USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 919 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 88 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 112 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 58 SER OG : rot -132:sc= 0.0255 USER MOD Set 2.2: A 90 GLN : amide:sc= -2.13 K(o=-2.1,f=-3.2) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.105 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 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 9 SER OG : rot 35:sc= 1.15 USER MOD Single : A 11 HIS : no HD1:sc= -0.0218 X(o=-0.022,f=0) USER MOD Single : A 16 GLN : amide:sc= -4.35! C(o=-4.3!,f=-3.9!) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 23 HIS : no HD1:sc= 0 K(o=0,f=-2!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0.0179 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00529 USER MOD Single : A 37 ASN : amide:sc= -0.0134 X(o=-0.013,f=0) USER MOD Single : A 39 THR OG1 : rot 27:sc= 0.466 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 155:sc= -0.0934 (180deg=-0.478) USER MOD Single : A 47 ASN : amide:sc= -1.81 K(o=-1.8,f=-3.3!) USER MOD Single : A 48 SER OG : rot 117:sc= -1.93 USER MOD Single : A 53 TYR OH : rot 165:sc= 0 USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -0.789 K(o=-0.79,f=-1.8!) USER MOD Single : A 61 ASN : amide:sc= -0.333 K(o=-0.33,f=-2!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -0.0289 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.00812 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 TYR OH : rot 89:sc= -0.0166 USER MOD Single : A 94 CYS SG : rot -130:sc= -0.925 USER MOD Single : A 97 ASN : amide:sc= -10.9! C(o=-11!,f=-24!) USER MOD Single : A 101 LYS NZ :NH3+ -150:sc= -0.131 (180deg=-1.54) USER MOD Single : A 103 GLN :FLIP amide:sc= -0.938 F(o=-1.9,f=-0.94) USER MOD Single : A 105 SER OG : rot 160:sc= -1.33 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 140:sc= 0.0229 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 33.246 -25.383 -18.204 1.00 0.00 N ATOM 2 CA GLY A 1 32.532 -26.307 -17.339 1.00 0.00 C ATOM 3 C GLY A 1 31.485 -27.098 -18.127 1.00 0.00 C ATOM 4 O GLY A 1 31.195 -26.775 -19.278 1.00 0.00 O ATOM 0 H1 GLY A 1 34.256 -25.632 -18.220 1.00 0.00 H new ATOM 0 H2 GLY A 1 32.860 -25.441 -19.168 1.00 0.00 H new ATOM 0 H3 GLY A 1 33.134 -24.414 -17.844 1.00 0.00 H new ATOM 0 HA2 GLY A 1 33.238 -26.995 -16.874 1.00 0.00 H new ATOM 0 HA3 GLY A 1 32.046 -25.756 -16.534 1.00 0.00 H new ATOM 8 N SER A 2 30.948 -28.118 -17.476 1.00 0.00 N ATOM 9 CA SER A 2 29.940 -28.958 -18.101 1.00 0.00 C ATOM 10 C SER A 2 28.906 -29.397 -17.062 1.00 0.00 C ATOM 11 O SER A 2 27.716 -29.125 -17.213 1.00 0.00 O ATOM 12 CB SER A 2 30.577 -30.180 -18.766 1.00 0.00 C ATOM 13 OG SER A 2 31.634 -29.818 -19.649 1.00 0.00 O ATOM 0 H SER A 2 31.192 -28.383 -16.521 1.00 0.00 H new ATOM 0 HA SER A 2 29.441 -28.375 -18.875 1.00 0.00 H new ATOM 0 HB2 SER A 2 30.961 -30.852 -17.998 1.00 0.00 H new ATOM 0 HB3 SER A 2 29.815 -30.730 -19.319 1.00 0.00 H new ATOM 0 HG SER A 2 32.015 -30.626 -20.052 1.00 0.00 H new ATOM 19 N SER A 3 29.398 -30.068 -16.031 1.00 0.00 N ATOM 20 CA SER A 3 28.532 -30.547 -14.968 1.00 0.00 C ATOM 21 C SER A 3 28.455 -29.508 -13.848 1.00 0.00 C ATOM 22 O SER A 3 29.411 -28.769 -13.615 1.00 0.00 O ATOM 23 CB SER A 3 29.025 -31.886 -14.417 1.00 0.00 C ATOM 24 OG SER A 3 30.268 -31.756 -13.731 1.00 0.00 O ATOM 0 H SER A 3 30.386 -30.291 -15.909 1.00 0.00 H new ATOM 0 HA SER A 3 27.535 -30.700 -15.382 1.00 0.00 H new ATOM 0 HB2 SER A 3 28.277 -32.296 -13.738 1.00 0.00 H new ATOM 0 HB3 SER A 3 29.136 -32.597 -15.236 1.00 0.00 H new ATOM 0 HG SER A 3 30.548 -32.632 -13.393 1.00 0.00 H new ATOM 30 N GLY A 4 27.309 -29.484 -13.184 1.00 0.00 N ATOM 31 CA GLY A 4 27.095 -28.547 -12.093 1.00 0.00 C ATOM 32 C GLY A 4 26.338 -29.211 -10.941 1.00 0.00 C ATOM 33 O GLY A 4 25.889 -30.350 -11.063 1.00 0.00 O ATOM 0 H GLY A 4 26.519 -30.098 -13.380 1.00 0.00 H new ATOM 0 HA2 GLY A 4 28.055 -28.174 -11.735 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.533 -27.686 -12.454 1.00 0.00 H new ATOM 37 N SER A 5 26.219 -28.470 -9.849 1.00 0.00 N ATOM 38 CA SER A 5 25.524 -28.973 -8.676 1.00 0.00 C ATOM 39 C SER A 5 24.590 -27.896 -8.120 1.00 0.00 C ATOM 40 O SER A 5 24.863 -26.704 -8.253 1.00 0.00 O ATOM 41 CB SER A 5 26.515 -29.423 -7.600 1.00 0.00 C ATOM 42 OG SER A 5 27.317 -30.517 -8.037 1.00 0.00 O ATOM 0 H SER A 5 26.592 -27.526 -9.752 1.00 0.00 H new ATOM 0 HA SER A 5 24.933 -29.839 -8.973 1.00 0.00 H new ATOM 0 HB2 SER A 5 27.159 -28.587 -7.328 1.00 0.00 H new ATOM 0 HB3 SER A 5 25.969 -29.710 -6.701 1.00 0.00 H new ATOM 0 HG SER A 5 27.937 -30.774 -7.323 1.00 0.00 H new ATOM 48 N SER A 6 23.508 -28.355 -7.509 1.00 0.00 N ATOM 49 CA SER A 6 22.532 -27.446 -6.933 1.00 0.00 C ATOM 50 C SER A 6 22.877 -27.167 -5.469 1.00 0.00 C ATOM 51 O SER A 6 23.398 -28.038 -4.773 1.00 0.00 O ATOM 52 CB SER A 6 21.116 -28.015 -7.045 1.00 0.00 C ATOM 53 OG SER A 6 20.165 -27.223 -6.339 1.00 0.00 O ATOM 0 H SER A 6 23.286 -29.345 -7.400 1.00 0.00 H new ATOM 0 HA SER A 6 22.564 -26.511 -7.492 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.831 -28.073 -8.095 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.102 -29.032 -6.654 1.00 0.00 H new ATOM 0 HG SER A 6 19.274 -27.618 -6.436 1.00 0.00 H new ATOM 59 N GLY A 7 22.575 -25.949 -5.044 1.00 0.00 N ATOM 60 CA GLY A 7 22.847 -25.544 -3.676 1.00 0.00 C ATOM 61 C GLY A 7 22.335 -26.589 -2.683 1.00 0.00 C ATOM 62 O GLY A 7 21.221 -27.092 -2.824 1.00 0.00 O ATOM 0 H GLY A 7 22.144 -25.229 -5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 7 23.919 -25.403 -3.541 1.00 0.00 H new ATOM 0 HA3 GLY A 7 22.372 -24.584 -3.476 1.00 0.00 H new ATOM 66 N ARG A 8 23.173 -26.886 -1.700 1.00 0.00 N ATOM 67 CA ARG A 8 22.819 -27.862 -0.684 1.00 0.00 C ATOM 68 C ARG A 8 23.245 -27.366 0.700 1.00 0.00 C ATOM 69 O ARG A 8 22.417 -27.244 1.601 1.00 0.00 O ATOM 70 CB ARG A 8 23.484 -29.212 -0.961 1.00 0.00 C ATOM 71 CG ARG A 8 22.644 -30.362 -0.403 1.00 0.00 C ATOM 72 CD ARG A 8 21.593 -30.817 -1.418 1.00 0.00 C ATOM 73 NE ARG A 8 20.694 -31.818 -0.801 1.00 0.00 N ATOM 74 CZ ARG A 8 21.024 -33.102 -0.601 1.00 0.00 C ATOM 75 NH1 ARG A 8 22.233 -33.548 -0.968 1.00 0.00 N ATOM 76 NH2 ARG A 8 20.144 -33.939 -0.035 1.00 0.00 N ATOM 0 H ARG A 8 24.096 -26.468 -1.586 1.00 0.00 H new ATOM 0 HA ARG A 8 21.737 -27.991 -0.711 1.00 0.00 H new ATOM 0 HB2 ARG A 8 23.617 -29.342 -2.035 1.00 0.00 H new ATOM 0 HB3 ARG A 8 24.477 -29.231 -0.512 1.00 0.00 H new ATOM 0 HG2 ARG A 8 23.293 -31.199 -0.146 1.00 0.00 H new ATOM 0 HG3 ARG A 8 22.153 -30.045 0.517 1.00 0.00 H new ATOM 0 HD2 ARG A 8 21.014 -29.960 -1.764 1.00 0.00 H new ATOM 0 HD3 ARG A 8 22.082 -31.245 -2.293 1.00 0.00 H new ATOM 0 HE ARG A 8 19.766 -31.512 -0.510 1.00 0.00 H new ATOM 0 HH11 ARG A 8 22.902 -32.911 -1.400 1.00 0.00 H new ATOM 0 HH12 ARG A 8 22.484 -34.525 -0.816 1.00 0.00 H new ATOM 0 HH21 ARG A 8 19.223 -33.599 0.244 1.00 0.00 H new ATOM 0 HH22 ARG A 8 20.395 -34.916 0.117 1.00 0.00 H new ATOM 90 N SER A 9 24.536 -27.095 0.824 1.00 0.00 N ATOM 91 CA SER A 9 25.082 -26.616 2.082 1.00 0.00 C ATOM 92 C SER A 9 25.607 -25.188 1.915 1.00 0.00 C ATOM 93 O SER A 9 26.702 -24.983 1.393 1.00 0.00 O ATOM 94 CB SER A 9 26.196 -27.536 2.585 1.00 0.00 C ATOM 95 OG SER A 9 27.365 -27.451 1.775 1.00 0.00 O ATOM 0 H SER A 9 25.219 -27.198 0.074 1.00 0.00 H new ATOM 0 HA SER A 9 24.284 -26.618 2.824 1.00 0.00 H new ATOM 0 HB2 SER A 9 26.447 -27.273 3.613 1.00 0.00 H new ATOM 0 HB3 SER A 9 25.838 -28.565 2.598 1.00 0.00 H new ATOM 0 HG SER A 9 27.474 -26.532 1.453 1.00 0.00 H new ATOM 101 N ALA A 10 24.802 -24.239 2.368 1.00 0.00 N ATOM 102 CA ALA A 10 25.172 -22.837 2.274 1.00 0.00 C ATOM 103 C ALA A 10 26.498 -22.614 3.004 1.00 0.00 C ATOM 104 O ALA A 10 26.902 -23.433 3.829 1.00 0.00 O ATOM 105 CB ALA A 10 24.043 -21.972 2.839 1.00 0.00 C ATOM 0 H ALA A 10 23.895 -24.413 2.801 1.00 0.00 H new ATOM 0 HA ALA A 10 25.316 -22.547 1.233 1.00 0.00 H new ATOM 0 HB1 ALA A 10 24.320 -20.920 2.769 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.131 -22.146 2.268 1.00 0.00 H new ATOM 0 HB3 ALA A 10 23.872 -22.233 3.883 1.00 0.00 H new ATOM 111 N HIS A 11 27.139 -21.502 2.675 1.00 0.00 N ATOM 112 CA HIS A 11 28.411 -21.161 3.289 1.00 0.00 C ATOM 113 C HIS A 11 28.166 -20.319 4.544 1.00 0.00 C ATOM 114 O HIS A 11 28.285 -20.817 5.662 1.00 0.00 O ATOM 115 CB HIS A 11 29.332 -20.470 2.282 1.00 0.00 C ATOM 116 CG HIS A 11 30.681 -21.132 2.130 1.00 0.00 C ATOM 117 ND1 HIS A 11 31.211 -21.480 0.900 1.00 0.00 N ATOM 118 CD2 HIS A 11 31.602 -21.505 3.065 1.00 0.00 C ATOM 119 CE1 HIS A 11 32.397 -22.037 1.098 1.00 0.00 C ATOM 120 NE2 HIS A 11 32.637 -22.052 2.440 1.00 0.00 N ATOM 0 H HIS A 11 26.801 -20.825 1.991 1.00 0.00 H new ATOM 0 HA HIS A 11 28.925 -22.071 3.599 1.00 0.00 H new ATOM 0 HB2 HIS A 11 28.839 -20.446 1.310 1.00 0.00 H new ATOM 0 HB3 HIS A 11 29.479 -19.435 2.590 1.00 0.00 H new ATOM 0 HD2 HIS A 11 31.505 -21.377 4.133 1.00 0.00 H new ATOM 0 HE1 HIS A 11 33.058 -22.413 0.331 1.00 0.00 H new ATOM 0 HE2 HIS A 11 33.474 -22.423 2.890 1.00 0.00 H new ATOM 128 N LEU A 12 27.829 -19.059 4.315 1.00 0.00 N ATOM 129 CA LEU A 12 27.566 -18.143 5.412 1.00 0.00 C ATOM 130 C LEU A 12 26.056 -17.947 5.557 1.00 0.00 C ATOM 131 O LEU A 12 25.477 -18.297 6.583 1.00 0.00 O ATOM 132 CB LEU A 12 28.340 -16.838 5.217 1.00 0.00 C ATOM 133 CG LEU A 12 29.717 -16.768 5.882 1.00 0.00 C ATOM 134 CD1 LEU A 12 29.600 -16.906 7.401 1.00 0.00 C ATOM 135 CD2 LEU A 12 30.667 -17.808 5.284 1.00 0.00 C ATOM 0 H LEU A 12 27.732 -18.650 3.386 1.00 0.00 H new ATOM 0 HA LEU A 12 27.924 -18.562 6.352 1.00 0.00 H new ATOM 0 HB2 LEU A 12 28.466 -16.670 4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 12 27.732 -16.018 5.599 1.00 0.00 H new ATOM 0 HG LEU A 12 30.145 -15.786 5.680 1.00 0.00 H new ATOM 0 HD11 LEU A 12 30.592 -16.853 7.849 1.00 0.00 H new ATOM 0 HD12 LEU A 12 28.981 -16.099 7.793 1.00 0.00 H new ATOM 0 HD13 LEU A 12 29.143 -17.865 7.645 1.00 0.00 H new ATOM 0 HD21 LEU A 12 31.638 -17.738 5.774 1.00 0.00 H new ATOM 0 HD22 LEU A 12 30.256 -18.806 5.435 1.00 0.00 H new ATOM 0 HD23 LEU A 12 30.784 -17.622 4.216 1.00 0.00 H new ATOM 147 N ARG A 13 25.462 -17.388 4.513 1.00 0.00 N ATOM 148 CA ARG A 13 24.030 -17.140 4.511 1.00 0.00 C ATOM 149 C ARG A 13 23.487 -17.178 3.081 1.00 0.00 C ATOM 150 O ARG A 13 24.221 -16.924 2.127 1.00 0.00 O ATOM 151 CB ARG A 13 23.704 -15.783 5.138 1.00 0.00 C ATOM 152 CG ARG A 13 23.046 -15.956 6.508 1.00 0.00 C ATOM 153 CD ARG A 13 24.068 -15.778 7.633 1.00 0.00 C ATOM 154 NE ARG A 13 23.610 -14.729 8.571 1.00 0.00 N ATOM 155 CZ ARG A 13 23.757 -13.414 8.357 1.00 0.00 C ATOM 156 NH1 ARG A 13 24.349 -12.980 7.237 1.00 0.00 N ATOM 157 NH2 ARG A 13 23.311 -12.534 9.264 1.00 0.00 N ATOM 0 H ARG A 13 25.946 -17.100 3.663 1.00 0.00 H new ATOM 0 HA ARG A 13 23.557 -17.923 5.104 1.00 0.00 H new ATOM 0 HB2 ARG A 13 24.617 -15.197 5.241 1.00 0.00 H new ATOM 0 HB3 ARG A 13 23.039 -15.224 4.479 1.00 0.00 H new ATOM 0 HG2 ARG A 13 22.242 -15.229 6.624 1.00 0.00 H new ATOM 0 HG3 ARG A 13 22.594 -16.945 6.576 1.00 0.00 H new ATOM 0 HD2 ARG A 13 24.203 -16.720 8.165 1.00 0.00 H new ATOM 0 HD3 ARG A 13 25.037 -15.506 7.215 1.00 0.00 H new ATOM 0 HE ARG A 13 23.154 -15.025 9.434 1.00 0.00 H new ATOM 0 HH11 ARG A 13 24.688 -13.650 6.547 1.00 0.00 H new ATOM 0 HH12 ARG A 13 24.461 -11.979 7.074 1.00 0.00 H new ATOM 0 HH21 ARG A 13 22.860 -12.865 10.117 1.00 0.00 H new ATOM 0 HH22 ARG A 13 23.423 -11.533 9.102 1.00 0.00 H new ATOM 171 N VAL A 14 22.205 -17.495 2.977 1.00 0.00 N ATOM 172 CA VAL A 14 21.555 -17.569 1.679 1.00 0.00 C ATOM 173 C VAL A 14 20.620 -16.369 1.513 1.00 0.00 C ATOM 174 O VAL A 14 19.720 -16.162 2.326 1.00 0.00 O ATOM 175 CB VAL A 14 20.837 -18.912 1.529 1.00 0.00 C ATOM 176 CG1 VAL A 14 19.483 -18.892 2.241 1.00 0.00 C ATOM 177 CG2 VAL A 14 20.676 -19.285 0.054 1.00 0.00 C ATOM 0 H VAL A 14 21.599 -17.704 3.770 1.00 0.00 H new ATOM 0 HA VAL A 14 22.293 -17.519 0.879 1.00 0.00 H new ATOM 0 HB VAL A 14 21.453 -19.677 2.003 1.00 0.00 H new ATOM 0 HG11 VAL A 14 18.993 -19.858 2.119 1.00 0.00 H new ATOM 0 HG12 VAL A 14 19.633 -18.692 3.302 1.00 0.00 H new ATOM 0 HG13 VAL A 14 18.857 -18.111 1.810 1.00 0.00 H new ATOM 0 HG21 VAL A 14 20.163 -20.243 -0.025 1.00 0.00 H new ATOM 0 HG22 VAL A 14 20.092 -18.518 -0.454 1.00 0.00 H new ATOM 0 HG23 VAL A 14 21.659 -19.360 -0.412 1.00 0.00 H new ATOM 187 N ARG A 15 20.865 -15.610 0.455 1.00 0.00 N ATOM 188 CA ARG A 15 20.056 -14.437 0.172 1.00 0.00 C ATOM 189 C ARG A 15 18.661 -14.855 -0.297 1.00 0.00 C ATOM 190 O ARG A 15 18.449 -15.103 -1.483 1.00 0.00 O ATOM 191 CB ARG A 15 20.708 -13.564 -0.902 1.00 0.00 C ATOM 192 CG ARG A 15 21.611 -12.502 -0.271 1.00 0.00 C ATOM 193 CD ARG A 15 22.299 -11.659 -1.347 1.00 0.00 C ATOM 194 NE ARG A 15 23.766 -11.692 -1.155 1.00 0.00 N ATOM 195 CZ ARG A 15 24.565 -12.652 -1.640 1.00 0.00 C ATOM 196 NH1 ARG A 15 24.045 -13.663 -2.349 1.00 0.00 N ATOM 197 NH2 ARG A 15 25.886 -12.601 -1.416 1.00 0.00 N ATOM 0 H ARG A 15 21.612 -15.785 -0.217 1.00 0.00 H new ATOM 0 HA ARG A 15 19.975 -13.860 1.093 1.00 0.00 H new ATOM 0 HB2 ARG A 15 21.292 -14.188 -1.578 1.00 0.00 H new ATOM 0 HB3 ARG A 15 19.936 -13.081 -1.501 1.00 0.00 H new ATOM 0 HG2 ARG A 15 21.020 -11.857 0.379 1.00 0.00 H new ATOM 0 HG3 ARG A 15 22.362 -12.983 0.355 1.00 0.00 H new ATOM 0 HD2 ARG A 15 22.045 -12.039 -2.336 1.00 0.00 H new ATOM 0 HD3 ARG A 15 21.941 -10.631 -1.299 1.00 0.00 H new ATOM 0 HE ARG A 15 24.196 -10.937 -0.620 1.00 0.00 H new ATOM 0 HH11 ARG A 15 23.040 -13.702 -2.520 1.00 0.00 H new ATOM 0 HH12 ARG A 15 24.654 -14.393 -2.718 1.00 0.00 H new ATOM 0 HH21 ARG A 15 26.282 -11.832 -0.876 1.00 0.00 H new ATOM 0 HH22 ARG A 15 26.494 -13.332 -1.785 1.00 0.00 H new ATOM 211 N GLN A 16 17.744 -14.920 0.658 1.00 0.00 N ATOM 212 CA GLN A 16 16.376 -15.303 0.357 1.00 0.00 C ATOM 213 C GLN A 16 15.526 -14.062 0.075 1.00 0.00 C ATOM 214 O GLN A 16 15.850 -12.967 0.533 1.00 0.00 O ATOM 215 CB GLN A 16 15.775 -16.132 1.494 1.00 0.00 C ATOM 216 CG GLN A 16 15.266 -17.480 0.981 1.00 0.00 C ATOM 217 CD GLN A 16 16.400 -18.290 0.349 1.00 0.00 C ATOM 218 OE1 GLN A 16 16.795 -18.073 -0.785 1.00 0.00 O ATOM 219 NE2 GLN A 16 16.899 -19.233 1.143 1.00 0.00 N ATOM 0 H GLN A 16 17.923 -14.714 1.641 1.00 0.00 H new ATOM 0 HA GLN A 16 16.383 -15.925 -0.538 1.00 0.00 H new ATOM 0 HB2 GLN A 16 16.526 -16.293 2.267 1.00 0.00 H new ATOM 0 HB3 GLN A 16 14.955 -15.582 1.956 1.00 0.00 H new ATOM 0 HG2 GLN A 16 14.826 -18.044 1.804 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.476 -17.319 0.247 1.00 0.00 H new ATOM 0 HE21 GLN A 16 16.522 -19.361 2.082 1.00 0.00 H new ATOM 0 HE22 GLN A 16 17.659 -19.828 0.813 1.00 0.00 H new ATOM 228 N LEU A 17 14.456 -14.275 -0.676 1.00 0.00 N ATOM 229 CA LEU A 17 13.558 -13.187 -1.024 1.00 0.00 C ATOM 230 C LEU A 17 12.665 -12.865 0.176 1.00 0.00 C ATOM 231 O LEU A 17 12.294 -13.759 0.935 1.00 0.00 O ATOM 232 CB LEU A 17 12.780 -13.521 -2.298 1.00 0.00 C ATOM 233 CG LEU A 17 13.609 -13.641 -3.579 1.00 0.00 C ATOM 234 CD1 LEU A 17 12.766 -14.198 -4.727 1.00 0.00 C ATOM 235 CD2 LEU A 17 14.257 -12.304 -3.940 1.00 0.00 C ATOM 0 H LEU A 17 14.190 -15.185 -1.053 1.00 0.00 H new ATOM 0 HA LEU A 17 14.124 -12.284 -1.252 1.00 0.00 H new ATOM 0 HB2 LEU A 17 12.252 -14.462 -2.141 1.00 0.00 H new ATOM 0 HB3 LEU A 17 12.023 -12.752 -2.450 1.00 0.00 H new ATOM 0 HG LEU A 17 14.416 -14.351 -3.398 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.379 -14.273 -5.625 1.00 0.00 H new ATOM 0 HD12 LEU A 17 12.393 -15.186 -4.458 1.00 0.00 H new ATOM 0 HD13 LEU A 17 11.924 -13.532 -4.917 1.00 0.00 H new ATOM 0 HD21 LEU A 17 14.840 -12.417 -4.854 1.00 0.00 H new ATOM 0 HD22 LEU A 17 13.481 -11.554 -4.095 1.00 0.00 H new ATOM 0 HD23 LEU A 17 14.912 -11.986 -3.129 1.00 0.00 H new ATOM 247 N PRO A 18 12.336 -11.552 0.312 1.00 0.00 N ATOM 248 CA PRO A 18 11.493 -11.102 1.406 1.00 0.00 C ATOM 249 C PRO A 18 10.031 -11.478 1.163 1.00 0.00 C ATOM 250 O PRO A 18 9.591 -11.568 0.017 1.00 0.00 O ATOM 251 CB PRO A 18 11.716 -9.600 1.481 1.00 0.00 C ATOM 252 CG PRO A 18 12.309 -9.199 0.141 1.00 0.00 C ATOM 253 CD PRO A 18 12.757 -10.467 -0.569 1.00 0.00 C ATOM 0 HA PRO A 18 11.745 -11.577 2.354 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.779 -9.075 1.666 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.391 -9.346 2.298 1.00 0.00 H new ATOM 0 HG2 PRO A 18 11.571 -8.666 -0.459 1.00 0.00 H new ATOM 0 HG3 PRO A 18 13.152 -8.523 0.284 1.00 0.00 H new ATOM 0 HD2 PRO A 18 12.296 -10.554 -1.553 1.00 0.00 H new ATOM 0 HD3 PRO A 18 13.836 -10.476 -0.721 1.00 0.00 H new ATOM 261 N HIS A 19 9.317 -11.689 2.259 1.00 0.00 N ATOM 262 CA HIS A 19 7.912 -12.054 2.179 1.00 0.00 C ATOM 263 C HIS A 19 7.066 -10.796 1.975 1.00 0.00 C ATOM 264 O HIS A 19 7.493 -9.694 2.317 1.00 0.00 O ATOM 265 CB HIS A 19 7.490 -12.860 3.408 1.00 0.00 C ATOM 266 CG HIS A 19 7.400 -14.348 3.166 1.00 0.00 C ATOM 267 ND1 HIS A 19 6.224 -15.062 3.315 1.00 0.00 N ATOM 268 CD2 HIS A 19 8.352 -15.247 2.784 1.00 0.00 C ATOM 269 CE1 HIS A 19 6.469 -16.334 3.033 1.00 0.00 C ATOM 270 NE2 HIS A 19 7.788 -16.446 2.705 1.00 0.00 N ATOM 0 H HIS A 19 9.685 -11.614 3.207 1.00 0.00 H new ATOM 0 HA HIS A 19 7.749 -12.702 1.318 1.00 0.00 H new ATOM 0 HB2 HIS A 19 8.202 -12.676 4.213 1.00 0.00 H new ATOM 0 HB3 HIS A 19 6.521 -12.499 3.751 1.00 0.00 H new ATOM 0 HD2 HIS A 19 9.388 -15.022 2.580 1.00 0.00 H new ATOM 0 HE1 HIS A 19 5.750 -17.140 3.059 1.00 0.00 H new ATOM 0 HE2 HIS A 19 8.263 -17.309 2.442 1.00 0.00 H new ATOM 278 N ALA A 20 5.881 -11.002 1.419 1.00 0.00 N ATOM 279 CA ALA A 20 4.971 -9.898 1.166 1.00 0.00 C ATOM 280 C ALA A 20 4.561 -9.265 2.497 1.00 0.00 C ATOM 281 O ALA A 20 4.749 -9.861 3.556 1.00 0.00 O ATOM 282 CB ALA A 20 3.769 -10.401 0.365 1.00 0.00 C ATOM 0 H ALA A 20 5.530 -11.917 1.137 1.00 0.00 H new ATOM 0 HA ALA A 20 5.460 -9.126 0.571 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.086 -9.573 0.175 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.111 -10.814 -0.584 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.252 -11.175 0.932 1.00 0.00 H new ATOM 288 N PRO A 21 3.994 -8.033 2.397 1.00 0.00 N ATOM 289 CA PRO A 21 3.556 -7.312 3.580 1.00 0.00 C ATOM 290 C PRO A 21 2.257 -7.903 4.133 1.00 0.00 C ATOM 291 O PRO A 21 1.296 -8.100 3.391 1.00 0.00 O ATOM 292 CB PRO A 21 3.406 -5.869 3.129 1.00 0.00 C ATOM 293 CG PRO A 21 3.315 -5.913 1.612 1.00 0.00 C ATOM 294 CD PRO A 21 3.755 -7.296 1.159 1.00 0.00 C ATOM 0 HA PRO A 21 4.266 -7.386 4.404 1.00 0.00 H new ATOM 0 HB2 PRO A 21 2.514 -5.416 3.561 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.256 -5.269 3.452 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.295 -5.710 1.285 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.950 -5.146 1.169 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.987 -7.777 0.554 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.656 -7.245 0.548 1.00 0.00 H new ATOM 302 N GLU A 22 2.271 -8.170 5.430 1.00 0.00 N ATOM 303 CA GLU A 22 1.106 -8.735 6.091 1.00 0.00 C ATOM 304 C GLU A 22 0.180 -7.619 6.580 1.00 0.00 C ATOM 305 O GLU A 22 0.473 -6.439 6.394 1.00 0.00 O ATOM 306 CB GLU A 22 1.520 -9.649 7.245 1.00 0.00 C ATOM 307 CG GLU A 22 1.410 -11.122 6.845 1.00 0.00 C ATOM 308 CD GLU A 22 0.010 -11.666 7.139 1.00 0.00 C ATOM 309 OE1 GLU A 22 -0.945 -10.869 7.020 1.00 0.00 O ATOM 310 OE2 GLU A 22 -0.072 -12.867 7.475 1.00 0.00 O ATOM 0 H GLU A 22 3.071 -8.006 6.042 1.00 0.00 H new ATOM 0 HA GLU A 22 0.561 -9.342 5.368 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.545 -9.425 7.542 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.888 -9.456 8.112 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.631 -11.232 5.783 1.00 0.00 H new ATOM 0 HG3 GLU A 22 2.153 -11.707 7.388 1.00 0.00 H new ATOM 317 N HIS A 23 -0.918 -8.032 7.195 1.00 0.00 N ATOM 318 CA HIS A 23 -1.888 -7.082 7.713 1.00 0.00 C ATOM 319 C HIS A 23 -1.979 -5.879 6.773 1.00 0.00 C ATOM 320 O HIS A 23 -1.814 -4.738 7.201 1.00 0.00 O ATOM 321 CB HIS A 23 -1.548 -6.687 9.151 1.00 0.00 C ATOM 322 CG HIS A 23 -2.662 -6.942 10.138 1.00 0.00 C ATOM 323 ND1 HIS A 23 -3.768 -6.118 10.250 1.00 0.00 N ATOM 324 CD2 HIS A 23 -2.830 -7.938 11.055 1.00 0.00 C ATOM 325 CE1 HIS A 23 -4.558 -6.604 11.195 1.00 0.00 C ATOM 326 NE2 HIS A 23 -3.975 -7.732 11.694 1.00 0.00 N ATOM 0 H HIS A 23 -1.158 -9.012 7.346 1.00 0.00 H new ATOM 0 HA HIS A 23 -2.874 -7.546 7.750 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.662 -7.237 9.468 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -1.291 -5.628 9.175 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.147 -8.756 11.231 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -5.499 -6.181 11.515 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -4.356 -8.320 12.435 1.00 0.00 H new ATOM 334 N PRO A 24 -2.249 -6.182 5.475 1.00 0.00 N ATOM 335 CA PRO A 24 -2.364 -5.139 4.470 1.00 0.00 C ATOM 336 C PRO A 24 -3.692 -4.390 4.607 1.00 0.00 C ATOM 337 O PRO A 24 -4.634 -4.648 3.860 1.00 0.00 O ATOM 338 CB PRO A 24 -2.222 -5.857 3.138 1.00 0.00 C ATOM 339 CG PRO A 24 -2.498 -7.324 3.425 1.00 0.00 C ATOM 340 CD PRO A 24 -2.451 -7.522 4.931 1.00 0.00 C ATOM 0 HA PRO A 24 -1.600 -4.369 4.575 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -2.926 -5.463 2.405 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.222 -5.721 2.725 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.473 -7.613 3.032 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.757 -7.955 2.934 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.376 -7.964 5.301 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.640 -8.192 5.217 1.00 0.00 H new ATOM 348 N VAL A 25 -3.723 -3.478 5.567 1.00 0.00 N ATOM 349 CA VAL A 25 -4.920 -2.690 5.812 1.00 0.00 C ATOM 350 C VAL A 25 -4.794 -1.344 5.096 1.00 0.00 C ATOM 351 O VAL A 25 -3.741 -0.708 5.141 1.00 0.00 O ATOM 352 CB VAL A 25 -5.153 -2.547 7.317 1.00 0.00 C ATOM 353 CG1 VAL A 25 -6.634 -2.307 7.622 1.00 0.00 C ATOM 354 CG2 VAL A 25 -4.629 -3.770 8.072 1.00 0.00 C ATOM 0 H VAL A 25 -2.939 -3.267 6.185 1.00 0.00 H new ATOM 0 HA VAL A 25 -5.798 -3.193 5.407 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.594 -1.677 7.661 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.772 -2.209 8.699 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.963 -1.392 7.129 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.222 -3.149 7.256 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.807 -3.642 9.140 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.147 -4.663 7.722 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.559 -3.877 7.893 1.00 0.00 H new ATOM 364 N ALA A 26 -5.881 -0.949 4.450 1.00 0.00 N ATOM 365 CA ALA A 26 -5.906 0.310 3.726 1.00 0.00 C ATOM 366 C ALA A 26 -7.195 1.063 4.062 1.00 0.00 C ATOM 367 O ALA A 26 -8.273 0.693 3.598 1.00 0.00 O ATOM 368 CB ALA A 26 -5.763 0.040 2.227 1.00 0.00 C ATOM 0 H ALA A 26 -6.752 -1.479 4.413 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.069 0.941 4.026 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.782 0.985 1.684 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.818 -0.469 2.037 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -6.587 -0.589 1.890 1.00 0.00 H new ATOM 374 N THR A 27 -7.042 2.104 4.866 1.00 0.00 N ATOM 375 CA THR A 27 -8.181 2.912 5.270 1.00 0.00 C ATOM 376 C THR A 27 -8.012 4.353 4.785 1.00 0.00 C ATOM 377 O THR A 27 -6.890 4.841 4.658 1.00 0.00 O ATOM 378 CB THR A 27 -8.328 2.795 6.788 1.00 0.00 C ATOM 379 OG1 THR A 27 -7.011 2.497 7.243 1.00 0.00 O ATOM 380 CG2 THR A 27 -9.151 1.575 7.205 1.00 0.00 C ATOM 0 H THR A 27 -6.147 2.407 5.249 1.00 0.00 H new ATOM 0 HA THR A 27 -9.103 2.554 4.811 1.00 0.00 H new ATOM 0 HB THR A 27 -8.797 3.699 7.177 1.00 0.00 H new ATOM 0 HG1 THR A 27 -7.015 2.406 8.219 1.00 0.00 H new ATOM 0 HG21 THR A 27 -9.224 1.540 8.292 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.151 1.646 6.776 1.00 0.00 H new ATOM 0 HG23 THR A 27 -8.666 0.668 6.845 1.00 0.00 H new ATOM 388 N LEU A 28 -9.142 4.993 4.526 1.00 0.00 N ATOM 389 CA LEU A 28 -9.134 6.368 4.057 1.00 0.00 C ATOM 390 C LEU A 28 -8.752 7.294 5.214 1.00 0.00 C ATOM 391 O LEU A 28 -8.784 6.889 6.374 1.00 0.00 O ATOM 392 CB LEU A 28 -10.471 6.719 3.403 1.00 0.00 C ATOM 393 CG LEU A 28 -10.468 6.810 1.876 1.00 0.00 C ATOM 394 CD1 LEU A 28 -11.881 7.044 1.337 1.00 0.00 C ATOM 395 CD2 LEU A 28 -9.486 7.879 1.392 1.00 0.00 C ATOM 0 H LEU A 28 -10.071 4.584 4.632 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.382 6.502 3.280 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.206 5.971 3.701 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.809 7.675 3.803 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.126 5.855 1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -11.850 7.105 0.249 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.526 6.218 1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -12.275 7.976 1.741 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -9.504 7.923 0.303 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.774 8.848 1.799 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.480 7.628 1.729 1.00 0.00 H new ATOM 407 N SER A 29 -8.400 8.520 4.856 1.00 0.00 N ATOM 408 CA SER A 29 -8.013 9.507 5.850 1.00 0.00 C ATOM 409 C SER A 29 -9.240 10.298 6.308 1.00 0.00 C ATOM 410 O SER A 29 -9.925 10.916 5.494 1.00 0.00 O ATOM 411 CB SER A 29 -6.947 10.455 5.298 1.00 0.00 C ATOM 412 OG SER A 29 -6.048 10.897 6.312 1.00 0.00 O ATOM 0 H SER A 29 -8.375 8.852 3.892 1.00 0.00 H new ATOM 0 HA SER A 29 -7.587 8.982 6.705 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.386 9.951 4.511 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.431 11.318 4.841 1.00 0.00 H new ATOM 0 HG SER A 29 -5.382 11.499 5.919 1.00 0.00 H new ATOM 418 N THR A 30 -9.481 10.253 7.610 1.00 0.00 N ATOM 419 CA THR A 30 -10.614 10.957 8.186 1.00 0.00 C ATOM 420 C THR A 30 -10.216 12.383 8.570 1.00 0.00 C ATOM 421 O THR A 30 -10.798 12.970 9.481 1.00 0.00 O ATOM 422 CB THR A 30 -11.133 10.133 9.366 1.00 0.00 C ATOM 423 OG1 THR A 30 -10.040 10.108 10.280 1.00 0.00 O ATOM 424 CG2 THR A 30 -11.348 8.662 9.003 1.00 0.00 C ATOM 0 H THR A 30 -8.911 9.740 8.282 1.00 0.00 H new ATOM 0 HA THR A 30 -11.423 11.062 7.463 1.00 0.00 H new ATOM 0 HB THR A 30 -12.070 10.560 9.722 1.00 0.00 H new ATOM 0 HG1 THR A 30 -10.291 9.595 11.076 1.00 0.00 H new ATOM 0 HG21 THR A 30 -11.717 8.122 9.875 1.00 0.00 H new ATOM 0 HG22 THR A 30 -12.077 8.589 8.196 1.00 0.00 H new ATOM 0 HG23 THR A 30 -10.403 8.225 8.679 1.00 0.00 H new ATOM 432 N VAL A 31 -9.227 12.900 7.856 1.00 0.00 N ATOM 433 CA VAL A 31 -8.744 14.247 8.110 1.00 0.00 C ATOM 434 C VAL A 31 -8.306 14.884 6.790 1.00 0.00 C ATOM 435 O VAL A 31 -8.668 16.023 6.496 1.00 0.00 O ATOM 436 CB VAL A 31 -7.629 14.214 9.157 1.00 0.00 C ATOM 437 CG1 VAL A 31 -8.117 13.573 10.458 1.00 0.00 C ATOM 438 CG2 VAL A 31 -6.393 13.490 8.619 1.00 0.00 C ATOM 0 H VAL A 31 -8.747 12.410 7.101 1.00 0.00 H new ATOM 0 HA VAL A 31 -9.540 14.867 8.522 1.00 0.00 H new ATOM 0 HB VAL A 31 -7.345 15.243 9.377 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.305 13.562 11.185 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -8.953 14.148 10.856 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -8.441 12.551 10.261 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.616 13.481 9.383 