.00 H new ATOM 0 HB2 PRO A 116 20.393 28.280 -5.083 1.00 0.00 H new ATOM 0 HB3 PRO A 116 19.773 26.787 -5.761 1.00 0.00 H new ATOM 0 HG2 PRO A 116 18.283 28.980 -4.332 1.00 0.00 H new ATOM 0 HG3 PRO A 116 17.826 28.100 -5.776 1.00 0.00 H new ATOM 0 HD2 PRO A 116 16.785 27.479 -3.338 1.00 0.00 H new ATOM 0 HD3 PRO A 116 17.035 26.254 -4.566 1.00 0.00 H new ATOM 1757 N SER A 117 19.899 28.239 -1.669 1.00 0.00 N ATOM 1758 CA SER A 117 20.456 29.151 -0.678 1.00 0.00 C ATOM 1759 C SER A 117 21.869 28.729 -0.284 1.00 0.00 C ATOM 1760 O SER A 117 22.060 27.722 0.398 1.00 0.00 O ATOM 1761 CB SER A 117 19.561 29.201 0.562 1.00 0.00 C ATOM 1762 OG SER A 117 19.492 27.932 1.190 1.00 0.00 O ATOM 0 H SER A 117 18.899 28.066 -1.568 1.00 0.00 H new ATOM 0 HA SER A 117 20.503 30.145 -1.122 1.00 0.00 H new ATOM 0 HB2 SER A 117 19.949 29.938 1.265 1.00 0.00 H new ATOM 0 HB3 SER A 117 18.560 29.526 0.279 1.00 0.00 H new ATOM 0 HG SER A 117 20.351 27.471 1.091 1.00 0.00 H new ATOM 1768 N SER A 118 22.855 29.507 -0.718 1.00 0.00 N ATOM 1769 CA SER A 118 24.251 29.213 -0.414 1.00 0.00 C ATOM 1770 C SER A 118 24.498 29.249 1.091 1.00 0.00 C ATOM 1771 O SER A 118 25.223 28.416 1.633 1.00 0.00 O ATOM 1772 CB SER A 118 25.170 30.214 -1.118 1.00 0.00 C ATOM 1773 OG SER A 118 26.504 30.091 -0.658 1.00 0.00 O ATOM 0 H SER A 118 22.713 30.346 -1.281 1.00 0.00 H new ATOM 0 HA SER A 118 24.473 28.210 -0.777 1.00 0.00 H new ATOM 0 HB2 SER A 118 25.136 30.048 -2.195 1.00 0.00 H new ATOM 0 HB3 SER A 118 24.813 31.228 -0.940 1.00 0.00 H new ATOM 0 HG SER A 118 27.072 30.740 -1.124 1.00 0.00 H new ATOM 1779 N GLY A 119 23.890 30.224 1.761 1.00 0.00 N ATOM 1780 CA GLY A 119 24.056 30.352 3.197 1.00 0.00 C ATOM 1781 C GLY A 119 25.372 31.004 3.572 1.00 0.00 C ATOM 1782 O GLY A 119 26.415 30.685 3.002 1.00 0.00 O ATOM 0 H GLY A 119 23.286 30.927 1.335 1.00 0.00 H new ATOM 0 HA2 GLY A 119 23.234 30.940 3.604 1.00 0.00 H new ATOM 0 HA3 GLY A 119 23.999 29.365 3.656 1.00 0.00 H new TER 1786 GLY A 119