USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 807 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 77 ASN : amide:sc= 0 X(o=-0.19,f=-0.2) USER MOD Set 1.2: A 81 LYS NZ :NH3+ 148:sc= -0.189 (180deg=-1.51!) USER MOD Set 2.1: A 20 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 27 LYS NZ :NH3+ -143:sc= -0.0644 (180deg=-0.429) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 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 GLN : amide:sc= -1.73! K(o=-1.7!,f=-0.71) USER MOD Single : A 11 SER OG : rot 53:sc= 0.626 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.0407 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HD1:sc= -0.562 K(o=-0.56,f=-2.1) USER MOD Single : A 28 ASN : amide:sc= -0.0142 X(o=-0.014,f=-0.014) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.0205 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.654) USER MOD Single : A 37 SER OG : rot 100:sc= 1.21 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 150:sc= -1.48 (180deg=-1.74) USER MOD Single : A 44 LYS NZ :NH3+ 159:sc= -0.0233 (180deg=-0.558) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -2.41! C(o=-2.4!,f=-6.3!) USER MOD Single : A 49 LYS NZ :NH3+ -130:sc= 1.21 (180deg=-0.0496) USER MOD Single : A 50 ASN : amide:sc= -12.4! C(o=-12!,f=-13!) USER MOD Single : A 53 ASN : amide:sc= -2.21 K(o=-2.2,f=-4.4!) USER MOD Single : A 59 LYS NZ :NH3+ -129:sc= 0.731 (180deg=-1.71!) USER MOD Single : A 61 LYS NZ :NH3+ -109:sc= 0.436 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -5.7! C(o=-5.7!,f=-7!) USER MOD Single : A 65 ASN : amide:sc= -0.181 X(o=-0.18,f=0) USER MOD Single : A 67 HIS : no HD1:sc= -3.39! C(o=-3.4!,f=-3.9!) USER MOD Single : A 71 THR OG1 : rot -69:sc= 0.7 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.095) USER MOD Single : A 79 TYR OH : rot -106:sc= -0.21 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= -0.0099 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 GLN : amide:sc= -0.113 K(o=-0.11,f=-1.4!) USER MOD Single : A 97 ASN : amide:sc= -4.3! C(o=-4.3!,f=-7.2!) USER MOD Single : A 99 ASN : amide:sc= -1.55 K(o=-1.5,f=-3.4) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.506 -26.571 -9.480 1.00 0.00 N ATOM 2 CA GLY A 1 26.986 -25.259 -9.815 1.00 0.00 C ATOM 3 C GLY A 1 25.593 -25.322 -10.409 1.00 0.00 C ATOM 4 O GLY A 1 25.433 -25.456 -11.622 1.00 0.00 O ATOM 0 H1 GLY A 1 28.460 -26.474 -9.078 1.00 0.00 H new ATOM 0 H2 GLY A 1 26.881 -27.025 -8.783 1.00 0.00 H new ATOM 0 H3 GLY A 1 27.550 -27.156 -10.338 1.00 0.00 H new ATOM 0 HA2 GLY A 1 26.968 -24.639 -8.919 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.658 -24.775 -10.524 1.00 0.00 H new ATOM 8 N SER A 2 24.581 -25.227 -9.552 1.00 0.00 N ATOM 9 CA SER A 2 23.194 -25.280 -9.999 