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -6.657 12.465 8.357 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.025 14.008 7.733 1.00 0.00 H new ATOM 448 N GLU A 32 -7.533 14.123 6.030 1.00 0.00 N ATOM 449 CA GLU A 32 -7.042 14.600 4.748 1.00 0.00 C ATOM 450 C GLU A 32 -7.922 14.073 3.613 1.00 0.00 C ATOM 451 O GLU A 32 -8.073 12.864 3.449 1.00 0.00 O ATOM 452 CB GLU A 32 -5.580 14.200 4.538 1.00 0.00 C ATOM 453 CG GLU A 32 -4.690 15.435 4.384 1.00 0.00 C ATOM 454 CD GLU A 32 -3.300 15.187 4.974 1.00 0.00 C ATOM 455 OE1 GLU A 32 -2.458 14.638 4.231 1.00 0.00 O ATOM 456 OE2 GLU A 32 -3.112 15.551 6.155 1.00 0.00 O ATOM 0 H GLU A 32 -7.234 13.179 6.277 1.00 0.00 H new ATOM 0 HA GLU A 32 -7.091 15.689 4.745 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -5.237 13.604 5.384 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -5.495 13.573 3.650 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -4.600 15.693 3.329 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -5.154 16.286 4.882 1.00 0.00 H new ATOM 463 N ARG A 33 -8.481 15.008 2.858 1.00 0.00 N ATOM 464 CA ARG A 33 -9.343 14.654 1.744 1.00 0.00 C ATOM 465 C ARG A 33 -8.536 13.948 0.652 1.00 0.00 C ATOM 466 O ARG A 33 -7.359 14.248 0.453 1.00 0.00 O ATOM 467 CB ARG A 33 -10.015 15.894 1.150 1.00 0.00 C ATOM 468 CG ARG A 33 -10.954 16.547 2.166 1.00 0.00 C ATOM 469 CD ARG A 33 -12.404 16.123 1.924 1.00 0.00 C ATOM 470 NE ARG A 33 -13.327 17.174 2.410 1.00 0.00 N ATOM 471 CZ ARG A 33 -13.552 18.329 1.771 1.00 0.00 C ATOM 472 NH1 ARG A 33 -12.923 18.591 0.617 1.00 0.00 N ATOM 473 NH2 ARG A 33 -14.406 19.224 2.286 1.00 0.00 N ATOM 0 H ARG A 33 -8.353 16.010 2.996 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.114 13.983 2.123 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -9.255 16.610 0.839 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -10.575 15.616 0.257 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -10.654 16.268 3.176 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -10.872 17.632 2.097 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -12.567 15.947 0.861 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -12.607 15.183 2.437 1.00 0.00 H new ATOM 0 HE ARG A 33 -13.822 17.008 3.286 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -12.272 17.910 0.225 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -13.095 19.471 0.131 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -14.885 19.025 3.165 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -14.578 20.104 1.799 1.00 0.00 H new ATOM 487 N ARG A 34 -9.200 13.024 -0.027 1.00 0.00 N ATOM 488 CA ARG A 34 -8.558 12.274 -1.093 1.00 0.00 C ATOM 489 C ARG A 34 -7.185 11.776 -0.640 1.00 0.00 C ATOM 490 O ARG A 34 -6.172 12.079 -1.269 1.00 0.00 O ATOM 491 CB ARG A 34 -8.393 13.133 -2.349 1.00 0.00 C ATOM 492 CG ARG A 34 -9.575 14.090 -2.517 1.00 0.00 C ATOM 493 CD ARG A 34 -9.637 14.638 -3.945 1.00 0.00 C ATOM 494 NE ARG A 34 -8.748 15.814 -4.075 1.00 0.00 N ATOM 495 CZ ARG A 34 -9.051 17.039 -3.624 1.00 0.00 C ATOM 496 NH1 ARG A 34 -10.223 17.256 -3.011 1.00 0.00 N ATOM 497 NH2 ARG A 34 -8.183 18.047 -3.786 1.00 0.00 N ATOM 0 H ARG A 34 -10.176 12.778 0.140 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.196 11.423 -1.330 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.466 13.702 -2.286 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -8.313 12.490 -3.226 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -10.504 13.571 -2.282 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -9.483 14.915 -1.811 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -9.337 13.865 -4.653 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -10.661 14.917 -4.192 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.848 15.684 -4.537 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -10.884 16.489 -2.888 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -10.454 18.188 -2.668 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -7.291 17.882 -4.253 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -8.414 18.979 -3.443 1.00 0.00 H new ATOM 511 N ALA A 35 -7.194 11.021 0.448 1.00 0.00 N ATOM 512 CA ALA A 35 -5.961 10.478 0.993 1.00 0.00 C ATOM 513 C ALA A 35 -6.269 9.186 1.752 1.00 0.00 C ATOM 514 O ALA A 35 -7.142 9.164 2.619 1.00 0.00 O ATOM 515 CB ALA A 35 -5.288 11.528 1.879 1.00 0.00 C ATOM 0 H ALA A 35 -8.036 10.772 0.967 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.264 10.232 0.192 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.363 11.121 2.288 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.063 12.414 1.286 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.958 11.798 2.696 1.00 0.00 H new ATOM 521 N ILE A 36 -5.536 8.140 1.399 1.00 0.00 N ATOM 522 CA ILE A 36 -5.720 6.848 2.036 1.00 0.00 C ATOM 523 C ILE A 36 -4.497 6.530 2.898 1.00 0.00 C ATOM 524 O ILE A 36 -3.365 6.806 2.502 1.00 0.00 O ATOM 525 CB ILE A 36 -6.032 5.775 0.991 1.00 0.00 C ATOM 526 CG1 ILE A 36 -7.385 6.034 0.326 1.00 0.00 C ATOM 527 CG2 ILE A 36 -5.953 4.374 1.603 1.00 0.00 C ATOM 528 CD1 ILE A 36 -7.568 5.149 -0.909 1.00 0.00 C ATOM 0 H ILE A 36 -4.813 8.162 0.680 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.582 6.871 2.702 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.274 5.829 0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -8.187 5.841 1.038 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -7.459 7.083 0.040 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.179 3.630 0.839 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.949 4.202 1.991 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.675 4.291 2.415 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.538 5.353 -1.363 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -6.778 5.362 -1.630 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -7.518 4.100 -0.616 1.00 0.00 H new ATOM 540 N ASN A 37 -4.765 5.953 4.061 1.00 0.00 N ATOM 541 CA ASN A 37 -3.700 5.595 4.981 1.00 0.00 C ATOM 542 C ASN A 37 -3.392 4.103 4.842 1.00 0.00 C ATOM 543 O ASN A 37 -4.141 3.262 5.336 1.00 0.00 O ATOM 544 CB ASN A 37 -4.113 5.859 6.431 1.00 0.00 C ATOM 545 CG ASN A 37 -3.246 6.953 7.057 1.00 0.00 C ATOM 546 OD1 ASN A 37 -2.059 6.785 7.287 1.00 0.00 O ATOM 547 ND2 ASN A 37 -3.902 8.079 7.319 1.00 0.00 N ATOM 0 H ASN A 37 -5.704 5.725 4.386 1.00 0.00 H new ATOM 0 HA ASN A 37 -2.827 6.201 4.738 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -5.161 6.156 6.466 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -4.022 4.941 7.012 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -3.412 8.869 7.738 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -4.896 8.153 7.101 1.00 0.00 H new ATOM 554 N LEU A 38 -2.287 3.820 4.167 1.00 0.00 N ATOM 555 CA LEU A 38 -1.871 2.444 3.956 1.00 0.00 C ATOM 556 C LEU A 38 -1.019 1.986 5.141 1.00 0.00 C ATOM 557 O LEU A 38 -0.115 2.700 5.573 1.00 0.00 O ATOM 558 CB LEU A 38 -1.172 2.296 2.603 1.00 0.00 C ATOM 559 CG LEU A 38 -1.575 1.079 1.768 1.00 0.00 C ATOM 560 CD1 LEU A 38 -0.832 -0.175 2.234 1.00 0.00 C ATOM 561 CD2 LEU A 38 -3.092 0.884 1.780 1.00 0.00 C ATOM 0 H LEU A 38 -1.667 4.520 3.759 1.00 0.00 H new ATOM 0 HA LEU A 38 -2.739 1.786 3.913 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.366 3.194 2.016 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.097 2.253 2.775 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.282 1.262 0.734 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -1.136 -1.026 1.624 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.242 -0.021 2.131 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.072 -0.373 3.279 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.352 0.012 1.179 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.431 0.732 2.805 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.576 1.768 1.365 1.00 0.00 H new ATOM 573 N THR A 39 -1.337 0.798 5.634 1.00 0.00 N ATOM 574 CA THR A 39 -0.612 0.236 6.761 1.00 0.00 C ATOM 575 C THR A 39 -0.504 -1.284 6.622 1.00 0.00 C ATOM 576 O THR A 39 -1.512 -1.968 6.453 1.00 0.00 O ATOM 577 CB THR A 39 -1.316 0.681 8.045 1.00 0.00 C ATOM 578 OG1 THR A 39 -2.595 0.057 7.973 1.00 0.00 O ATOM 579 CG2 THR A 39 -1.631 2.178 8.051 1.00 0.00 C ATOM 0 H THR A 39 -2.087 0.209 5.273 1.00 0.00 H new ATOM 0 HA THR A 39 0.415 0.601 6.793 1.00 0.00 H new ATOM 0 HB THR A 39 -0.691 0.438 8.905 1.00 0.00 H new ATOM 0 HG1 THR A 39 -2.532 -0.758 7.432 1.00 0.00 H new ATOM 0 HG21 THR A 39 -2.130 2.441 8.984 1.00 0.00 H new ATOM 0 HG22 THR A 39 -0.704 2.745 7.963 1.00 0.00 H new ATOM 0 HG23 THR A 39 -2.284 2.416 7.211 1.00 0.00 H new ATOM 587 N TRP A 40 0.727 -1.767 6.700 1.00 0.00 N ATOM 588 CA TRP A 40 0.979 -3.193 6.585 1.00 0.00 C ATOM 589 C TRP A 40 1.930 -3.597 7.713 1.00 0.00 C ATOM 590 O TRP A 40 2.351 -2.757 8.506 1.00 0.00 O ATOM 591 CB TRP A 40 1.516 -3.545 5.196 1.00 0.00 C ATOM 592 CG TRP A 40 2.800 -2.803 4.819 1.00 0.00 C ATOM 593 CD1 TRP A 40 4.058 -3.264 4.848 1.00 0.00 C ATOM 594 CD2 TRP A 40 2.901 -1.442 4.352 1.00 0.00 C ATOM 595 NE1 TRP A 40 4.959 -2.303 4.436 1.00 0.00 N ATOM 596 CE2 TRP A 40 4.233 -1.160 4.124 1.00 0.00 C ATOM 597 CE3 TRP A 40 1.900 -0.480 4.129 1.00 0.00 C ATOM 598 CZ2 TRP A 40 4.685 0.082 3.662 1.00 0.00 C ATOM 599 CZ3 TRP A 40 2.369 0.756 3.667 1.00 0.00 C ATOM 600 CH2 TRP A 40 3.706 1.056 3.433 1.00 0.00 C ATOM 0 H TRP A 40 1.561 -1.196 6.841 1.00 0.00 H new ATOM 0 HA TRP A 40 0.053 -3.758 6.691 1.00 0.00 H new ATOM 0 HB2 TRP A 40 1.702 -4.618 5.151 1.00 0.00 H new ATOM 0 HB3 TRP A 40 0.749 -3.323 4.454 1.00 0.00 H new ATOM 0 HD1 TRP A 40 4.332 -4.262 5.155 1.00 0.00 H new ATOM 0 HE1 TRP A 40 5.971 -2.412 4.372 1.00 0.00 H new ATOM 0 HE3 TRP A 40 0.852 -0.679 4.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 5.733 0.278 3.491 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 1.640 1.531 3.479 1.00 0.00 H new ATOM 0 HH2 TRP A 40 3.988 2.036 3.076 1.00 0.00 H new ATOM 611 N THR A 41 2.241 -4.885 7.750 1.00 0.00 N ATOM 612 CA THR A 41 3.134 -5.411 8.768 1.00 0.00 C ATOM 613 C THR A 41 4.521 -5.670 8.178 1.00 0.00 C ATOM 614 O THR A 41 4.661 -5.862 6.971 1.00 0.00 O ATOM 615 CB THR A 41 2.485 -6.660 9.366 1.00 0.00 C ATOM 616 OG1 THR A 41 1.631 -6.153 10.388 1.00 0.00 O ATOM 617 CG2 THR A 41 3.487 -7.537 10.120 1.00 0.00 C ATOM 0 H THR A 41 1.890 -5.580 7.091 1.00 0.00 H new ATOM 0 HA THR A 41 3.287 -4.690 9.571 1.00 0.00 H new ATOM 0 HB THR A 41 2.019 -7.242 8.571 1.00 0.00 H new ATOM 0 HG1 THR A 41 1.169 -6.897 10.827 1.00 0.00 H new ATOM 0 HG21 THR A 41 2.974 -8.410 10.524 1.00 0.00 H new ATOM 0 HG22 THR A 41 4.272 -7.861 9.437 1.00 0.00 H new ATOM 0 HG23 THR A 41 3.929 -6.965 10.936 1.00 0.00 H new ATOM 625 N LYS A 42 5.513 -5.668 9.056 1.00 0.00 N ATOM 626 CA LYS A 42 6.885 -5.900 8.638 1.00 0.00 C ATOM 627 C LYS A 42 7.101 -7.400 8.425 1.00 0.00 C ATOM 628 O LYS A 42 7.074 -8.176 9.379 1.00 0.00 O ATOM 629 CB LYS A 42 7.863 -5.273 9.633 1.00 0.00 C ATOM 630 CG LYS A 42 9.096 -4.720 8.916 1.00 0.00 C ATOM 631 CD LYS A 42 10.169 -5.799 8.761 1.00 0.00 C ATOM 632 CE LYS A 42 11.562 -5.176 8.654 1.00 0.00 C ATOM 633 NZ LYS A 42 11.953 -4.557 9.941 1.00 0.00 N ATOM 0 H LYS A 42 5.394 -5.509 10.056 1.00 0.00 H new ATOM 0 HA LYS A 42 7.081 -5.410 7.684 1.00 0.00 H new ATOM 0 HB2 LYS A 42 7.367 -4.472 10.180 1.00 0.00 H new ATOM 0 HB3 LYS A 42 8.169 -6.019 10.367 1.00 0.00 H new ATOM 0 HG2 LYS A 42 8.811 -4.342 7.934 1.00 0.00 H new ATOM 0 HG3 LYS A 42 9.500 -3.878 9.477 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.134 -6.476 9.614 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.964 -6.395 7.872 1.00 0.00 H new ATOM 0 HE2 LYS A 42 12.288 -5.940 8.376 1.00 0.00 H new ATOM 0 HE3 LYS A 42 11.571 -4.425 7.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 12.990 -4.523 10.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 11.570 -3.591 9.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 11.573 -5.122 10.727 1.00 0.00 H new ATOM 647 N PRO A 43 7.317 -7.772 7.135 1.00 0.00 N ATOM 648 CA PRO A 43 7.538 -9.165 6.785 1.00 0.00 C ATOM 649 C PRO A 43 8.944 -9.615 7.186 1.00 0.00 C ATOM 650 O PRO A 43 9.743 -8.812 7.666 1.00 0.00 O ATOM 651 CB PRO A 43 7.296 -9.237 5.286 1.00 0.00 C ATOM 652 CG PRO A 43 7.405 -7.809 4.777 1.00 0.00 C ATOM 653 CD PRO A 43 7.355 -6.880 5.980 1.00 0.00 C ATOM 0 HA PRO A 43 6.870 -9.843 7.316 1.00 0.00 H new ATOM 0 HB2 PRO A 43 8.030 -9.881 4.802 1.00 0.00 H new ATOM 0 HB3 PRO A 43 6.313 -9.655 5.069 1.00 0.00 H new ATOM 0 HG2 PRO A 43 8.335 -7.670 4.226 1.00 0.00 H new ATOM 0 HG3 PRO A 43 6.590 -7.586 4.088 1.00 0.00 H new ATOM 0 HD2 PRO A 43 8.227 -6.227 6.013 1.00 0.00 H new ATOM 0 HD3 PRO A 43 6.476 -6.237 5.947 1.00 0.00 H new ATOM 661 N PHE A 44 9.204 -10.896 6.974 1.00 0.00 N ATOM 662 CA PHE A 44 10.500 -11.462 7.308 1.00 0.00 C ATOM 663 C PHE A 44 11.465 -11.358 6.125 1.00 0.00 C ATOM 664 O PHE A 44 11.156 -11.815 5.025 1.00 0.00 O ATOM 665 CB PHE A 44 10.272 -12.939 7.636 1.00 0.00 C ATOM 666 CG PHE A 44 11.558 -13.721 7.911 1.00 0.00 C ATOM 667 CD1 PHE A 44 12.433 -13.968 6.899 1.00 0.00 C ATOM 668 CD2 PHE A 44 11.826 -14.170 9.166 1.00 0.00 C ATOM 669 CE1 PHE A 44 13.627 -14.693 7.154 1.00 0.00 C ATOM 670 CE2 PHE A 44 13.020 -14.895 9.421 1.00 0.00 C ATOM 671 CZ PHE A 44 13.895 -15.142 8.410 1.00 0.00 C ATOM 0 H PHE A 44 8.539 -11.559 6.575 1.00 0.00 H new ATOM 0 HA PHE A 44 10.937 -10.921 8.148 1.00 0.00 H new ATOM 0 HB2 PHE A 44 9.622 -13.011 8.508 1.00 0.00 H new ATOM 0 HB3 PHE A 44 9.744 -13.408 6.805 1.00 0.00 H new ATOM 0 HD1 PHE A 44 12.220 -13.613 5.902 1.00 0.00 H new ATOM 0 HD2 PHE A 44 11.131 -13.975 9.969 1.00 0.00 H new ATOM 0 HE1 PHE A 44 14.322 -14.888 6.351 1.00 0.00 H new ATOM 0 HE2 PHE A 44 13.233 -15.250 10.418 1.00 0.00 H new ATOM 0 HZ PHE A 44 14.803 -15.694 8.604 1.00 0.00 H new ATOM 681 N ASP A 45 12.613 -10.754 6.390 1.00 0.00 N ATOM 682 CA ASP A 45 13.625 -10.584 5.361 1.00 0.00 C ATOM 683 C ASP A 45 14.392 -11.896 5.184 1.00 0.00 C ATOM 684 O ASP A 45 14.901 -12.457 6.153 1.00 0.00 O ATOM 685 CB ASP A 45 14.630 -9.498 5.751 1.00 0.00 C ATOM 686 CG ASP A 45 15.766 -9.966 6.663 1.00 0.00 C ATOM 687 OD1 ASP A 45 15.444 -10.431 7.778 1.00 0.00 O ATOM 688 OD2 ASP A 45 16.931 -9.847 6.226 1.00 0.00 O ATOM 0 H ASP A 45 12.866 -10.376 7.303 1.00 0.00 H new ATOM 0 HA ASP A 45 13.122 -10.296 4.438 1.00 0.00 H new ATOM 0 HB2 ASP A 45 15.063 -9.081 4.842 1.00 0.00 H new ATOM 0 HB3 ASP A 45 14.094 -8.690 6.249 1.00 0.00 H new ATOM 693 N GLY A 46 14.450 -12.347 3.940 1.00 0.00 N ATOM 694 CA GLY A 46 15.146 -13.582 3.623 1.00 0.00 C ATOM 695 C GLY A 46 16.465 -13.681 4.392 1.00 0.00 C ATOM 696 O GLY A 46 16.640 -14.575 5.219 1.00 0.00 O ATOM 0 H GLY A 46 14.026 -11.879 3.139 1.00 0.00 H new ATOM 0 HA2 GLY A 46 14.513 -14.434 3.869 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.341 -13.629 2.552 1.00 0.00 H new ATOM 700 N ASN A 47 17.359 -12.750 4.092 1.00 0.00 N ATOM 701 CA ASN A 47 18.657 -12.721 4.744 1.00 0.00 C ATOM 702 C ASN A 47 19.385 -11.430 4.365 1.00 0.00 C ATOM 703 O ASN A 47 20.610 -11.412 4.260 1.00 0.00 O ATOM 704 CB ASN A 47 19.523 -13.901 4.299 1.00 0.00 C ATOM 705 CG ASN A 47 20.001 -14.716 5.503 1.00 0.00 C ATOM 706 OD1 ASN A 47 20.060 -14.238 6.625 1.00 0.00 O ATOM 707 ND2 ASN A 47 20.337 -15.968 5.210 1.00 0.00 N ATOM 0 H ASN A 47 17.210 -12.010 3.406 1.00 0.00 H new ATOM 0 HA ASN A 47 18.495 -12.778 5.820 1.00 0.00 H new ATOM 0 HB2 ASN A 47 18.953 -14.541 3.625 1.00 0.00 H new ATOM 0 HB3 ASN A 47 20.383 -13.534 3.739 1.00 0.00 H new ATOM 0 HD21 ASN A 47 20.668 -16.593 5.945 1.00 0.00 H new ATOM 0 HD22 ASN A 47 20.264 -16.304 4.250 1.00 0.00 H new ATOM 714 N SER A 48 18.599 -10.381 4.170 1.00 0.00 N ATOM 715 CA SER A 48 19.154 -9.089 3.805 1.00 0.00 C ATOM 716 C SER A 48 18.203 -7.970 4.237 1.00 0.00 C ATOM 717 O SER A 48 17.001 -8.190 4.371 1.00 0.00 O ATOM 718 CB SER A 48 19.419 -9.008 2.300 1.00 0.00 C ATOM 719 OG SER A 48 20.753 -8.599 2.014 1.00 0.00 O ATOM 0 H SER A 48 17.583 -10.400 4.258 1.00 0.00 H new ATOM 0 HA SER A 48 20.106 -8.968 4.321 1.00 0.00 H new ATOM 0 HB2 SER A 48 19.233 -9.982 1.846 1.00 0.00 H new ATOM 0 HB3 SER A 48 18.719 -8.306 1.846 1.00 0.00 H new ATOM 0 HG SER A 48 21.221 -9.317 1.539 1.00 0.00 H new ATOM 725 N PRO A 49 18.794 -6.764 4.449 1.00 0.00 N ATOM 726 CA PRO A 49 18.013 -5.611 4.863 1.00 0.00 C ATOM 727 C PRO A 49 17.203 -5.048 3.693 1.00 0.00 C ATOM 728 O PRO A 49 17.751 -4.787 2.623 1.00 0.00 O ATOM 729 CB PRO A 49 19.030 -4.623 5.411 1.00 0.00 C ATOM 730 CG PRO A 49 20.377 -5.063 4.860 1.00 0.00 C ATOM 731 CD PRO A 49 20.215 -6.466 4.300 1.00 0.00 C ATOM 0 HA PRO A 49 17.269 -5.857 5.620 1.00 0.00 H new ATOM 0 HB2 PRO A 49 18.794 -3.606 5.099 1.00 0.00 H new ATOM 0 HB3 PRO A 49 19.033 -4.629 6.501 1.00 0.00 H new ATOM 0 HG2 PRO A 49 20.713 -4.378 4.082 1.00 0.00 H new ATOM 0 HG3 PRO A 49 21.133 -5.050 5.645 1.00 0.00 H new ATOM 0 HD2 PRO A 49 20.522 -6.513 3.255 1.00 0.00 H new ATOM 0 HD3 PRO A 49 20.829 -7.183 4.845 1.00 0.00 H new ATOM 739 N LEU A 50 15.912 -4.877 3.936 1.00 0.00 N ATOM 740 CA LEU A 50 15.022 -4.350 2.916 1.00 0.00 C ATOM 741 C LEU A 50 15.695 -3.166 2.220 1.00 0.00 C ATOM 742 O LEU A 50 16.572 -2.521 2.792 1.00 0.00 O ATOM 743 CB LEU A 50 13.656 -4.013 3.519 1.00 0.00 C ATOM 744 CG LEU A 50 12.842 -5.199 4.040 1.00 0.00 C ATOM 745 CD1 LEU A 50 11.640 -4.722 4.857 1.00 0.00 C ATOM 746 CD2 LEU A 50 12.426 -6.123 2.894 1.00 0.00 C ATOM 0 H LEU A 50 15.461 -5.094 4.825 1.00 0.00 H new ATOM 0 HA LEU A 50 14.831 -5.103 2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 50 13.806 -3.312 4.340 1.00 0.00 H new ATOM 0 HB3 LEU A 50 13.065 -3.496 2.763 1.00 0.00 H new ATOM 0 HG LEU A 50 13.475 -5.781 4.709 1.00 0.00 H new ATOM 0 HD11 LEU A 50 11.078 -5.585 5.216 1.00 0.00 H new ATOM 0 HD12 LEU A 50 11.988 -4.136 5.708 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.996 -4.105 4.231 1.00 0.00 H new ATOM 0 HD21 LEU A 50 11.849 -6.958 3.291 1.00 0.00 H new ATOM 0 HD22 LEU A 50 11.817 -5.567 2.181 1.00 0.00 H new ATOM 0 HD23 LEU A 50 13.316 -6.503 2.392 1.00 0.00 H new ATOM 758 N ILE A 51 15.260 -2.916 0.993 1.00 0.00 N ATOM 759 CA ILE A 51 15.810 -1.821 0.212 1.00 0.00 C ATOM 760 C ILE A 51 14.711 -0.791 -0.058 1.00 0.00 C ATOM 761 O ILE A 51 14.866 0.386 0.265 1.00 0.00 O ATOM 762 CB ILE A 51 16.481 -2.352 -1.056 1.00 0.00 C ATOM 763 CG1 ILE A 51 17.845 -2.967 -0.739 1.00 0.00 C ATOM 764 CG2 ILE A 51 16.578 -1.260 -2.123 1.00 0.00 C ATOM 765 CD1 ILE A 51 18.547 -3.434 -2.016 1.00 0.00 C ATOM 0 H ILE A 51 14.533 -3.453 0.521 1.00 0.00 H new ATOM 0 HA ILE A 51 16.595 -1.311 0.770 1.00 0.00 H new ATOM 0 HB ILE A 51 15.858 -3.147 -1.465 1.00 0.00 H new ATOM 0 HG12 ILE A 51 18.467 -2.235 -0.225 1.00 0.00 H new ATOM 0 HG13 ILE A 51 17.719 -3.810 -0.060 1.00 0.00 H new ATOM 0 HG21 ILE A 51 17.059 -1.664 -3.014 1.00 0.00 H new ATOM 0 HG22 ILE A 51 15.578 -0.910 -2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.167 -0.427 -1.739 1.00 0.00 H new ATOM 0 HD11 ILE A 51 19.514 -3.867 -1.762 1.00 0.00 H new ATOM 0 HD12 ILE A 51 17.933 -4.184 -2.515 1.00 0.00 H new ATOM 0 HD13 ILE A 51 18.694 -2.584 -2.682 1.00 0.00 H new ATOM 777 N ARG A 52 13.626 -1.271 -0.647 1.00 0.00 N ATOM 778 CA ARG A 52 12.502 -0.407 -0.964 1.00 0.00 C ATOM 779 C ARG A 52 11.224 -1.233 -1.118 1.00 0.00 C ATOM 780 O ARG A 52 11.256 -2.458 -1.011 1.00 0.00 O ATOM 781 CB ARG A 52 12.755 0.374 -2.255 1.00 0.00 C ATOM 782 CG ARG A 52 12.473 -0.493 -3.484 1.00 0.00 C ATOM 783 CD ARG A 52 12.881 0.230 -4.770 1.00 0.00 C ATOM 784 NE ARG A 52 14.355 0.249 -4.894 1.00 0.00 N ATOM 785 CZ ARG A 52 15.011 0.565 -6.019 1.00 0.00 C ATOM 786 NH1 ARG A 52 14.326 0.889 -7.125 1.00 0.00 N ATOM 787 NH2 ARG A 52 16.350 0.556 -6.039 1.00 0.00 N ATOM 0 H ARG A 52 13.501 -2.248 -0.913 1.00 0.00 H new ATOM 0 HA ARG A 52 12.385 0.299 -0.142 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.122 1.261 -2.278 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.788 0.720 -2.279 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.018 -1.434 -3.403 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.412 -0.741 -3.523 1.00 0.00 H new ATOM 0 HD2 ARG A 52 12.442 -0.270 -5.633 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.495 1.249 -4.762 1.00 0.00 H new ATOM 0 HE ARG A 52 14.907 0.006 -4.071 1.00 0.00 H new ATOM 0 HH11 ARG A 52 13.306 0.895 -7.110 1.00 0.00 H new ATOM 0 HH12 ARG A 52 14.825 1.130 -7.982 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.871 0.309 -5.198 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.849 0.797 -6.896 1.00 0.00 H new ATOM 801 N TYR A 53 10.129 -0.529 -1.365 1.00 0.00 N ATOM 802 CA TYR A 53 8.842 -1.183 -1.535 1.00 0.00 C ATOM 803 C TYR A 53 8.115 -0.650 -2.771 1.00 0.00 C ATOM 804 O TYR A 53 8.068 0.558 -2.995 1.00 0.00 O ATOM 805 CB TYR A 53 8.025 -0.834 -0.289 1.00 0.00 C ATOM 806 CG TYR A 53 8.034 -1.924 0.786 1.00 0.00 C ATOM 807 CD1 TYR A 53 9.104 -2.031 1.650 1.00 0.00 C ATOM 808 CD2 TYR A 53 6.972 -2.799 0.890 1.00 0.00 C ATOM 809 CE1 TYR A 53 9.113 -3.057 2.661 1.00 0.00 C ATOM 810 CE2 TYR A 53 6.980 -3.824 1.901 1.00 0.00 C ATOM 811 CZ TYR A 53 8.050 -3.902 2.737 1.00 0.00 C ATOM 812 OH TYR A 53 8.058 -4.870 3.692 1.00 0.00 O ATOM 0 H TYR A 53 10.106 0.487 -1.451 1.00 0.00 H new ATOM 0 HA TYR A 53 8.972 -2.258 -1.664 1.00 0.00 H new ATOM 0 HB2 TYR A 53 8.413 0.089 0.141 1.00 0.00 H new ATOM 0 HB3 TYR A 53 6.994 -0.639 -0.586 1.00 0.00 H new ATOM 0 HD1 TYR A 53 9.935 -1.346 1.568 1.00 0.00 H new ATOM 0 HD2 TYR A 53 6.135 -2.715 0.213 1.00 0.00 H new ATOM 0 HE1 TYR A 53 9.945 -3.153 3.343 1.00 0.00 H new ATOM 0 HE2 TYR A 53 6.155 -4.515 1.993 1.00 0.00 H new ATOM 0 HH TYR A 53 7.156 -5.240 3.791 1.00 0.00 H new ATOM 822 N ILE A 54 7.568 -1.579 -3.542 1.00 0.00 N ATOM 823 CA ILE A 54 6.846 -1.218 -4.750 1.00 0.00 C ATOM 824 C ILE A 54 5.342 -1.340 -4.497 1.00 0.00 C ATOM 825 O ILE A 54 4.789 -2.438 -4.538 1.00 0.00 O ATOM 826 CB ILE A 54 7.339 -2.048 -5.937 1.00 0.00 C ATOM 827 CG1 ILE A 54 8.867 -2.050 -6.008 1.00 0.00 C ATOM 828 CG2 ILE A 54 6.705 -1.567 -7.244 1.00 0.00 C ATOM 829 CD1 ILE A 54 9.365 -3.008 -7.092 1.00 0.00 C ATOM 0 H ILE A 54 7.610 -2.581 -3.353 1.00 0.00 H new ATOM 0 HA ILE A 54 7.042 -0.179 -5.014 1.00 0.00 H new ATOM 0 HB ILE A 54 7.022 -3.080 -5.787 1.00 0.00 H new ATOM 0 HG12 ILE A 54 9.226 -1.042 -6.216 1.00 0.00 H new ATOM 0 HG13 ILE A 54 9.279 -2.342 -5.042 1.00 0.00 H new ATOM 0 HG21 ILE A 54 7.072 -2.174 -8.072 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.621 -1.661 -7.179 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.969 -0.523 -7.414 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.454 -2.990 -7.121 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.025 -4.019 -6.868 1.00 0.00 H new ATOM 0 HD13 ILE A 54 8.971 -2.698 -8.060 1.00 0.00 H new ATOM 841 N LEU A 55 4.723 -0.198 -4.239 1.00 0.00 N ATOM 842 CA LEU A 55 3.294 -0.163 -3.979 1.00 0.00 C ATOM 843 C LEU A 55 2.540 -0.068 -5.307 1.00 0.00 C ATOM 844 O LEU A 55 2.785 0.840 -6.100 1.00 0.00 O ATOM 845 CB LEU A 55 2.955 0.960 -2.997 1.00 0.00 C ATOM 846 CG LEU A 55 1.494 1.414 -2.975 1.00 0.00 C ATOM 847 CD1 LEU A 55 0.675 0.579 -1.989 1.00 0.00 C ATOM 848 CD2 LEU A 55 1.389 2.912 -2.682 1.00 0.00 C ATOM 0 H LEU A 55 5.185 0.711 -4.204 1.00 0.00 H new ATOM 0 HA LEU A 55 2.972 -1.085 -3.495 1.00 0.00 H new ATOM 0 HB2 LEU A 55 3.228 0.633 -1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 55 3.579 1.822 -3.232 1.00 0.00 H new ATOM 0 HG LEU A 55 1.071 1.249 -3.966 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -0.359 0.922 -1.993 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.710 -0.470 -2.283 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.090 0.689 -0.987 1.00 0.00 H new ATOM 0 HD21 LEU A 55 0.340 3.208 -2.672 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.835 3.125 -1.711 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.917 3.472 -3.454 1.00 0.00 H new ATOM 860 N GLU A 56 1.637 -1.017 -5.508 1.00 0.00 N ATOM 861 CA GLU A 56 0.846 -1.051 -6.726 1.00 0.00 C ATOM 862 C GLU A 56 -0.624 -0.763 -6.412 1.00 0.00 C ATOM 863 O GLU A 56 -1.251 -1.487 -5.640 1.00 0.00 O ATOM 864 CB GLU A 56 1.001 -2.393 -7.443 1.00 0.00 C ATOM 865 CG GLU A 56 2.294 -2.432 -8.260 1.00 0.00 C ATOM 866 CD GLU A 56 1.993 -2.512 -9.758 1.00 0.00 C ATOM 867 OE1 GLU A 56 1.171 -1.689 -10.217 1.00 0.00 O ATOM 868 OE2 GLU A 56 2.592 -3.394 -10.412 1.00 0.00 O ATOM 0 H GLU A 56 1.436 -1.768 -4.848 1.00 0.00 H new ATOM 0 HA GLU A 56 1.213 -0.274 -7.397 1.00 0.00 H new ATOM 0 HB2 GLU A 56 1.004 -3.202 -6.712 1.00 0.00 H new ATOM 0 HB3 GLU A 56 0.147 -2.560 -8.099 1.00 0.00 H new ATOM 0 HG2 GLU A 56 2.887 -1.542 -8.052 1.00 0.00 H new ATOM 0 HG3 GLU A 56 2.893 -3.292 -7.959 1.00 0.00 H new ATOM 875 N MET A 57 -1.131 0.295 -7.027 1.00 0.00 N ATOM 876 CA MET A 57 -2.515 0.687 -6.824 1.00 0.00 C ATOM 877 C MET A 57 -3.386 0.262 -8.008 1.00 0.00 C ATOM 878 O MET A 57 -2.969 0.371 -9.160 1.00 0.00 O ATOM 879 CB MET A 57 -2.596 2.205 -6.650 1.00 0.00 C ATOM 880 CG MET A 57 -4.046 2.688 -6.713 1.00 0.00 C ATOM 881 SD MET A 57 -4.097 4.472 -6.692 1.00 0.00 S ATOM 882 CE MET A 57 -3.984 4.806 -8.442 1.00 0.00 C ATOM 0 H MET A 57 -0.608 0.893 -7.666 1.00 0.00 H new ATOM 0 HA MET A 57 -2.885 0.189 -5.928 1.00 0.00 H new ATOM 0 HB2 MET A 57 -2.156 2.489 -5.694 1.00 0.00 H new ATOM 0 HB3 MET A 57 -2.012 2.695 -7.428 1.00 0.00 H new ATOM 0 HG2 MET A 57 -4.524 2.313 -7.618 1.00 0.00 H new ATOM 0 HG3 MET A 57 -4.608 2.290 -5.868 1.00 0.00 H new ATOM 0 HE1 MET A 57 -4.002 5.883 -8.609 1.00 0.00 H new ATOM 0 HE2 MET A 57 -3.053 4.394 -8.832 1.00 0.00 H new ATOM 0 HE3 MET A 57 -4.828 4.345 -8.956 1.00 0.00 H new ATOM 892 N SER A 58 -4.579 -0.214 -7.684 1.00 0.00 N ATOM 893 CA SER A 58 -5.511 -0.657 -8.706 1.00 0.00 C ATOM 894 C SER A 58 -6.843 0.081 -8.554 1.00 0.00 C ATOM 895 O SER A 58 -7.543 -0.093 -7.558 1.00 0.00 O ATOM 896 CB SER A 58 -5.732 -2.169 -8.634 1.00 0.00 C ATOM 897 OG SER A 58 -7.096 -2.521 -8.846 1.00 0.00 O ATOM 0 H SER A 58 -4.922 -0.303 -6.727 1.00 0.00 H new ATOM 0 HA SER A 58 -5.083 -0.426 -9.681 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.110 -2.662 -9.381 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.410 -2.536 -7.659 1.00 0.00 H new ATOM 0 HG SER A 58 -7.381 -3.155 -8.155 1.00 0.00 H new ATOM 903 N GLU A 59 -7.152 0.890 -9.557 1.00 0.00 N ATOM 904 CA GLU A 59 -8.387 1.655 -9.548 1.00 0.00 C ATOM 905 C GLU A 59 -9.574 0.753 -9.894 1.00 0.00 C ATOM 906 O GLU A 59 -9.579 -0.429 -9.553 1.00 0.00 O ATOM 907 CB GLU A 59 -8.304 2.843 -10.508 1.00 0.00 C ATOM 908 CG GLU A 59 -9.154 4.013 -10.009 1.00 0.00 C ATOM 909 CD GLU A 59 -9.508 4.962 -11.155 1.00 0.00 C ATOM 910 OE1 GLU A 59 -8.594 5.697 -11.587 1.00 0.00 O ATOM 911 OE2 GLU A 59 -10.685 4.932 -11.574 1.00 0.00 O ATOM 0 H GLU A 59 -6.568 1.032 -10.381 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.537 2.051 -8.544 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.266 3.161 -10.610 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.643 2.539 -11.498 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.067 3.634 -9.551 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.612 4.557 -9.236 1.00 0.00 H new ATOM 918 N ASN A 60 -10.550 1.344 -10.567 1.00 0.00 N ATOM 919 CA ASN A 60 -11.739 0.609 -10.962 1.00 0.00 C ATOM 920 C ASN A 60 -11.386 -0.344 -12.106 1.00 0.00 C ATOM 921 O ASN A 60 -11.338 0.063 -13.266 1.00 0.00 O ATOM 922 CB ASN A 60 -12.833 1.556 -11.457 1.00 0.00 C ATOM 923 CG ASN A 60 -13.483 2.300 -10.289 1.00 0.00 C ATOM 924 OD1 ASN A 60 -14.188 1.731 -9.471 1.00 0.00 O ATOM 925 ND2 ASN A 60 -13.208 3.601 -10.256 1.00 0.00 N ATOM 0 H ASN A 60 -10.542 2.324 -10.849 1.00 0.00 H new ATOM 0 HA ASN A 60 -12.102 0.062 -10.092 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -12.408 2.274 -12.159 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -13.591 0.990 -11.999 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.595 4.185 -9.515 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -12.610 4.014 -10.972 1.00 0.00 H new ATOM 932 N ASN A 61 -11.148 -1.595 -11.740 1.00 0.00 N ATOM 933 CA ASN A 61 -10.801 -2.609 -12.721 1.00 0.00 C ATOM 934 C ASN A 61 -9.516 -2.197 -13.442 1.00 0.00 C ATOM 935 O ASN A 61 -9.182 -2.751 -14.488 1.00 0.00 O ATOM 936 CB ASN A 61 -11.904 -2.761 -13.770 1.00 0.00 C ATOM 937 CG ASN A 61 -12.558 -4.141 -13.683 1.00 0.00 C ATOM 938 OD1 ASN A 61 -11.992 -5.093 -13.171 1.00 0.00 O ATOM 939 ND2 ASN A 61 -13.777 -4.197 -14.211 1.00 0.00 N ATOM 0 H ASN A 61 -11.189 -1.929 -10.777 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.670 -3.555 -12.196 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.658 -1.988 -13.624 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.486 -2.615 -14.766 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -14.296 -5.075 -14.203 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -14.193 -3.362 -14.624 1.00 0.00 H new ATOM 946 N ALA A 62 -8.830 -1.228 -12.854 1.00 0.00 N ATOM 947 CA ALA A 62 -7.590 -0.735 -13.427 1.00 0.00 C ATOM 948 C ALA A 62 -6.475 -1.750 -13.168 1.00 0.00 C ATOM 949 O ALA A 62 -6.492 -2.452 -12.158 1.00 0.00 O ATOM 950 CB ALA A 62 -7.270 0.643 -12.845 1.00 0.00 C ATOM 0 H ALA A 62 -9.110 -0.771 -11.986 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.686 -0.618 -14.506 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.339 1.013 -13.275 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.079 1.335 -13.081 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -7.164 0.565 -11.763 1.00 0.00 H new ATOM 956 N PRO A 63 -5.507 -1.797 -14.122 1.00 0.00 N ATOM 957 CA PRO A 63 -4.386 -2.714 -14.007 1.00 0.00 C ATOM 958 C PRO A 63 -3.381 -2.224 -12.963 1.00 0.00 C ATOM 959 O PRO A 63 -3.157 -1.022 -12.828 1.00 0.00 O ATOM 960 CB PRO A 63 -3.797 -2.794 -15.406 1.00 0.00 C ATOM 961 CG PRO A 63 -4.315 -1.571 -16.146 1.00 0.00 C ATOM 962 CD PRO A 63 -5.454 -0.981 -15.331 1.00 0.00 C ATOM 0 HA PRO A 63 -4.686 -3.702 -13.658 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.708 -2.797 -15.372 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -4.103 -3.712 -15.907 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -3.519 -0.838 -16.276 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -4.661 -1.846 -17.142 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.270 0.067 -15.094 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.396 -1.023 -15.878 1.00 0.00 H new ATOM 970 N TRP A 64 -2.803 -3.179 -12.250 1.00 0.00 N ATOM 971 CA TRP A 64 -1.827 -2.860 -11.222 1.00 0.00 C ATOM 972 C TRP A 64 -0.880 -1.798 -11.783 1.00 0.00 C ATOM 973 O TRP A 64 -0.145 -2.056 -12.735 1.00 0.00 O ATOM 974 CB TRP A 64 -1.099 -4.119 -10.746 1.00 0.00 C ATOM 975 CG TRP A 64 -2.012 -5.153 -10.084 1.00 0.00 C ATOM 976 CD1 TRP A 64 -2.266 -6.406 -10.486 1.00 0.00 C ATOM 977 CD2 TRP A 64 -2.786 -4.971 -8.880 1.00 0.00 C ATOM 978 NE1 TRP A 64 -3.144 -7.042 -9.632 1.00 0.00 N ATOM 979 CE2 TRP A 64 -3.470 -6.142 -8.624 1.00 0.00 C ATOM 980 CE3 TRP A 64 -2.904 -3.854 -8.035 1.00 0.00 C ATOM 981 CZ2 TRP A 64 -4.320 -6.309 -7.524 1.00 0.00 C ATOM 982 CZ3 TRP A 64 -3.757 -4.037 -6.940 1.00 0.00 C ATOM 983 CH2 TRP A 64 -4.453 -5.209 -6.668 1.00 0.00 C ATOM 0 H TRP A 64 -2.992 -4.175 -12.364 1.00 0.00 H new ATOM 0 HA TRP A 64 -2.318 -2.456 -10.337 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -0.601 -4.582 -11.598 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -0.321 -3.831 -10.039 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -1.838 -6.861 -11.367 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -3.490 -7.997 -9.724 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.378 -2.928 -8.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -4.845 -7.236 -7.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.883 -3.209 -6.258 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -5.093 -5.271 -5.801 1.00 0.00 H new ATOM 994 N THR A 65 -0.927 -0.624 -11.169 1.00 0.00 N ATOM 995 CA THR A 65 -0.083 0.478 -11.595 1.00 0.00 C ATOM 996 C THR A 65 0.878 0.879 -10.474 1.00 0.00 C ATOM 997 O THR A 65 0.456 1.430 -9.458 1.00 0.00 O ATOM 998 CB THR A 65 -0.991 1.620 -12.054 1.00 0.00 C ATOM 999 OG1 THR A 65 -0.206 2.326 -13.011 1.00 0.00 O ATOM 1000 CG2 THR A 65 -1.243 2.648 -10.949 1.00 0.00 C ATOM 0 H THR A 65 -1.537 -0.413 -10.379 1.00 0.00 H new ATOM 0 HA THR A 65 0.549 0.189 -12.435 1.00 0.00 H new ATOM 0 HB THR A 65 -1.942 1.212 -12.395 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.720 3.083 -13.361 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.893 3.437 -11.327 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.721 2.160 -10.100 1.00 0.00 H new ATOM 0 HG23 THR A 65 -0.294 3.081 -10.631 1.00 0.00 H new ATOM 1008 N VAL A 66 2.151 0.586 -10.696 1.00 0.00 N ATOM 1009 CA VAL A 66 3.175 0.909 -9.716 1.00 0.00 C ATOM 1010 C VAL A 66 3.108 2.402 -9.388 1.00 0.00 C ATOM 1011 O VAL A 66 3.599 3.231 -10.152 1.00 0.00 O ATOM 1012 CB VAL A 66 4.547 0.471 -10.231 1.00 0.00 C ATOM 1013 CG1 VAL A 66 5.665 1.002 -9.331 1.00 0.00 C ATOM 1014 CG2 VAL A 66 4.624 -1.052 -10.359 1.00 0.00 C ATOM 0 H VAL A 66 2.497 0.129 -11.540 1.00 0.00 H new ATOM 0 HA VAL A 66 3.002 0.365 -8.788 1.00 0.00 H new ATOM 0 HB VAL A 66 4.684 0.898 -11.224 1.00 0.00 H new ATOM 0 HG11 VAL A 66 6.630 0.676 -9.719 1.00 0.00 H new ATOM 0 HG12 VAL A 66 5.630 2.091 -9.312 1.00 0.00 H new ATOM 0 HG13 VAL A 66 5.532 0.617 -8.320 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.610 -1.337 -10.727 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.455 -1.508 -9.384 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.862 -1.397 -11.058 1.00 0.00 H new ATOM 1024 N LEU A 67 2.496 2.698 -8.251 1.00 0.00 N ATOM 1025 CA LEU A 67 2.359 4.077 -7.813 1.00 0.00 C ATOM 1026 C LEU A 67 3.688 4.556 -7.226 1.00 0.00 C ATOM 1027 O LEU A 67 4.293 5.497 -7.737 1.00 0.00 O ATOM 1028 CB LEU A 67 1.176 4.218 -6.852 1.00 0.00 C ATOM 1029 CG LEU A 67 0.636 5.636 -6.658 1.00 0.00 C ATOM 1030 CD1 LEU A 67 -0.106 6.116 -7.907 1.00 0.00 C ATOM 1031 CD2 LEU A 67 -0.237 5.724 -5.404 1.00 0.00 C ATOM 0 H LEU A 67 2.090 2.007 -7.620 1.00 0.00 H new ATOM 0 HA LEU A 67 2.132 4.725 -8.660 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.363 3.587 -7.212 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.475 3.828 -5.879 1.00 0.00 H new ATOM 0 HG LEU A 67 1.483 6.306 -6.509 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.480 7.127 -7.742 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.575 6.115 -8.758 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.943 5.449 -8.112 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.608 6.743 -5.290 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.080 5.039 -5.499 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.354 5.453 -4.529 1.00 0.00 H new ATOM 1043 N LEU A 68 4.104 3.886 -6.161 1.00 0.00 N ATOM 1044 CA LEU A 68 5.350 4.232 -5.499 1.00 0.00 C ATOM 1045 C LEU A 68 6.384 3.135 -5.763 1.00 0.00 C ATOM 1046 O LEU A 68 6.221 2.002 -5.313 1.00 0.00 O ATOM 1047 CB LEU A 68 5.110 4.505 -4.013 1.00 0.00 C ATOM 1048 CG LEU A 68 5.404 5.929 -3.537 1.00 0.00 C ATOM 1049 CD1 LEU A 68 5.019 6.106 -2.067 1.00 0.00 C ATOM 1050 CD2 LEU A 68 6.865 6.303 -3.795 1.00 0.00 C ATOM 0 H LEU A 68 3.600 3.105 -5.740 1.00 0.00 H new ATOM 0 HA LEU A 68 5.754 5.158 -5.908 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.069 4.274 -3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 68 5.724 3.815 -3.433 1.00 0.00 H new ATOM 0 HG LEU A 68 4.788 6.617 -4.117 1.00 0.00 H new ATOM 0 HD11 LEU A 68 5.238 7.127 -1.754 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.954 5.909 -1.944 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.590 5.408 -1.455 1.00 0.00 H new ATOM 0 HD21 LEU A 68 7.047 7.320 -3.447 1.00 0.00 H new ATOM 0 HD22 LEU A 68 7.517 5.614 -3.258 1.00 0.00 H new ATOM 0 HD23 LEU A 68 7.073 6.242 -4.863 1.00 0.00 H new ATOM 1062 N ALA A 69 7.424 3.511 -6.492 1.00 0.00 N ATOM 1063 CA ALA A 69 8.485 2.573 -6.822 1.00 0.00 C ATOM 1064 C ALA A 69 9.552 2.611 -5.727 1.00 0.00 C ATOM 1065 O ALA A 69 10.048 1.569 -5.302 1.00 0.00 O ATOM 1066 CB ALA A 69 9.053 2.910 -8.202 1.00 0.00 C ATOM 0 H ALA A 69 7.555 4.452 -6.864 1.00 0.00 H new ATOM 0 HA ALA A 69 8.097 1.555 -6.869 1.00 0.00 H new ATOM 0 HB1 ALA A 69 9.848 2.207 -8.450 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.262 2.840 -8.948 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.454 3.923 -8.193 1.00 0.00 H new ATOM 1072 N SER A 70 9.874 3.824 -5.301 1.00 0.00 N ATOM 1073 CA SER A 70 10.874 4.012 -4.264 1.00 0.00 C ATOM 1074 C SER A 70 10.192 4.317 -2.929 1.00 0.00 C ATOM 1075 O SER A 70 9.742 5.439 -2.700 1.00 0.00 O ATOM 1076 CB SER A 70 11.846 5.135 -4.632 1.00 0.00 C ATOM 1077 OG SER A 70 12.253 5.884 -3.491 1.00 0.00 O ATOM 0 H SER A 70 9.460 4.686 -5.655 1.00 0.00 H new ATOM 0 HA SER A 70 11.447 3.089 -4.170 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.724 4.710 -5.118 1.00 0.00 H new ATOM 0 HB3 SER A 70 11.373 5.802 -5.353 1.00 0.00 H new ATOM 0 HG SER A 70 12.874 6.590 -3.768 1.00 0.00 H new ATOM 1083 N VAL A 71 10.137 3.299 -2.082 1.00 0.00 N ATOM 1084 CA VAL A 71 9.517 3.445 -0.776 1.00 0.00 C ATOM 1085 C VAL A 71 10.530 3.071 0.309 1.00 0.00 C ATOM 1086 O VAL A 71 11.433 2.271 0.070 1.00 0.00 O ATOM 1087 CB VAL A 71 8.235 2.613 -0.710 1.00 0.00 C ATOM 1088 CG1 VAL A 71 7.786 2.413 0.739 1.00 0.00 C ATOM 1089 CG2 VAL A 71 7.123 3.251 -1.545 1.00 0.00 C ATOM 0 H VAL A 71 10.512 2.370 -2.275 1.00 0.00 H new ATOM 0 HA VAL A 71 9.225 4.481 -0.605 1.00 0.00 H new ATOM 0 HB VAL A 71 8.450 1.632 -1.133 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.873 1.818 0.758 1.00 0.00 H new ATOM 0 HG12 VAL A 71 8.568 1.895 1.294 1.00 0.00 H new ATOM 0 HG13 VAL A 71 7.597 3.383 1.199 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.223 2.639 -1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 71 6.911 4.250 -1.165 1.00 0.00 H new ATOM 0 HG23 VAL A 71 7.442 3.318 -2.585 1.00 0.00 H new ATOM 1099 N ASP A 72 10.344 3.668 1.477 1.00 0.00 N ATOM 1100 CA ASP A 72 11.230 3.407 2.599 1.00 0.00 C ATOM 1101 C ASP A 72 11.013 1.976 3.094 1.00 0.00 C ATOM 1102 O ASP A 72 9.875 1.537 3.252 1.00 0.00 O ATOM 1103 CB ASP A 72 10.941 4.359 3.762 1.00 0.00 C ATOM 1104 CG ASP A 72 12.041 5.381 4.050 1.00 0.00 C ATOM 1105 OD1 ASP A 72 13.114 4.944 4.520 1.00 0.00 O ATOM 1106 OD2 ASP A 72 11.786 6.578 3.794 1.00 0.00 O ATOM 0 H ASP A 72 9.594 4.331 1.671 1.00 0.00 H new ATOM 0 HA ASP A 72 12.255 3.553 2.259 1.00 0.00 H new ATOM 0 HB2 ASP A 72 10.015 4.894 3.552 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.771 3.768 4.662 1.00 0.00 H new ATOM 1111 N PRO A 73 12.151 1.270 3.329 1.00 0.00 N ATOM 1112 CA PRO A 73 12.095 -0.103 3.803 1.00 0.00 C ATOM 1113 C PRO A 73 11.714 -0.157 5.283 1.00 0.00 C ATOM 1114 O PRO A 73 11.178 -1.159 5.754 1.00 0.00 O ATOM 1115 CB PRO A 73 13.477 -0.671 3.525 1.00 0.00 C ATOM 1116 CG PRO A 73 14.391 0.529 3.336 1.00 0.00 C ATOM 1117 CD PRO A 73 13.515 1.758 3.152 1.00 0.00 C ATOM 0 HA PRO A 73 11.328 -0.691 3.299 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.817 -1.294 4.352 1.00 0.00 H new ATOM 0 HB3 PRO A 73 13.469 -1.300 2.635 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.044 0.651 4.200 1.00 0.00 H new ATOM 0 HG3 PRO A 73 15.035 0.386 2.468 1.00 0.00 H new ATOM 0 HD2 PRO A 73 13.757 2.530 3.882 1.00 0.00 H new ATOM 0 HD3 PRO A 73 13.653 2.199 2.165 1.00 0.00 H new ATOM 1125 N LYS A 74 12.004 0.934 5.977 1.00 0.00 N ATOM 1126 CA LYS A 74 11.698 1.023 7.395 1.00 0.00 C ATOM 1127 C LYS A 74 10.302 1.622 7.574 1.00 0.00 C ATOM 1128 O LYS A 74 9.967 2.114 8.650 1.00 0.00 O ATOM 1129 CB LYS A 74 12.796 1.792 8.132 1.00 0.00 C ATOM 1130 CG LYS A 74 14.008 0.896 8.400 1.00 0.00 C ATOM 1131 CD LYS A 74 13.601 -0.359 9.175 1.00 0.00 C ATOM 1132 CE LYS A 74 13.467 -1.562 8.240 1.00 0.00 C ATOM 1133 NZ LYS A 74 14.682 -2.406 8.303 1.00 0.00 N ATOM 0 H LYS A 74 12.448 1.764 5.584 1.00 0.00 H new ATOM 0 HA LYS A 74 11.679 0.030 7.844 1.00 0.00 H new ATOM 0 HB2 LYS A 74 13.101 2.655 7.540 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.406 2.175 9.075 1.00 0.00 H new ATOM 0 HG2 LYS A 74 14.470 0.610 7.455 1.00 0.00 H new ATOM 0 HG3 LYS A 74 14.757 1.450 8.966 1.00 0.00 H new ATOM 0 HD2 LYS A 74 14.344 -0.573 9.944 1.00 0.00 H new ATOM 0 HD3 LYS A 74 12.654 -0.184 9.686 1.00 0.00 H new ATOM 0 HE2 LYS A 74 12.593 -2.151 8.519 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.308 -1.219 7.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.574 -3.218 7.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.509 -1.845 8.