1.00 0.00 C ATOM 10 C SER A 2 22.530 -23.911 -9.874 1.00 0.00 C ATOM 11 O SER A 2 22.581 -23.278 -8.820 1.00 0.00 O ATOM 12 CB SER A 2 22.413 -26.314 -9.185 1.00 0.00 C ATOM 13 OG SER A 2 22.915 -27.620 -9.405 1.00 0.00 O ATOM 0 H SER A 2 24.696 -25.113 -8.545 1.00 0.00 H new ATOM 0 HA SER A 2 23.187 -25.574 -11.049 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.477 -26.070 -8.125 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.358 -26.275 -9.458 1.00 0.00 H new ATOM 0 HG SER A 2 22.401 -28.262 -8.873 1.00 0.00 H new ATOM 19 N SER A 3 21.908 -23.461 -10.959 1.00 0.00 N ATOM 20 CA SER A 3 21.238 -22.166 -10.974 1.00 0.00 C ATOM 21 C SER A 3 19.838 -22.272 -10.376 1.00 0.00 C ATOM 22 O SER A 3 19.539 -21.655 -9.355 1.00 0.00 O ATOM 23 CB SER A 3 21.155 -21.627 -12.403 1.00 0.00 C ATOM 24 OG SER A 3 20.366 -20.451 -12.460 1.00 0.00 O ATOM 0 H SER A 3 21.854 -23.974 -11.839 1.00 0.00 H new ATOM 0 HA SER A 3 21.823 -21.475 -10.367 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.158 -21.414 -12.773 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.728 -22.387 -13.057 1.00 0.00 H new ATOM 0 HG SER A 3 20.330 -20.126 -13.384 1.00 0.00 H new ATOM 30 N GLY A 4 18.984 -23.061 -11.022 1.00 0.00 N ATOM 31 CA GLY A 4 17.626 -23.235 -10.540 1.00 0.00 C ATOM 32 C GLY A 4 16.636 -22.342 -11.263 1.00 0.00 C ATOM 33 O GLY A 4 17.023 -21.358 -11.893 1.00 0.00 O ATOM 0 H GLY A 4 19.208 -23.582 -11.870 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.330 -24.277 -10.665 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.592 -23.020 -9.472 1.00 0.00 H new ATOM 37 N SER A 5 15.356 -22.687 -11.173 1.00 0.00 N ATOM 38 CA SER A 5 14.308 -21.913 -11.828 1.00 0.00 C ATOM 39 C SER A 5 12.954 -22.169 -11.174 1.00 0.00 C ATOM 40 O SER A 5 12.755 -23.187 -10.511 1.00 0.00 O ATOM 41 CB SER A 5 14.242 -22.261 -13.317 1.00 0.00 C ATOM 42 OG SER A 5 14.010 -23.646 -13.507 1.00 0.00 O ATOM 0 H SER A 5 15.019 -23.497 -10.653 1.00 0.00 H new ATOM 0 HA SER A 5 14.550 -20.856 -11.720 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.447 -21.687 -13.793 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.175 -21.975 -13.802 1.00 0.00 H new ATOM 0 HG SER A 5 13.970 -23.842 -14.466 1.00 0.00 H new ATOM 48 N SER A 6 12.025 -21.238 -11.366 1.00 0.00 N ATOM 49 CA SER A 6 10.690 -21.359 -10.792 1.00 0.00 C ATOM 50 C SER A 6 9.630 -21.401 -11.888 1.00 0.00 C ATOM 51 O SER A 6 8.569 -20.791 -11.764 1.00 0.00 O ATOM 52 CB SER A 6 10.412 -20.193 -9.841 1.00 0.00 C ATOM 53 OG SER A 6 10.998 -18.995 -10.319 1.00 0.00 O ATOM 0 H SER A 6 12.172 -20.391 -11.915 1.00 0.00 H new ATOM 0 HA SER A 6 10.646 -22.293 -10.232 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.336 -20.057 -9.732 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.806 -20.425 -8.851 1.00 0.00 H new ATOM 0 HG SER A 6 10.805 -18.265 -9.695 1.00 0.00 H new ATOM 59 N GLY A 7 9.925 -22.127 -12.962 1.00 0.00 N ATOM 60 CA GLY A 7 8.989 -22.235 -14.065 1.00 0.00 C ATOM 61 C GLY A 7 8.676 -20.892 -14.695 1.00 0.00 C ATOM 62 O GLY A 7 9.580 -20.178 -15.131 1.00 0.00 O ATOM 0 H GLY A 7 10.796 -22.642 -13.088 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.401 -22.901 -14.823 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.065 -22.690 -13.709 1.00 0.00 H new ATOM 66 N ARG A 8 7.394 -20.547 -14.744 1.00 0.00 N ATOM 67 CA ARG A 8 6.964 -19.282 -15.328 1.00 0.00 C ATOM 68 C ARG A 8 5.511 -18.984 -14.970 1.00 0.00 C ATOM 69 O ARG A 8 4.702 -19.897 -14.811 1.00 0.00 O ATOM 70 CB ARG A 8 7.131 -19.315 -16.848 1.00 0.00 C ATOM 71 CG ARG A 8 6.803 -17.995 -17.526 1.00 0.00 C ATOM 72 CD ARG A 8 7.924 -16.983 -17.345 1.00 0.00 C ATOM 73 NE ARG A 8 7.570 -15.672 -17.884 1.00 0.00 N ATOM 74 CZ ARG A 8 8.390 -14.627 -17.874 1.00 0.00 C ATOM 75 NH1 ARG A 8 9.605 -14.740 -17.356 1.00 0.00 N ATOM 76 NH2 ARG A 8 7.996 -13.468 -18.383 1.00 0.00 N ATOM 0 H ARG A 8 6.634 -21.126 -14.386 1.00 0.00 H new ATOM 0 HA ARG A 8 7.590 -18.489 -14.918 1.00 0.00 H new ATOM 0 HB2 ARG A 8 8.158 -19.591 -17.086 1.00 0.00 H new ATOM 0 HB3 ARG A 8 6.489 -20.094 -17.259 1.00 0.00 H new ATOM 0 HG2 ARG A 8 6.631 -18.163 -18.589 1.00 0.00 H new ATOM 0 HG3 ARG A 8 5.878 -17.593 -17.113 1.00 0.00 H new ATOM 0 HD2 ARG A 8 8.159 -16.888 -16.285 1.00 0.00 H new ATOM 0 HD3 ARG A 8 8.825 -17.347 -17.839 1.00 0.00 H new ATOM 0 HE ARG A 8 6.642 -15.553 -18.290 1.00 0.00 H new ATOM 0 HH11 ARG A 8 9.912 -15.630 -16.964 1.00 0.00 H new ATOM 0 HH12 ARG A 8 10.233 -13.936 -17.349 1.00 0.00 H new ATOM 0 HH21 ARG A 8 7.062 -13.378 -18.783 1.00 0.00 H new ATOM 0 HH22 ARG A 8 8.627 -12.666 -18.375 1.00 0.00 H new ATOM 90 N GLN A 9 5.189 -17.700 -14.846 1.00 0.00 N ATOM 91 CA GLN A 9 3.834 -17.283 -14.507 1.00 0.00 C ATOM 92 C GLN A 9 3.483 -15.966 -15.192 1.00 0.00 C ATOM 93 O GLN A 9 4.254 -15.008 -15.149 1.00 0.00 O ATOM 94 CB GLN A 9 3.688 -17.137 -12.991 1.00 0.00 C ATOM 95 CG GLN A 9 2.273 -17.381 -12.491 1.00 0.00 C ATOM 96 CD GLN A 9 1.437 -16.116 -12.466 1.00 0.00 C ATOM 97 OE1 GLN A 9 1.752 -15.164 -11.751 1.00 0.00 O ATOM 98 NE2 GLN A 9 0.365 -16.100 -13.249 1.00 0.00 N ATOM 0 H GLN A 9 5.847 -16.932 -14.975 1.00 0.00 H new ATOM 0 HA GLN A 9 3.145 -18.050 -14.860 1.00 0.00 H new ATOM 0 HB2 GLN A 9 4.364 -17.837 -12.500 1.00 0.00 H new ATOM 0 HB3 GLN A 9 4.000 -16.134 -12.699 1.00 0.00 H new ATOM 0 HG2 GLN A 9 1.788 -18.120 -13.129 1.00 0.00 H new ATOM 0 HG3 GLN A 9 2.314 -17.805 -11.488 1.00 0.00 H new ATOM 0 HE21 GLN A 9 0.142 -16.912 -13.825 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -0.236 -15.276 -13.275 1.00 0.00 H new ATOM 107 N ARG A 10 2.314 -15.927 -15.823 1.00 0.00 N ATOM 108 CA ARG A 10 1.861 -14.729 -16.518 1.00 0.00 C ATOM 109 C ARG A 10 1.722 -13.557 -15.550 1.00 0.00 C ATOM 110 O ARG A 10 1.562 -13.751 -14.345 1.00 0.00 O ATOM 111 CB ARG A 10 0.523 -14.991 -17.213 1.00 0.00 C ATOM 112 CG ARG A 10 -0.627 -15.230 -16.249 1.00 0.00 C ATOM 113 CD ARG A 10 -1.831 -15.832 -16.957 1.00 0.00 C ATOM 114 NE ARG A 10 -1.625 -17.240 -17.287 1.00 0.00 N ATOM 115 CZ ARG A 10 -2.616 -18.094 -17.515 1.00 0.00 C ATOM 116 NH1 ARG A 10 -3.876 -17.686 -17.450 1.00 0.00 N ATOM 117 NH2 ARG A 10 -2.348 -19.360 -17.810 1.00 0.00 N ATOM 0 H ARG A 10 1.664 -16.712 -15.867 1.00 0.00 H new ATOM 0 HA ARG A 10 2.609 -14.471 -17.268 1.00 0.00 H new ATOM 0 HB2 ARG A 10 0.281 -14.140 -17.850 1.00 0.00 H new ATOM 0 HB3 ARG A 10 0.626 -15.858 -17.865 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -0.302 -15.897 -15.451 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -0.912 -14.288 -15.780 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -2.711 -15.734 -16.322 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -2.032 -15.271 -17.870 1.00 0.00 H new ATOM 0 HE ARG A 10 -0.667 -17.586 -17.346 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.086 -16.714 -17.224 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -4.635 -18.344 -17.626 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -1.380 -19.678 -17.862 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -3.110 -20.015 -17.985 1.00 0.00 H new ATOM 131 N SER A 11 1.785 -12.343 -16.086 1.00 0.00 N ATOM 132 CA SER A 11 1.671 -11.140 -15.269 1.00 0.00 C ATOM 133 C SER A 11 0.328 -10.454 -15.497 1.00 0.00 C ATOM 134 O SER A 11 0.224 -9.510 -16.282 1.00 0.00 O ATOM 135 CB SER A 11 2.812 -10.172 -15.587 1.00 0.00 C ATOM 136 OG SER A 11 2.820 -9.828 -16.961 1.00 0.00 O ATOM 0 H SER A 11 1.914 -12.166 -17.082 1.00 0.00 H new ATOM 0 HA SER A 11 1.736 -11.434 -14.221 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.707 -9.270 -14.984 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.765 -10.627 -15.317 1.00 0.00 H new ATOM 0 HG SER A 11 1.935 -9.497 -17.220 1.00 0.00 H new ATOM 142 N LEU A 12 -0.700 -10.934 -14.805 1.00 0.00 N ATOM 143 CA LEU A 12 -2.039 -10.368 -14.931 1.00 0.00 C ATOM 144 C LEU A 12 -2.168 -9.088 -14.112 1.00 0.00 C ATOM 145 O LEU A 12 -2.015 -9.103 -12.891 1.00 0.00 O ATOM 146 CB LEU A 12 -3.088 -11.385 -14.479 1.00 0.00 C ATOM 147 CG LEU A 12 -4.458 -11.279 -15.149 1.00 0.00 C ATOM 148 CD1 LEU A 12 -5.351 -12.434 -14.724 1.00 0.00 C ATOM 149 CD2 LEU A 12 -5.113 -9.946 -14.816 1.00 0.00 C ATOM 0 H LEU A 12 -0.632 -11.714 -14.151 1.00 0.00 H new ATOM 0 HA LEU A 12 -2.207 -10.124 -15.980 