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.817 -2.748 9.276 1.00 0.00 H new ATOM 1147 N ALA A 75 9.524 1.561 6.503 1.00 0.00 N ATOM 1148 CA ALA A 75 8.172 2.091 6.528 1.00 0.00 C ATOM 1149 C ALA A 75 7.176 0.945 6.341 1.00 0.00 C ATOM 1150 O ALA A 75 7.384 0.067 5.504 1.00 0.00 O ATOM 1151 CB ALA A 75 8.027 3.171 5.454 1.00 0.00 C ATOM 0 H ALA A 75 9.805 1.152 5.612 1.00 0.00 H new ATOM 0 HA ALA A 75 7.960 2.558 7.490 1.00 0.00 H new ATOM 0 HB1 ALA A 75 7.012 3.569 5.473 1.00 0.00 H new ATOM 0 HB2 ALA A 75 8.736 3.976 5.649 1.00 0.00 H new ATOM 0 HB3 ALA A 75 8.229 2.739 4.474 1.00 0.00 H new ATOM 1157 N THR A 76 6.115 0.990 7.133 1.00 0.00 N ATOM 1158 CA THR A 76 5.086 -0.034 7.065 1.00 0.00 C ATOM 1159 C THR A 76 3.740 0.588 6.689 1.00 0.00 C ATOM 1160 O THR A 76 2.737 -0.116 6.577 1.00 0.00 O ATOM 1161 CB THR A 76 5.062 -0.770 8.406 1.00 0.00 C ATOM 1162 OG1 THR A 76 5.305 0.253 9.368 1.00 0.00 O ATOM 1163 CG2 THR A 76 6.246 -1.725 8.571 1.00 0.00 C ATOM 0 H THR A 76 5.945 1.720 7.825 1.00 0.00 H new ATOM 0 HA THR A 76 5.303 -0.762 6.283 1.00 0.00 H new ATOM 0 HB THR A 76 4.130 -1.328 8.497 1.00 0.00 H new ATOM 0 HG1 THR A 76 5.305 -0.137 10.267 1.00 0.00 H new ATOM 0 HG21 THR A 76 6.181 -2.221 9.539 1.00 0.00 H new ATOM 0 HG22 THR A 76 6.224 -2.472 7.778 1.00 0.00 H new ATOM 0 HG23 THR A 76 7.178 -1.162 8.514 1.00 0.00 H new ATOM 1171 N SER A 77 3.760 1.899 6.503 1.00 0.00 N ATOM 1172 CA SER A 77 2.554 2.623 6.142 1.00 0.00 C ATOM 1173 C SER A 77 2.888 3.729 5.139 1.00 0.00 C ATOM 1174 O SER A 77 3.994 4.266 5.147 1.00 0.00 O ATOM 1175 CB SER A 77 1.876 3.216 7.379 1.00 0.00 C ATOM 1176 OG SER A 77 2.807 3.873 8.235 1.00 0.00 O ATOM 0 H SER A 77 4.594 2.479 6.596 1.00 0.00 H new ATOM 0 HA SER A 77 1.859 1.921 5.681 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.108 3.924 7.067 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.373 2.423 7.932 1.00 0.00 H new ATOM 0 HG SER A 77 2.335 4.239 9.012 1.00 0.00 H new ATOM 1182 N VAL A 78 1.910 4.037 4.299 1.00 0.00 N ATOM 1183 CA VAL A 78 2.087 5.069 3.291 1.00 0.00 C ATOM 1184 C VAL A 78 0.747 5.763 3.039 1.00 0.00 C ATOM 1185 O VAL A 78 -0.311 5.186 3.283 1.00 0.00 O ATOM 1186 CB VAL A 78 2.695 4.465 2.024 1.00 0.00 C ATOM 1187 CG1 VAL A 78 1.669 3.612 1.276 1.00 0.00 C ATOM 1188 CG2 VAL A 78 3.267 5.556 1.117 1.00 0.00 C ATOM 0 H VAL A 78 0.993 3.590 4.296 1.00 0.00 H new ATOM 0 HA VAL A 78 2.787 5.828 3.640 1.00 0.00 H new ATOM 0 HB VAL A 78 3.516 3.814 2.324 1.00 0.00 H new ATOM 0 HG11 VAL A 78 2.127 3.195 0.379 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.330 2.801 1.921 1.00 0.00 H new ATOM 0 HG13 VAL A 78 0.818 4.231 0.994 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.693 5.100 0.223 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.472 6.244 0.829 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.044 6.103 1.651 1.00 0.00 H new ATOM 1198 N THR A 79 0.836 6.993 2.553 1.00 0.00 N ATOM 1199 CA THR A 79 -0.356 7.772 2.265 1.00 0.00 C ATOM 1200 C THR A 79 -0.483 8.016 0.760 1.00 0.00 C ATOM 1201 O THR A 79 0.482 8.411 0.108 1.00 0.00 O ATOM 1202 CB THR A 79 -0.288 9.061 3.086 1.00 0.00 C ATOM 1203 OG1 THR A 79 -0.084 8.611 4.422 1.00 0.00 O ATOM 1204 CG2 THR A 79 -1.632 9.792 3.140 1.00 0.00 C ATOM 0 H THR A 79 1.715 7.469 2.352 1.00 0.00 H new ATOM 0 HA THR A 79 -1.259 7.234 2.552 1.00 0.00 H new ATOM 0 HB THR A 79 0.468 9.722 2.662 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.026 9.384 5.022 1.00 0.00 H new ATOM 0 HG21 THR A 79 -1.529 10.700 3.735 1.00 0.00 H new ATOM 0 HG22 THR A 79 -1.945 10.054 2.129 1.00 0.00 H new ATOM 0 HG23 THR A 79 -2.381 9.144 3.595 1.00 0.00 H new ATOM 1212 N VAL A 80 -1.682 7.770 0.252 1.00 0.00 N ATOM 1213 CA VAL A 80 -1.947 7.958 -1.165 1.00 0.00 C ATOM 1214 C VAL A 80 -2.869 9.165 -1.351 1.00 0.00 C ATOM 1215 O VAL A 80 -4.080 9.060 -1.164 1.00 0.00 O ATOM 1216 CB VAL A 80 -2.518 6.671 -1.765 1.00 0.00 C ATOM 1217 CG1 VAL A 80 -2.757 6.827 -3.268 1.00 0.00 C ATOM 1218 CG2 VAL A 80 -1.605 5.479 -1.476 1.00 0.00 C ATOM 0 H VAL A 80 -2.480 7.442 0.796 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.023 8.169 -1.702 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.480 6.478 -1.291 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.163 5.899 -3.670 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.465 7.638 -3.442 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.814 7.056 -3.765 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.034 4.578 -1.913 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.622 5.660 -1.910 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.507 5.348 -0.398 1.00 0.00 H new ATOM 1228 N LYS A 81 -2.259 10.283 -1.716 1.00 0.00 N ATOM 1229 CA LYS A 81 -3.010 11.509 -1.929 1.00 0.00 C ATOM 1230 C LYS A 81 -3.115 11.783 -3.431 1.00 0.00 C ATOM 1231 O LYS A 81 -2.173 11.526 -4.179 1.00 0.00 O ATOM 1232 CB LYS A 81 -2.391 12.661 -1.135 1.00 0.00 C ATOM 1233 CG LYS A 81 -2.035 12.219 0.285 1.00 0.00 C ATOM 1234 CD LYS A 81 -1.156 13.261 0.980 1.00 0.00 C ATOM 1235 CE LYS A 81 -0.022 12.590 1.758 1.00 0.00 C ATOM 1236 NZ LYS A 81 1.077 12.206 0.845 1.00 0.00 N ATOM 0 H LYS A 81 -1.254 10.366 -1.870 1.00 0.00 H new ATOM 0 HA LYS A 81 -4.027 11.403 -1.552 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -1.496 13.018 -1.644 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -3.090 13.497 -1.095 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -2.947 12.065 0.861 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -1.514 11.262 0.252 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.740 13.943 0.239 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -1.763 13.860 1.659 1.00 0.00 H new ATOM 0 HE2 LYS A 81 0.354 13.269 2.523 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -0.400 11.707 2.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 1.838 11.752 1.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 0.718 11.541 0.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 1.448 13.055 0.372 1.00 0.00 H new ATOM 1250 N GLY A 82 -4.268 12.302 -3.826 1.00 0.00 N ATOM 1251 CA GLY A 82 -4.507 12.614 -5.225 1.00 0.00 C ATOM 1252 C GLY A 82 -5.655 11.771 -5.786 1.00 0.00 C ATOM 1253 O GLY A 82 -6.111 12.003 -6.905 1.00 0.00 O ATOM 0 H GLY A 82 -5.047 12.514 -3.202 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.743 13.673 -5.330 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.601 12.431 -5.802 1.00 0.00 H new ATOM 1257 N LEU A 83 -6.090 10.812 -4.982 1.00 0.00 N ATOM 1258 CA LEU A 83 -7.176 9.934 -5.384 1.00 0.00 C ATOM 1259 C LEU A 83 -8.380 10.779 -5.806 1.00 0.00 C ATOM 1260 O LEU A 83 -8.493 11.941 -5.419 1.00 0.00 O ATOM 1261 CB LEU A 83 -7.490 8.928 -4.275 1.00 0.00 C ATOM 1262 CG LEU A 83 -7.031 7.490 -4.525 1.00 0.00 C ATOM 1263 CD1 LEU A 83 -5.776 7.459 -5.399 1.00 0.00 C ATOM 1264 CD2 LEU A 83 -6.829 6.742 -3.205 1.00 0.00 C ATOM 0 H LEU A 83 -5.710 10.624 -4.054 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.884 9.339 -6.249 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -7.030 9.280 -3.352 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.568 8.921 -4.112 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.817 6.971 -5.073 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.471 6.425 -5.561 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.989 7.929 -6.359 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.972 8.000 -4.900 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.503 5.722 -3.411 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.072 7.252 -2.610 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.769 6.718 -2.653 1.00 0.00 H new ATOM 1276 N VAL A 84 -9.248 10.163 -6.595 1.00 0.00 N ATOM 1277 CA VAL A 84 -10.438 10.844 -7.074 1.00 0.00 C ATOM 1278 C VAL A 84 -11.640 10.418 -6.228 1.00 0.00 C ATOM 1279 O VAL A 84 -11.741 9.260 -5.827 1.00 0.00 O ATOM 1280 CB VAL A 84 -10.632 10.572 -8.567 1.00 0.00 C ATOM 1281 CG1 VAL A 84 -11.950 11.168 -9.067 1.00 0.00 C ATOM 1282 CG2 VAL A 84 -9.448 11.101 -9.379 1.00 0.00 C ATOM 0 H VAL A 84 -9.150 9.199 -6.914 1.00 0.00 H new ATOM 0 HA VAL A 84 -10.330 11.923 -6.965 1.00 0.00 H new ATOM 0 HB VAL A 84 -10.679 9.492 -8.707 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.063 10.960 -10.131 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -12.781 10.723 -8.520 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -11.946 12.246 -8.906 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -9.611 10.895 -10.437 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -9.356 12.177 -9.229 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -8.533 10.609 -9.050 1.00 0.00 H new ATOM 1292 N PRO A 85 -12.543 11.403 -5.975 1.00 0.00 N ATOM 1293 CA PRO A 85 -13.733 11.141 -5.184 1.00 0.00 C ATOM 1294 C PRO A 85 -14.766 10.353 -5.992 1.00 0.00 C ATOM 1295 O PRO A 85 -14.953 10.605 -7.181 1.00 0.00 O ATOM 1296 CB PRO A 85 -14.232 12.513 -4.759 1.00 0.00 C ATOM 1297 CG PRO A 85 -13.578 13.506 -5.706 1.00 0.00 C ATOM 1298 CD PRO A 85 -12.455 12.786 -6.434 1.00 0.00 C ATOM 0 HA PRO A 85 -13.531 10.518 -4.313 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -15.319 12.570 -4.822 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -13.962 12.724 -3.724 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.308 13.892 -6.417 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -13.188 14.361 -5.153 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -12.577 12.853 -7.515 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -11.485 13.222 -6.195 1.00 0.00 H new ATOM 1306 N ALA A 86 -15.410 9.415 -5.313 1.00 0.00 N ATOM 1307 CA ALA A 86 -16.420 8.589 -5.953 1.00 0.00 C ATOM 1308 C ALA A 86 -15.739 7.608 -6.909 1.00 0.00 C ATOM 1309 O ALA A 86 -16.176 7.440 -8.047 1.00 0.00 O ATOM 1310 CB ALA A 86 -17.438 9.483 -6.663 1.00 0.00 C ATOM 0 H ALA A 86 -15.252 9.209 -4.327 1.00 0.00 H new ATOM 0 HA ALA A 86 -16.963 8.004 -5.211 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -18.195 8.863 -7.143 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -17.915 10.140 -5.936 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -16.931 10.084 -7.417 1.00 0.00 H new ATOM 1316 N ARG A 87 -14.679 6.986 -6.413 1.00 0.00 N ATOM 1317 CA ARG A 87 -13.933 6.026 -7.209 1.00 0.00 C ATOM 1318 C ARG A 87 -13.281 4.979 -6.304 1.00 0.00 C ATOM 1319 O ARG A 87 -12.889 5.283 -5.179 1.00 0.00 O ATOM 1320 CB ARG A 87 -12.850 6.721 -8.037 1.00 0.00 C ATOM 1321 CG ARG A 87 -13.454 7.407 -9.264 1.00 0.00 C ATOM 1322 CD ARG A 87 -12.462 7.418 -10.429 1.00 0.00 C ATOM 1323 NE ARG A 87 -13.039 8.152 -11.578 1.00 0.00 N ATOM 1324 CZ ARG A 87 -12.613 8.023 -12.842 1.00 0.00 C ATOM 1325 NH1 ARG A 87 -11.604 7.188 -13.127 1.00 0.00 N ATOM 1326 NH2 ARG A 87 -13.196 8.729 -13.820 1.00 0.00 N ATOM 0 H ARG A 87 -14.319 7.128 -5.469 1.00 0.00 H new ATOM 0 HA ARG A 87 -14.635 5.539 -7.886 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -12.333 7.458 -7.422 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -12.105 5.991 -8.354 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -14.366 6.889 -9.563 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -13.736 8.429 -9.012 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -11.529 7.888 -10.118 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -12.222 6.396 -10.723 1.00 0.00 H new ATOM 0 HE ARG A 87 -13.809 8.796 -11.396 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -11.161 6.651 -12.382 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -11.280 7.090 -14.089 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -13.964 9.364 -13.602 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -12.872 8.631 -14.782 1.00 0.00 H new ATOM 1340 N SER A 88 -13.185 3.767 -6.830 1.00 0.00 N ATOM 1341 CA SER A 88 -12.586 2.673 -6.084 1.00 0.00 C ATOM 1342 C SER A 88 -11.080 2.622 -6.348 1.00 0.00 C ATOM 1343 O SER A 88 -10.629 2.929 -7.450 1.00 0.00 O ATOM 1344 CB SER A 88 -13.235 1.336 -6.451 1.00 0.00 C ATOM 1345 OG SER A 88 -14.607 1.286 -6.067 1.00 0.00 O ATOM 0 H SER A 88 -13.512 3.518 -7.764 1.00 0.00 H new ATOM 0 HA SER A 88 -12.756 2.850 -5.022 1.00 0.00 H new ATOM 0 HB2 SER A 88 -13.153 1.176 -7.526 1.00 0.00 H new ATOM 0 HB3 SER A 88 -12.693 0.524 -5.966 1.00 0.00 H new ATOM 0 HG SER A 88 -14.986 0.418 -6.320 1.00 0.00 H new ATOM 1351 N TYR A 89 -10.344 2.231 -5.318 1.00 0.00 N ATOM 1352 CA TYR A 89 -8.898 2.136 -5.424 1.00 0.00 C ATOM 1353 C TYR A 89 -8.363 0.966 -4.595 1.00 0.00 C ATOM 1354 O TYR A 89 -8.908 0.649 -3.539 1.00 0.00 O ATOM 1355 CB TYR A 89 -8.346 3.444 -4.854 1.00 0.00 C ATOM 1356 CG TYR A 89 -8.555 4.656 -5.763 1.00 0.00 C ATOM 1357 CD1 TYR A 89 -7.660 4.919 -6.780 1.00 0.00 C ATOM 1358 CD2 TYR A 89 -9.640 5.487 -5.567 1.00 0.00 C ATOM 1359 CE1 TYR A 89 -7.857 6.061 -7.636 1.00 0.00 C ATOM 1360 CE2 TYR A 89 -9.837 6.628 -6.423 1.00 0.00 C ATOM 1361 CZ TYR A 89 -8.935 6.859 -7.415 1.00 0.00 C ATOM 1362 OH TYR A 89 -9.122 7.936 -8.224 1.00 0.00 O ATOM 0 H TYR A 89 -10.722 1.976 -4.406 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.599 1.972 -6.459 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -8.821 3.638 -3.892 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.279 3.324 -4.665 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -6.812 4.269 -6.934 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -10.341 5.281 -4.772 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -7.164 6.278 -8.435 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -10.682 7.286 -6.281 1.00 0.00 H new ATOM 0 HH TYR A 89 -9.655 7.672 -9.003 1.00 0.00 H new ATOM 1372 N GLN A 90 -7.304 0.356 -5.106 1.00 0.00 N ATOM 1373 CA GLN A 90 -6.689 -0.771 -4.426 1.00 0.00 C ATOM 1374 C GLN A 90 -5.211 -0.485 -4.153 1.00 0.00 C ATOM 1375 O GLN A 90 -4.645 0.456 -4.707 1.00 0.00 O ATOM 1376 CB GLN A 90 -6.858 -2.058 -5.237 1.00 0.00 C ATOM 1377 CG GLN A 90 -8.093 -2.837 -4.777 1.00 0.00 C ATOM 1378 CD GLN A 90 -8.142 -4.220 -5.430 1.00 0.00 C ATOM 1379 OE1 GLN A 90 -7.363 -4.548 -6.310 1.00 0.00 O ATOM 1380 NE2 GLN A 90 -9.098 -5.010 -4.950 1.00 0.00 N ATOM 0 H GLN A 90 -6.856 0.621 -5.983 1.00 0.00 H new ATOM 0 HA GLN A 90 -7.193 -0.913 -3.470 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -6.950 -1.816 -6.296 