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.695 -12.386 -14.657 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -3.224 -11.283 -13.402 1.00 0.00 H new ATOM 0 HG LEU A 12 -4.318 -11.333 -16.229 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -6.322 -12.342 -15.211 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -4.888 -13.377 -15.014 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.484 -12.412 -13.642 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.087 -9.888 -15.301 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.240 -9.862 -13.737 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -4.482 -9.132 -15.171 1.00 0.00 H new ATOM 161 N SER A 13 -2.452 -7.982 -14.793 1.00 0.00 N ATOM 162 CA SER A 13 -2.600 -6.693 -14.129 1.00 0.00 C ATOM 163 C SER A 13 -3.259 -6.858 -12.763 1.00 0.00 C ATOM 164 O SER A 13 -2.617 -6.686 -11.725 1.00 0.00 O ATOM 165 CB SER A 13 -3.428 -5.741 -14.995 1.00 0.00 C ATOM 166 OG SER A 13 -2.874 -5.622 -16.294 1.00 0.00 O ATOM 0 H SER A 13 -2.584 -7.953 -15.804 1.00 0.00 H new ATOM 0 HA SER A 13 -1.606 -6.270 -13.985 1.00 0.00 H new ATOM 0 HB2 SER A 13 -4.453 -6.106 -15.065 1.00 0.00 H new ATOM 0 HB3 SER A 13 -3.471 -4.759 -14.523 1.00 0.00 H new ATOM 0 HG SER A 13 -3.422 -5.010 -16.828 1.00 0.00 H new ATOM 172 N THR A 14 -4.545 -7.193 -12.769 1.00 0.00 N ATOM 173 CA THR A 14 -5.293 -7.381 -11.532 1.00 0.00 C ATOM 174 C THR A 14 -5.204 -8.824 -11.050 1.00 0.00 C ATOM 175 O THR A 14 -5.896 -9.704 -11.562 1.00 0.00 O ATOM 176 CB THR A 14 -6.775 -7.001 -11.709 1.00 0.00 C ATOM 177 OG1 THR A 14 -6.881 -5.679 -12.250 1.00 0.00 O ATOM 178 CG2 THR A 14 -7.513 -7.071 -10.380 1.00 0.00 C ATOM 0 H THR A 14 -5.091 -7.340 -13.618 1.00 0.00 H new ATOM 0 HA THR A 14 -4.844 -6.724 -10.787 1.00 0.00 H new ATOM 0 HB THR A 14 -7.230 -7.712 -12.398 1.00 0.00 H new ATOM 0 HG1 THR A 14 -7.826 -5.446 -12.361 1.00 0.00 H new ATOM 0 HG21 THR A 14 -8.558 -6.799 -10.529 1.00 0.00 H new ATOM 0 HG22 THR A 14 -7.455 -8.085 -9.985 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.055 -6.379 -9.673 1.00 0.00 H new ATOM 186 N SER A 15 -4.348 -9.061 -10.061 1.00 0.00 N ATOM 187 CA SER A 15 -4.166 -10.400 -9.511 1.00 0.00 C ATOM 188 C SER A 15 -4.283 -10.382 -7.990 1.00 0.00 C ATOM 189 O SER A 15 -5.077 -11.120 -7.409 1.00 0.00 O ATOM 190 CB SER A 15 -2.805 -10.963 -9.923 1.00 0.00 C ATOM 191 OG SER A 15 -1.759 -10.067 -9.587 1.00 0.00 O ATOM 0 H SER A 15 -3.770 -8.343 -9.624 1.00 0.00 H new ATOM 0 HA SER A 15 -4.952 -11.041 -9.911 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.640 -11.921 -9.430 1.00 0.00 H new ATOM 0 HB3 SER A 15 -2.796 -11.151 -10.997 1.00 0.00 H new ATOM 0 HG SER A 15 -0.899 -10.451 -9.859 1.00 0.00 H new ATOM 197 N GLY A 16 -3.484 -9.533 -7.351 1.00 0.00 N ATOM 198 CA GLY A 16 -3.512 -9.435 -5.903 1.00 0.00 C ATOM 199 C GLY A 16 -2.418 -8.536 -5.362 1.00 0.00 C ATOM 200 O GLY A 16 -2.698 -7.535 -4.703 1.00 0.00 O ATOM 0 H GLY A 16 -2.818 -8.911 -7.810 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -4.482 -9.052 -5.586 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -3.406 -10.431 -5.472 1.00 0.00 H new ATOM 204 N GLU A 17 -1.168 -8.894 -5.639 1.00 0.00 N ATOM 205 CA GLU A 17 -0.029 -8.113 -5.173 1.00 0.00 C ATOM 206 C GLU A 17 -0.275 -6.620 -5.370 1.00 0.00 C ATOM 207 O GLU A 17 -0.052 -6.081 -6.454 1.00 0.00 O ATOM 208 CB GLU A 17 1.243 -8.533 -5.912 1.00 0.00 C ATOM 209 CG GLU A 17 2.522 -8.184 -5.170 1.00 0.00 C ATOM 210 CD GLU A 17 3.769 -8.592 -5.932 1.00 0.00 C ATOM 211 OE1 GLU A 17 3.732 -8.582 -7.180 1.00 0.00 O ATOM 212 OE2 GLU A 17 4.781 -8.921 -5.279 1.00 0.00 O ATOM 0 H GLU A 17 -0.919 -9.720 -6.184 1.00 0.00 H new ATOM 0 HA GLU A 17 0.098 -8.305 -4.108 1.00 0.00 H new ATOM 0 HB2 GLU A 17 1.215 -9.609 -6.084 1.00 0.00 H new ATOM 0 HB3 GLU A 17 1.259 -8.054 -6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 17 2.549 -7.110 -4.985 1.00 0.00 H new ATOM 0 HG3 GLU A 17 2.519 -8.675 -4.197 1.00 0.00 H new ATOM 219 N SER A 18 -0.737 -5.958 -4.314 1.00 0.00 N ATOM 220 CA SER A 18 -1.019 -4.529 -4.372 1.00 0.00 C ATOM 221 C SER A 18 -0.262 -3.782 -3.277 1.00 0.00 C ATOM 222 O SER A 18 0.658 -3.013 -3.557 1.00 0.00 O ATOM 223 CB SER A 18 -2.522 -4.277 -4.231 1.00 0.00 C ATOM 224 OG SER A 18 -3.161 -4.290 -5.495 1.00 0.00 O ATOM 0 H SER A 18 -0.924 -6.389 -3.408 1.00 0.00 H new ATOM 0 HA SER A 18 -0.685 -4.157 -5.341 1.00 0.00 H new ATOM 0 HB2 SER A 18 -2.963 -5.039 -3.589 1.00 0.00 H new ATOM 0 HB3 SER A 18 -2.689 -3.316 -3.745 1.00 0.00 H new ATOM 0 HG SER A 18 -4.121 -4.128 -5.378 1.00 0.00 H new ATOM 230 N LEU A 19 -0.657 -4.014 -2.030 1.00 0.00 N ATOM 231 CA LEU A 19 -0.017 -3.363 -0.892 1.00 0.00 C ATOM 232 C LEU A 19 1.502 -3.389 -1.033 1.00 0.00 C ATOM 233 O LEU A 19 2.186 -2.434 -0.666 1.00 0.00 O ATOM 234 CB LEU A 19 -0.431 -4.049 0.411 1.00 0.00 C ATOM 235 CG LEU A 19 -1.922 -4.003 0.749 1.00 0.00 C ATOM 236 CD1 LEU A 19 -2.244 -4.976 1.873 1.00 0.00 C ATOM 237 CD2 LEU A 19 -2.340 -2.590 1.128 1.00 0.00 C ATOM 0 H LEU A 19 -1.417 -4.647 -1.781 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.343 -2.323 -0.868 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -0.122 -5.093 0.363 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.121 -3.591 1.231 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.485 -4.302 -0.135 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.309 -4.930 2.100 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.982 -5.988 1.564 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.672 -4.708 2.761 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.404 -2.577 1.365 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.770 -2.263 1.998 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.146 -1.917 0.293 1.00 0.00 H new ATOM 249 N TYR A 20 2.022 -4.487 -1.570 1.00 0.00 N ATOM 250 CA TYR A 20 3.460 -4.638 -1.760 1.00 0.00 C ATOM 251 C TYR A 20 3.967 -3.696 -2.847 1.00 0.00 C ATOM 252 O TYR A 20 4.896 -2.917 -2.627 1.00 0.00 O ATOM 253 CB TYR A 20 3.799 -6.084 -2.124 1.00 0.00 C ATOM 254 CG TYR A 20 3.369 -7.089 -1.078 1.00 0.00 C ATOM 255 CD1 TYR A 20 4.103 -7.264 0.089 1.00 0.00 C ATOM 256 CD2 TYR A 20 2.228 -7.862 -1.257 1.00 0.00 C ATOM 257 CE1 TYR A 20 3.714 -8.181 1.046 1.00 0.00 C ATOM 258 CE2 TYR A 20 1.831 -8.780 -0.304 1.00 0.00 C ATOM 259 CZ TYR A 20 2.577 -8.936 0.845 1.00 0.00 C ATOM 260 OH TYR A 20 2.186 -9.849 1.797 1.00 0.00 O ATOM 0 H TYR A 20 1.469 -5.286 -1.881 1.00 0.00 H new ATOM 0 HA TYR A 20 3.954 -4.382 -0.823 1.00 0.00 H new ATOM 0 HB2 TYR A 20 3.322 -6.332 -3.072 1.00 0.00 H new ATOM 0 HB3 TYR A 20 4.875 -6.169 -2.277 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.992 -6.673 0.250 1.00 0.00 H new ATOM 0 HD2 TYR A 20 1.642 -7.743 -2.156 1.00 0.00 H new ATOM 0 HE1 TYR A 20 4.297 -8.306 1.947 1.00 0.00 H new ATOM 0 HE2 TYR A 20 0.941 -9.372 -0.458 1.00 0.00 H new ATOM 0 HH TYR A 20 1.365 -10.297 1.503 1.00 0.00 H new ATOM 270 N HIS A 21 3.351 -3.772 -4.022 1.00 0.00 N ATOM 271 CA HIS A 21 3.738 -2.925 -5.145 1.00 0.00 C ATOM 272 C HIS A 21 3.668 -1.450 -4.762 1.00 0.00 C ATOM 273 O HIS A 21 4.608 -0.691 -5.002 1.00 0.00 O ATOM 274 CB HIS A 21 2.835 -3.195 -6.349 1.00 0.00 C ATOM 275 CG HIS A 21 3.347 -4.276 -7.251 1.00 0.00 C ATOM 276 ND1 HIS A 21 3.435 -4.135 -8.620 1.00 0.00 N ATOM 277 CD2 HIS A 21 3.800 -5.521 -6.972 1.00 0.00 C ATOM 278 CE1 HIS A 21 3.919 -5.247 -9.144 1.00 0.00 C ATOM 279 NE2 HIS A 21 4.150 -6.103 -8.166 1.00 0.00 N ATOM 0 H HIS A 21 2.582 -4.411 -4.222 1.00 0.00 H new ATOM 0 HA HIS A 21 4.767 -3.164 -5.411 1.00 0.00 H new ATOM 0 HB2 HIS A 21 1.842 -3.470 -5.994 1.00 0.00 H new ATOM 0 HB3 HIS A 21 2.725 -2.275 -6.924 1.00 0.00 H new ATOM 0 HD2 HIS A 21 3.873 -5.972 -5.993 1.00 0.00 H new ATOM 0 HE1 HIS A 21 4.096 -5.425 -10.194 1.00 0.00 H new ATOM 0 HE2 HIS A 21 4.527 -7.044 -8.279 1.00 0.00 H new ATOM 287 N VAL A 22 2.549 -1.050 -4.168 1.00 0.00 N ATOM 288 CA VAL A 22 2.357 0.334 -3.752 1.00 0.00 C ATOM 289 C VAL A 22 3.652 0.931 -3.214 1.00 0.00 C ATOM 290 O VAL A 22 3.995 2.075 -3.519 1.00 0.00 O ATOM 291 CB VAL A 22 1.264 0.450 -2.672 1.00 0.00 C ATOM 292 CG1 VAL A 22 1.134 1.888 -2.196 1.00 0.00 C ATOM 293 CG2 VAL A 22 -0.064 -0.068 -3.202 1.00 0.00 C ATOM 0 H VAL A 22 1.761 -1.665 -3.964 