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -5.970 -2.680 -5.128 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -8.078 -2.943 -3.692 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -8.995 -2.279 -5.030 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -9.716 -4.672 -4.212 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -9.213 -5.954 -5.319 1.00 0.00 H new ATOM 1389 N PHE A 91 -4.629 -1.315 -3.300 1.00 0.00 N ATOM 1390 CA PHE A 91 -3.228 -1.163 -2.947 1.00 0.00 C ATOM 1391 C PHE A 91 -2.597 -2.515 -2.612 1.00 0.00 C ATOM 1392 O PHE A 91 -3.257 -3.392 -2.057 1.00 0.00 O ATOM 1393 CB PHE A 91 -3.173 -0.267 -1.708 1.00 0.00 C ATOM 1394 CG PHE A 91 -3.554 1.190 -1.976 1.00 0.00 C ATOM 1395 CD1 PHE A 91 -3.136 1.804 -3.115 1.00 0.00 C ATOM 1396 CD2 PHE A 91 -4.311 1.872 -1.075 1.00 0.00 C ATOM 1397 CE1 PHE A 91 -3.489 3.157 -3.364 1.00 0.00 C ATOM 1398 CE2 PHE A 91 -4.664 3.225 -1.324 1.00 0.00 C ATOM 1399 CZ PHE A 91 -4.246 3.838 -2.463 1.00 0.00 C ATOM 0 H PHE A 91 -5.102 -2.095 -2.843 1.00 0.00 H new ATOM 0 HA PHE A 91 -2.678 -0.733 -3.784 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.842 -0.673 -0.949 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.165 -0.298 -1.294 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -2.535 1.263 -3.831 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -4.644 1.385 -0.170 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.156 3.645 -4.268 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -5.265 3.767 -0.608 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.515 4.867 -2.652 1.00 0.00 H new ATOM 1409 N ARG A 92 -1.326 -2.643 -2.963 1.00 0.00 N ATOM 1410 CA ARG A 92 -0.598 -3.874 -2.707 1.00 0.00 C ATOM 1411 C ARG A 92 0.892 -3.680 -2.993 1.00 0.00 C ATOM 1412 O ARG A 92 1.306 -3.646 -4.151 1.00 0.00 O ATOM 1413 CB ARG A 92 -1.131 -5.019 -3.570 1.00 0.00 C ATOM 1414 CG ARG A 92 -1.251 -4.591 -5.034 1.00 0.00 C ATOM 1415 CD ARG A 92 -1.033 -5.780 -5.973 1.00 0.00 C ATOM 1416 NE ARG A 92 -0.243 -5.356 -7.151 1.00 0.00 N ATOM 1417 CZ ARG A 92 0.554 -6.172 -7.853 1.00 0.00 C ATOM 1418 NH1 ARG A 92 0.672 -7.460 -7.501 1.00 0.00 N ATOM 1419 NH2 ARG A 92 1.233 -5.701 -8.908 1.00 0.00 N ATOM 0 H ARG A 92 -0.781 -1.914 -3.423 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.739 -4.129 -1.657 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -0.465 -5.879 -3.492 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.106 -5.336 -3.199 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.236 -4.159 -5.211 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -0.519 -3.813 -5.250 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -0.514 -6.580 -5.445 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -1.994 -6.181 -6.295 1.00 0.00 H new ATOM 0 HE ARG A 92 -0.310 -4.382 -7.446 1.00 0.00 H new ATOM 0 HH11 ARG A 92 0.155 -7.819 -6.698 1.00 0.00 H new ATOM 0 HH12 ARG A 92 1.279 -8.081 -8.036 1.00 0.00 H new ATOM 0 HH21 ARG A 92 1.143 -4.721 -9.176 1.00 0.00 H new ATOM 0 HH22 ARG A 92 1.840 -6.322 -9.443 1.00 0.00 H new ATOM 1433 N LEU A 93 1.658 -3.557 -1.918 1.00 0.00 N ATOM 1434 CA LEU A 93 3.093 -3.366 -2.039 1.00 0.00 C ATOM 1435 C LEU A 93 3.803 -4.699 -1.791 1.00 0.00 C ATOM 1436 O LEU A 93 3.188 -5.656 -1.323 1.00 0.00 O ATOM 1437 CB LEU A 93 3.563 -2.238 -1.119 1.00 0.00 C ATOM 1438 CG LEU A 93 3.133 -2.343 0.345 1.00 0.00 C ATOM 1439 CD1 LEU A 93 4.136 -1.642 1.263 1.00 0.00 C ATOM 1440 CD2 LEU A 93 1.711 -1.812 0.538 1.00 0.00 C ATOM 0 H LEU A 93 1.311 -3.586 -0.959 1.00 0.00 H new ATOM 0 HA LEU A 93 3.352 -3.050 -3.050 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.652 -2.196 -1.155 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.195 -1.293 -1.518 1.00 0.00 H new ATOM 0 HG LEU A 93 3.124 -3.397 0.624 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.806 -1.732 2.298 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.116 -2.106 1.153 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.201 -0.588 0.993 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.430 -1.898 1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.669 -0.766 0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.020 -2.394 -0.072 1.00 0.00 H new ATOM 1452 N CYS A 94 5.087 -4.718 -2.114 1.00 0.00 N ATOM 1453 CA CYS A 94 5.887 -5.918 -1.932 1.00 0.00 C ATOM 1454 C CYS A 94 7.208 -5.518 -1.272 1.00 0.00 C ATOM 1455 O CYS A 94 7.482 -4.333 -1.090 1.00 0.00 O ATOM 1456 CB CYS A 94 6.109 -6.656 -3.254 1.00 0.00 C ATOM 1457 SG CYS A 94 7.313 -5.742 -4.286 1.00 0.00 S ATOM 0 H CYS A 94 5.594 -3.922 -2.501 1.00 0.00 H new ATOM 0 HA CYS A 94 5.357 -6.618 -1.286 1.00 0.00 H new ATOM 0 HB2 CYS A 94 6.475 -7.664 -3.060 1.00 0.00 H new ATOM 0 HB3 CYS A 94 5.164 -6.757 -3.787 1.00 0.00 H new ATOM 0 HG CYS A 94 6.829 -5.587 -5.483 1.00 0.00 H new ATOM 1463 N ALA A 95 7.993 -6.530 -0.932 1.00 0.00 N ATOM 1464 CA ALA A 95 9.279 -6.299 -0.297 1.00 0.00 C ATOM 1465 C ALA A 95 10.393 -6.471 -1.332 1.00 0.00 C ATOM 1466 O ALA A 95 10.382 -7.425 -2.108 1.00 0.00 O ATOM 1467 CB ALA A 95 9.438 -7.248 0.894 1.00 0.00 C ATOM 0 H ALA A 95 7.763 -7.512 -1.084 1.00 0.00 H new ATOM 0 HA ALA A 95 9.340 -5.281 0.087 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.403 -7.075 1.371 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.640 -7.066 1.614 1.00 0.00 H new ATOM 0 HB3 ALA A 95 9.385 -8.280 0.547 1.00 0.00 H new ATOM 1473 N VAL A 96 11.327 -5.532 -1.309 1.00 0.00 N ATOM 1474 CA VAL A 96 12.446 -5.567 -2.236 1.00 0.00 C ATOM 1475 C VAL A 96 13.741 -5.275 -1.476 1.00 0.00 C ATOM 1476 O VAL A 96 13.815 -4.312 -0.714 1.00 0.00 O ATOM 1477 CB VAL A 96 12.198 -4.595 -3.392 1.00 0.00 C ATOM 1478 CG1 VAL A 96 13.461 -4.416 -4.237 1.00 0.00 C ATOM 1479 CG2 VAL A 96 11.022 -5.057 -4.254 1.00 0.00 C ATOM 0 H VAL A 96 11.332 -4.742 -0.663 1.00 0.00 H new ATOM 0 HA VAL A 96 12.545 -6.558 -2.678 1.00 0.00 H new ATOM 0 HB VAL A 96 11.940 -3.626 -2.966 1.00 0.00 H new ATOM 0 HG11 VAL A 96 13.258 -3.721 -5.052 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.263 -4.021 -3.614 1.00 0.00 H new ATOM 0 HG13 VAL A 96 13.763 -5.379 -4.649 1.00 0.00 H new ATOM 0 HG21 VAL A 96 10.867 -4.349 -5.068 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.238 -6.042 -4.667 1.00 0.00 H new ATOM 0 HG23 VAL A 96 10.121 -5.109 -3.643 1.00 0.00 H new ATOM 1489 N ASN A 97 14.731 -6.124 -1.710 1.00 0.00 N ATOM 1490 CA ASN A 97 16.020 -5.969 -1.058 1.00 0.00 C ATOM 1491 C ASN A 97 17.135 -6.256 -2.066 1.00 0.00 C ATOM 1492 O ASN A 97 16.869 -6.459 -3.249 1.00 0.00 O ATOM 1493 CB ASN A 97 16.170 -6.951 0.106 1.00 0.00 C ATOM 1494 CG ASN A 97 15.394 -8.242 -0.163 1.00 0.00 C ATOM 1495 OD1 ASN A 97 14.804 -8.435 -1.214 1.00 0.00 O ATOM 1496 ND2 ASN A 97 15.427 -9.112 0.842 1.00 0.00 N ATOM 0 H ASN A 97 14.666 -6.922 -2.342 1.00 0.00 H new ATOM 0 HA ASN A 97 16.086 -4.949 -0.680 1.00 0.00 H new ATOM 0 HB2 ASN A 97 17.224 -7.181 0.259 1.00 0.00 H new ATOM 0 HB3 ASN A 97 15.808 -6.490 1.025 1.00 0.00 H new ATOM 0 HD21 ASN A 97 14.939 -10.004 0.760 1.00 0.00 H new ATOM 0 HD22 ASN A 97 15.940 -8.887 1.694 1.00 0.00 H new ATOM 1503 N ASP A 98 18.359 -6.263 -1.559 1.00 0.00 N ATOM 1504 CA ASP A 98 19.515 -6.522 -2.400 1.00 0.00 C ATOM 1505 C ASP A 98 19.301 -7.829 -3.166 1.00 0.00 C ATOM 1506 O ASP A 98 19.462 -7.872 -4.385 1.00 0.00 O ATOM 1507 CB ASP A 98 20.786 -6.669 -1.560 1.00 0.00 C ATOM 1508 CG ASP A 98 20.828 -7.908 -0.664 1.00 0.00 C ATOM 1509 OD1 ASP A 98 19.750 -8.272 -0.147 1.00 0.00 O ATOM 1510 OD2 ASP A 98 21.938 -8.464 -0.516 1.00 0.00 O ATOM 0 H ASP A 98 18.575 -6.094 -0.577 1.00 0.00 H new ATOM 0 HA ASP A 98 19.630 -5.681 -3.083 1.00 0.00 H new ATOM 0 HB2 ASP A 98 21.645 -6.694 -2.230 1.00 0.00 H new ATOM 0 HB3 ASP A 98 20.895 -5.783 -0.935 1.00 0.00 H new ATOM 1515 N VAL A 99 18.941 -8.863 -2.420 1.00 0.00 N ATOM 1516 CA VAL A 99 18.703 -10.167 -3.014 1.00 0.00 C ATOM 1517 C VAL A 99 17.832 -10.004 -4.261 1.00 0.00 C ATOM 1518 O VAL A 99 18.174 -10.504 -5.332 1.00 0.00 O ATOM 1519 CB VAL A 99 18.091 -11.111 -1.977 1.00 0.00 C ATOM 1520 CG1 VAL A 99 18.823 -11.002 -0.637 1.00 0.00 C ATOM 1521 CG2 VAL A 99 16.594 -10.843 -1.807 1.00 0.00 C ATOM 0 H VAL A 99 18.808 -8.824 -1.409 1.00 0.00 H new ATOM 0 HA VAL A 99 19.643 -10.619 -3.331 1.00 0.00 H new ATOM 0 HB VAL A 99 18.209 -12.131 -2.342 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.368 -11.683 0.082 1.00 0.00 H new ATOM 0 HG12 VAL A 99 19.872 -11.265 -0.773 1.00 0.00 H new ATOM 0 HG13 VAL A 99 18.751 -9.980 -0.265 1.00 0.00 H new ATOM 0 HG21 VAL A 99 16.184 -11.527 -1.064 1.00 0.00 H new ATOM 0 HG22 VAL A 99 16.444 -9.816 -1.476 1.00 0.00 H new ATOM 0 HG23 VAL A 99 16.087 -10.995 -2.760 1.00 0.00 H new ATOM 1531 N GLY A 100 16.722 -9.303 -4.081 1.00 0.00 N ATOM 1532 CA GLY A 100 15.799 -9.068 -5.178 1.00 0.00 C ATOM 1533 C GLY A 100 14.375 -8.855 -4.661 1.00 0.00 C ATOM 1534 O GLY A 100 14.161 -8.726 -3.456 1.00 0.00 O ATOM 0 H GLY A 100 16.441 -8.890 -3.192 1.00 0.00 H new ATOM 0 HA2 GLY A 100 16.118 -8.194 -5.745 1.00 0.00 H new ATOM 0 HA3 GLY A 100 15.818 -9.916 -5.862 1.00 0.00 H new ATOM 1538 N LYS A 101 13.438 -8.826 -5.597 1.00 0.00 N ATOM 1539 CA LYS A 101 12.040 -8.632 -5.251 1.00 0.00 C ATOM 1540 C LYS A 101 11.489 -9.918 -4.632 1.00 0.00 C ATOM 1541 O LYS A 101 11.980 -11.009 -4.917 1.00 0.00 O ATOM 1542 CB LYS A 101 11.249 -8.147 -6.467 1.00 0.00 C ATOM 1543 CG LYS A 101 9.901 -7.558 -6.046 1.00 0.00 C ATOM 1544 CD LYS A 101 9.619 -6.249 -6.786 1.00 0.00 C ATOM 1545 CE LYS A 101 9.673 -6.454 -8.302 1.00 0.00 C ATOM 1546 NZ LYS A 101 8.718 -5.551 -8.981 1.00 0.00 N ATOM 0 H LYS A 101 13.619 -8.934 -6.595 1.00 0.00 H new ATOM 0 HA LYS A 101 11.939 -7.848 -4.501 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.827 -7.395 -7.004 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.088 -8.977 -7.155 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.106 -8.275 -6.253 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.898 -7.380 -4.971 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.637 -5.870 -6.501 1.00 0.00 H new ATOM 0 HD3 LYS A 101 10.349 -5.496 -6.491 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.683 -6.264 -8.665 1.00 0.00 H new ATOM 0 HE3 LYS A 101 9.437 -7.490 -8.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.382 -5.997 -9.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 7.909 -5.367 -8.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 9.191 -4.653 -9.208 1.00 0.00 H new ATOM 1560 N GLY A 102 10.476 -9.747 -3.795 1.00 0.00 N ATOM 1561 CA GLY A 102 9.852 -10.881 -3.133 1.00 0.00 C ATOM 1562 C GLY A 102 8.452 -11.140 -3.692 1.00 0.00 C ATOM 1563 O GLY A 102 8.305 -11.728 -4.762 1.00 0.00 O ATOM 0 H GLY A 102 10.072 -8.841 -3.560 1.00 0.00 H new ATOM 0 HA2 GLY A 102 10.470 -11.769 -3.265 1.00 0.00 H new ATOM 0 HA3 GLY A 102 9.790 -10.692 -2.061 1.00 0.00 H new ATOM 1567 N GLN A 103 7.457 -10.688 -2.942 1.00 0.00 N ATOM 1568 CA GLN A 103 6.074 -10.863 -3.348 1.00 0.00 C ATOM 1569 C GLN A 103 5.211 -9.724 -2.801 1.00 0.00 C ATOM 1570 O GLN A 103 5.534 -9.137 -1.769 1.00 0.00 O ATOM 1571 CB GLN A 103 5.537 -12.222 -2.896 1.00 0.00 C ATOM 1572 CG GLN A 103 5.663 -12.385 -1.380 1.00 0.00 C ATOM 1573 CD GLN A 103 4.590 -13.332 -0.840 1.00 0.00 C ATOM 1574 OE1 GLN A 103 3.349 -12.992 -1.176 1.00 0.00 O flip ATOM 1575 NE2 GLN A 103 4.870 -14.307 -0.162 1.00 0.00 N flip ATOM 0 H GLN A 103 7.582 -10.201 -2.055 1.00 0.00 H new ATOM 0 HA GLN A 103 6.030 -10.835 -4.437 1.00 0.00 H new ATOM 0 HB2 GLN A 103 4.492 -12.320 -3.190 1.00 0.00 H new ATOM 0 HB3 GLN A 103 6.086 -13.019 -3.398 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.652 -12.771 -1.133 1.00 0.00 H new ATOM 0 HG3 GLN A 103 5.571 -11.412 -0.897 1.00 0.00 H new ATOM 0 HE21 GLN A 103 5.844 -14.511 0.060 1.00 0.00 H new ATOM 0 HE22 GLN A 103 4.130 -14.918 0.183 1.00 0.00 H new ATOM 1584 N PHE A 104 4.132 -9.445 -3.517 1.00 0.00 N ATOM 1585 CA PHE A 104 3.220 -8.387 -3.116 1.00 0.00 C ATOM 1586 C PHE A 104 2.166 -8.912 -2.139 1.00 0.00 C ATOM 1587 O PHE A 104 2.080 -10.115 -1.901 1.00 0.00 O ATOM 1588 CB PHE A 104 2.522 -7.893 -4.385 1.00 0.00 C ATOM 1589 CG PHE A 104 3.450 -7.170 -5.364 1.00 0.00 C ATOM 1590 CD1 PHE A 104 4.365 -7.876 -6.080 1.00 0.00 C ATOM 1591 CD2 PHE A 104 3.358 -5.822 -5.518 1.00 0.00 C ATOM 1592 CE1 PHE A 104 5.226 -7.206 -6.989 1.00 0.00 C ATOM 1593 CE2 PHE A 104 4.219 -5.152 -6.427 1.00 0.00 C ATOM 1594 CZ PHE A 104 5.134 -5.858 -7.144 1.00 0.00 C ATOM 0 H PHE A 104 3.869 -9.933 -4.373 1.00 0.00 H new ATOM 0 HA PHE A 104 3.772 -7.589 -2.619 1.00 0.00 H new ATOM 0 HB2 PHE A 104 2.067 -8.744 -4.892 1.00 0.00 H new ATOM 0 HB3 PHE A 104 1.712 -7.220 -4.103 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.437 -8.947 -5.957 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.631 -5.261 -4.949 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.954 -7.767 -7.557 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.147 -4.081 -6.549 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.787 -5.348 -7.836 1.00 0.00 H new ATOM 1604 N SER A 105 1.390 -7.983 -1.601 1.00 0.00 N ATOM 1605 CA SER A 105 0.345 -8.337 -0.655 1.00 0.00 C ATOM 1606 C SER A 105 -1.005 -8.415 -1.372 1.00 0.00 C ATOM 1607 O SER A 105 -1.154 -7.901 -2.480 1.00 0.00 O ATOM 1608 CB SER A 105 0.277 -7.329 0.494 1.00 0.00 C ATOM 1609 OG SER A 105 0.532 -5.998 0.053 1.00 0.00 O ATOM 0 H SER A 105 1.464 -6.986 -1.802 1.00 0.00 H new ATOM 0 HA SER A 105 0.583 -9.313 -0.233 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.708 -7.375 0.958 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.003 -7.603 1.260 1.00 0.00 H new ATOM 0 HG SER A 105 0.176 -5.362 0.709 1.00 0.00 H new ATOM 1615 N LYS A 106 -1.953 -9.061 -0.711 1.00 0.00 N ATOM 1616 CA LYS A 106 -3.285 -9.213 -1.272 1.00 0.00 C ATOM 1617 C LYS A 106 -3.904 -7.831 -1.488 1.00 0.00 C ATOM 1618 O LYS A 106 -3.428 -6.840 -0.934 1.00 0.00 O ATOM 1619 CB LYS A 106 -4.134 -10.136 -0.394 1.00 0.00 C ATOM 1620 CG LYS A 106 -4.150 -11.560 -0.952 1.00 0.00 C ATOM 1621 CD LYS A 106 -2.730 -12.113 -1.087 1.00 0.00 C ATOM 1622 CE LYS A 106 -2.464 -12.601 -2.513 1.00 0.00 C ATOM 1623 NZ LYS A 106 -1.048 -12.382 -2.880 1.00 0.00 N ATOM 0 H LYS A 106 -1.826 -9.485 0.208 1.00 0.00 H new ATOM 0 HA LYS A 106 -3.234 -9.696 -2.248 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.738 -10.144 0.621 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.153 -9.753 -0.336 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -4.734 -12.205 -0.296 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.641 -11.567 -1.925 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.008 -11.340 -0.823 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.588 -12.935 -0.385 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -2.707 -13.661 -2.592 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.113 -12.072 -3.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -0.885 -12.719 -3.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -0.828 -11.367 -2.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -0.434 -12.906 -2.224 1.00 0.00 H new ATOM 1637 N ASP A 107 -4.955 -7.807 -2.294 1.00 0.00 N ATOM 1638 CA ASP A 107 -5.643 -6.562 -2.590 1.00 0.00 C ATOM 1639 C ASP A 107 -6.356 -6.066 -1.330 1.00 0.00 C ATOM 1640 O ASP A 107 -7.299 -6.698 -0.856 1.00 0.00 O ATOM 1641 CB ASP A 107 -6.697 -6.761 -3.681 1.00 0.00 C ATOM 1642 CG ASP A 107 -7.543 -8.029 -3.540 1.00 0.00 C ATOM 1643 OD1 ASP A 107 -6.937 -9.122 -3.574 1.00 0.00 O ATOM 1644 OD2 ASP A 107 -8.775 -7.876 -3.401 1.00 0.00 O ATOM 0 H ASP A 107 -5.347 -8.630 -2.751 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.901 -5.840 -2.932 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.362 -5.897 -3.685 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -6.197 -6.782 -4.649 1.00 0.00 H new ATOM 1649 N THR A 108 -5.878 -4.939 -0.823 1.00 0.00 N ATOM 1650 CA THR A 108 -6.457 -4.351 0.373 1.00 0.00 C ATOM 1651 C THR A 108 -7.965 -4.161 0.196 1.00 0.00 C ATOM 1652 O THR A 108 -8.436 -3.897 -0.909 1.00 0.00 O ATOM 1653 CB THR A 108 -5.710 -3.049 0.669 1.00 0.00 C ATOM 1654 OG1 THR A 108 -5.680 -2.374 -0.586 1.00 0.00 O ATOM 1655 CG2 THR A 108 -4.236 -3.283 1.002 1.00 0.00 C ATOM 0 H THR A 108 -5.096 -4.417 -1.219 1.00 0.00 H new ATOM 0 HA THR A 108 -6.343 -5.010 1.234 1.00 0.00 H new ATOM 0 HB THR A 108 -6.192 -2.534 1.500 1.00 0.00 H new ATOM 0 HG1 THR A 108 -5.837 -1.417 -0.446 1.00 0.00 H new ATOM 0 HG21 THR A 108 -3.752 -2.327 1.204 1.00 0.00 H new ATOM 0 HG22 THR A 108 -4.159 -3.922 1.882 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.745 -3.767 0.158 1.00 0.00 H new ATOM 1663 N GLU A 109 -8.680 -4.302 1.302 1.00 0.00 N ATOM 1664 CA GLU A 109 -10.125 -4.149 1.284 1.00 0.00 C ATOM 1665 C GLU A 109 -10.529 -3.038 0.312 1.00 0.00 C ATOM 1666 O GLU A 109 -10.080 -1.900 0.443 1.00 0.00 O ATOM 1667 CB GLU A 109 -10.665 -3.871 2.688 1.00 0.00 C ATOM 1668 CG GLU A 109 -11.665 -4.947 3.114 1.00 0.00 C ATOM 1669 CD GLU A 109 -12.226 -4.654 4.507 1.00 0.00 C ATOM 1670 OE1 GLU A 109 -13.094 -3.759 4.592 1.00 0.00 O ATOM 1671 OE2 GLU A 109 -11.774 -5.332 5.455 1.00 0.00 O ATOM 0 H GLU A 109 -8.286 -4.521 2.217 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.565 -5.085 0.940 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -9.839 -3.835 3.399 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -11.146 -2.893 2.709 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -12.481 -4.996 2.393 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.178 -5.922 3.112 1.00 0.00 H new ATOM 1678 N ARG A 110 -11.371 -3.408 -0.642 1.00 0.00 N ATOM 1679 CA ARG A 110 -11.839 -2.457 -1.636 1.00 0.00 C ATOM 1680 C ARG A 110 -12.032 -1.078 -1.002 1.00 0.00 C ATOM 1681 O ARG A 110 -13.071 -0.807 -0.401 1.00 0.00 O ATOM 1682 CB ARG A 110 -13.161 -2.915 -2.256 1.00 0.00 C ATOM 1683 CG ARG A 110 -13.248 -2.506 -3.727 1.00 0.00 C ATOM 1684 CD ARG A 110 -14.704 -2.432 -4.191 1.00 0.00 C ATOM 1685 NE ARG A 110 -14.948 -3.433 -5.254 1.00 0.00 N ATOM 1686 CZ ARG A 110 -15.178 -4.733 -5.023 1.00 0.00 C ATOM 1687 NH1 ARG A 110 -15.196 -5.197 -3.766 1.00 0.00 N ATOM 1688 NH2 ARG A 110 -15.389 -5.568 -6.048 1.00 0.00 N ATOM 0 H ARG A 110 -11.741 -4.353 -0.748 1.00 0.00 H new ATOM 0 HA ARG A 110 -11.084 -2.398 -2.420 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -13.251 -3.998 -2.170 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -13.995 -2.481 -1.704 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -12.768 -1.537 -3.868 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -12.703 -3.224 -4.340 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -15.372 -2.613 -3.349 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -14.925 -1.432 -4.564 1.00 0.00 H new ATOM 0 HE ARG A 110 -14.941 -3.113 -6.223 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -15.035 -4.561 -2.985 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -15.371 -6.186 -3.590 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -15.375 -5.215 -7.005 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -15.564 -6.557 -5.872 1.00 0.00 H new ATOM 1702 N VAL A 111 -11.015 -0.243 -1.157 1.00 0.00 N ATOM 1703 CA VAL A 111 -11.060 1.101 -0.607 1.00 0.00 C ATOM 1704 C VAL A 111 -11.671 2.050 -1.640 1.00 0.00 C ATOM 1705 O VAL A 111 -11.110 2.246 -2.717 1.00 0.00 O ATOM 1706 CB VAL A 111 -9.662 1.529 -0.156 1.00 0.00 C ATOM 1707 CG1 VAL A 111 -9.703 2.888 0.544 1.00 0.00 C ATOM 1708 CG2 VAL A 111 -9.027 0.467 0.744 1.00 0.00 C ATOM 0 H VAL A 111 -10.155 -0.471 -1.656 1.00 0.00 H new ATOM 0 HA VAL A 111 -11.696 1.130 0.278 1.00 0.00 H new ATOM 0 HB VAL A 111 -9.040 1.630 -1.045 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -8.696 3.168 0.854 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -10.093 3.639 -0.143 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.349 2.827 1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.034 0.796 1.050 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -9.649 0.319 1.627 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -8.945 -0.472 0.197 1.00 0.00 H new ATOM 1718 N SER A 112 -12.813 2.614 -1.276 1.00 0.00 N ATOM 1719 CA SER A 112 -13.506 3.538 -2.157 1.00 0.00 C ATOM 1720 C SER A 112 -13.242 4.979 -1.717 1.00 0.00 C ATOM 1721 O SER A 112 -13.036 5.243 -0.534 1.00 0.00 O ATOM 1722 CB SER A 112 -15.010 3.256 -2.178 1.00 0.00 C ATOM 1723 OG SER A 112 -15.594 3.566 -3.440 1.00 0.00 O ATOM 0 H SER A 112 -13.276 2.449 -0.382 1.00 0.00 H new ATOM 0 HA SER A 112 -13.123 3.398 -3.168 1.00 0.00 H new ATOM 0 HB2 SER A 112 -15.185 2.205 -1.946 1.00 0.00 H new ATOM 0 HB3 SER A 112 -15.499 3.840 -1.399 1.00 0.00 H new ATOM 0 HG SER A 112 -16.554 3.371 -3.413 1.00 0.00 H new ATOM 1729 N LEU A 113 -13.258 5.875 -2.694 1.00 0.00 N ATOM 1730 CA LEU A 113 -13.023 7.282 -2.422 1.00 0.00 C ATOM 1731 C LEU A 113 -14.337 7.942 -1.999 1.00 0.00 C ATOM 1732 O LEU A 113 -15.413 7.507 -2.406 1.00 0.00 O ATOM 1733 CB LEU A 113 -12.355 7.956 -3.623 1.00 0.00 C ATOM 1734 CG LEU A 113 -10.915 8.428 -3.412 1.00 0.00 C ATOM 1735 CD1 LEU A 113 -10.859 9.945 -3.223 1.00 0.00 C ATOM 1736 CD2 LEU A 113 -10.258 7.681 -2.250 1.00 0.00 C ATOM 0 H LEU A 113 -13.430 5.653 -3.675 1.00 0.00 H new ATOM 0 HA LEU A 113 -12.326 7.398 -1.592 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -12.369 7.258 -4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -12.959 8.815 -3.915 1.00 0.00 H new ATOM 0 HG LEU A 113 -10.343 8.193 -4.310 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -9.825 10.255 -3.075 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -11.262 10.437 -4.108 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -11.450 10.225 -2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -9.235 8.035 -2.121 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -10.823 7.862 -1.335 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -10.247 6.612 -2.464 1.00 0.00 H new ATOM 1748 N PRO A 114 -14.203 9.009 -1.167 1.00 0.00 N ATOM 1749 CA PRO A 114 -15.366 9.733 -0.685 1.00 0.00 C ATOM 1750 C PRO A 114 -15.954 10.621 -1.784 1.00 0.00 C ATOM 1751 O PRO A 114 -15.319 11.580 -2.218 1.00 0.00 O ATOM 1752 CB PRO A 114 -14.869 10.524 0.514 1.00 0.00 C ATOM 1753 CG PRO A 114 -13.355 10.578 0.379 1.00 0.00 C ATOM 1754 CD PRO A 114 -12.944 9.553 -0.665 1.00 0.00 C ATOM 0 HA PRO A 114 -16.183 9.071 -0.398 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -15.296 11.527 0.525 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -15.161 10.043 1.448 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -13.034 11.576 0.081 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -12.878 10.361 1.335 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -12.365 10.013 -1.465 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -12.321 8.772 -0.229 1.00 0.00 H new ATOM 1762 N GLU A 115 -17.161 10.268 -2.202 1.00 0.00 N ATOM 1763 CA GLU A 115 -17.842 11.021 -3.242 1.00 0.00 C ATOM 1764 C GLU A 115 -17.554 12.516 -3.091 1.00 0.00 C ATOM 1765 O GLU A 115 -17.350 13.216 -4.081 1.00 0.00 O ATOM 1766 CB GLU A 115 -19.347 10.747 -3.221 1.00 0.00 C ATOM 1767 CG GLU A 115 -19.846 10.318 -4.602 1.00 0.00 C ATOM 1768 CD GLU A 115 -21.287 9.807 -4.530 1.00 0.00 C ATOM 1769 OE1 GLU A 115 -21.492 8.781 -3.845 1.00 0.00 O ATOM 1770 OE2 GLU A 115 -22.150 10.454 -5.161 1.00 0.00 O ATOM 0 H GLU A 115 -17.685 9.471 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.460 10.694 -4.209 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -19.568 9.967 -2.492 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -19.879 11.643 -2.900 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -19.789 11.161 -5.291 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -19.199 9.537 -5.000 1.00 0.00 H new ATOM 1777 N SER A 116 -17.547 12.961 -1.843 1.00 0.00 N ATOM 1778 CA SER A 116 -17.287 14.360 -1.549 1.00 0.00 C ATOM 1779 C SER A 116 -18.450 15.223 -2.043 1.00 0.00 C ATOM 1780 O SER A 116 -19.186 15.797 -1.242 1.00 0.00 O ATOM 1781 CB SER A 116 -15.975 14.822 -2.185 1.00 0.00 C ATOM 1782 OG SER A 116 -15.502 16.037 -1.611 1.00 0.00 O ATOM 0 H SER A 116 -17.717 12.377 -1.024 1.00 0.00 H new ATOM 0 HA SER A 116 -17.194 14.471 -0.469 1.00 0.00 H new ATOM 0 HB2 SER A 116 -15.220 14.045 -2.063 1.00 0.00 H new ATOM 0 HB3 SER A 116 -16.120 14.960 -3.256 1.00 0.00 H new ATOM 0 HG SER A 116 -14.662 16.297 -2.043 1.00 0.00 H new ATOM 1788 N GLY A 117 -18.580 15.287 -3.360 1.00 0.00 N ATOM 1789 CA GLY A 117 -19.640 16.070 -3.971 1.00 0.00 C ATOM 1790 C GLY A 117 -20.867 15.202 -4.257 1.00 0.00 C ATOM 1791 O GLY A 117 -20.824 13.984 -4.089 1.00 0.00 O ATOM 0 H GLY A 117 -17.968 14.809 -4.021 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -19.917 16.892 -3.310 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -19.280 16.515 -4.899 1.00 0.00 H new ATOM 1795 N PRO A 118 -21.961 15.880 -4.697 1.00 0.00 N ATOM 1796 CA PRO A 118 -23.198 15.184 -5.009 1.00 0.00 C ATOM 1797 C PRO A 118 -23.085 14.435 -6.338 1.00 0.00 C ATOM 1798 O PRO A 118 -23.416 13.253 -6.418 1.00 0.00 O ATOM 1799 CB PRO A 118 -24.265 16.267 -5.026 1.00 0.00 C ATOM 1800 CG PRO A 118 -23.521 17.583 -5.184 1.00 0.00 C ATOM 1801 CD PRO A 118 -22.049 17.322 -4.909 1.00 0.00 C ATOM 0 HA PRO A 118 -23.443 14.413 -4.278 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -24.965 16.113 -5.847 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -24.847 16.256 -4.105 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -23.657 17.980 -6.190 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -23.912 18.328 -4.492 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -21.428 17.638 -5.747 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -21.706 17.873 -4.033 1.00 0.00 H new ATOM 1809 N SER A 119 -22.617 15.153 -7.348 1.00 0.00 N ATOM 1810 CA SER A 119 -22.457 14.571 -8.670 1.00 0.00 C ATOM 1811 C SER A 119 -21.384 15.332 -9.450 1.00 0.00 C ATOM 1812 O SER A 119 -21.675 16.342 -10.089 1.00 0.00 O ATOM 1813 CB SER A 119 -23.779 14.579 -9.439 1.00 0.00 C ATOM 1814 OG SER A 119 -23.645 14.010 -10.739 1.00 0.00 O ATOM 0 H SER A 119 -22.343 16.133 -7.278 1.00 0.00 H new ATOM 0 HA SER A 119 -22.144 13.534 -8.552 1.00 0.00 H new ATOM 0 HB2 SER A 119 -24.529 14.024 -8.876 1.00 0.00 H new ATOM 0 HB3 SER A 119 -24.141 15.603 -9.527 1.00 0.00 H new ATOM 0 HG SER A 119 -24.511 14.033 -11.197 1.00 0.00 H new ATOM 1820 N SER A 120 -20.165 14.818 -9.373 1.00 0.00 N ATOM 1821 CA SER A 120 -19.047 15.436 -10.065 1.00 0.00 C ATOM 1822 C SER A 120 -19.298 15.432 -11.574 1.00 0.00 C ATOM 1823 O SER A 120 -19.919 14.511 -12.101 1.00 0.00 O ATOM 1824 CB SER A 120 -17.735 14.718 -9.743 1.00 0.00 C ATOM 1825 OG SER A 120 -16.608 15.579 -9.880 1.00 0.00 O ATOM 0 H SER A 120 -19.927 13.980 -8.842 1.00 0.00 H new ATOM 0 HA SER A 120 -18.960 16.467 -9.721 1.00 0.00 H new ATOM 0 HB2 SER A 120 -17.774 14.331 -8.725 1.00 0.00 H new ATOM 0 HB3 SER A 120 -17.619 13.860 -10.406 1.00 0.00 H new ATOM 0 HG SER A 120 -15.790 15.084 -9.664 1.00 0.00 H new ATOM 1831 N GLY A 121 -18.802 16.473 -12.227 1.00 0.00 N ATOM 1832 CA GLY A 121 -18.965 16.601 -13.665 1.00 0.00 C ATOM 1833 C GLY A 121 -18.519 15.325 -14.383 1.00 0.00 C ATOM 1834 O GLY A 121 -19.092 14.952 -15.406 1.00 0.00 O ATOM 0 H GLY A 121 -18.287 17.235 -11.787 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -20.009 16.808 -13.899 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -18.383 17.449 -14.027 1.00 0.00 H new TER 1838 GLY A 121