1.00 0.00 H new ATOM 0 HA VAL A 22 2.044 0.889 -4.636 1.00 0.00 H new ATOM 0 HB VAL A 22 1.553 -0.164 -1.819 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.357 1.950 -1.434 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.083 2.219 -1.775 1.00 0.00 H new ATOM 0 HG13 VAL A 22 0.868 2.527 -3.038 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -0.825 0.021 -2.427 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -0.362 0.518 -4.072 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.042 -1.114 -3.488 1.00 0.00 H new ATOM 303 N LEU A 23 4.370 0.151 -2.414 1.00 0.00 N ATOM 304 CA LEU A 23 5.630 0.602 -1.833 1.00 0.00 C ATOM 305 C LEU A 23 6.800 0.281 -2.757 1.00 0.00 C ATOM 306 O LEU A 23 7.738 1.068 -2.884 1.00 0.00 O ATOM 307 CB LEU A 23 5.848 -0.053 -0.468 1.00 0.00 C ATOM 308 CG LEU A 23 4.661 -0.008 0.495 1.00 0.00 C ATOM 309 CD1 LEU A 23 4.902 -0.928 1.682 1.00 0.00 C ATOM 310 CD2 LEU A 23 4.410 1.417 0.966 1.00 0.00 C ATOM 0 H LEU A 23 4.101 -0.798 -2.153 1.00 0.00 H new ATOM 0 HA LEU A 23 5.577 1.683 -1.706 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.122 -1.096 -0.627 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.699 0.430 0.013 1.00 0.00 H new ATOM 0 HG LEU A 23 3.774 -0.356 -0.035 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.047 -0.883 2.357 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.032 -1.951 1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.800 -0.610 2.212 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.562 1.430 1.650 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.296 1.792 1.479 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.192 2.051 0.107 1.00 0.00 H new ATOM 322 N GLY A 24 6.738 -0.880 -3.402 1.00 0.00 N ATOM 323 CA GLY A 24 7.798 -1.283 -4.307 1.00 0.00 C ATOM 324 C GLY A 24 8.611 -2.444 -3.768 1.00 0.00 C ATOM 325 O GLY A 24 9.827 -2.500 -3.956 1.00 0.00 O ATOM 0 H GLY A 24 5.973 -1.548 -3.314 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.365 -1.562 -5.268 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.458 -0.435 -4.489 1.00 0.00 H new ATOM 329 N LEU A 25 7.940 -3.371 -3.094 1.00 0.00 N ATOM 330 CA LEU A 25 8.608 -4.536 -2.523 1.00 0.00 C ATOM 331 C LEU A 25 8.007 -5.828 -3.066 1.00 0.00 C ATOM 332 O LEU A 25 7.106 -5.802 -3.905 1.00 0.00 O ATOM 333 CB LEU A 25 8.503 -4.512 -0.998 1.00 0.00 C ATOM 334 CG LEU A 25 9.213 -3.355 -0.294 1.00 0.00 C ATOM 335 CD1 LEU A 25 8.962 -3.407 1.205 1.00 0.00 C ATOM 336 CD2 LEU A 25 10.706 -3.387 -0.588 1.00 0.00 C ATOM 0 H LEU A 25 6.934 -3.339 -2.929 1.00 0.00 H new ATOM 0 HA LEU A 25 9.659 -4.498 -2.809 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.448 -4.483 -0.727 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.906 -5.448 -0.611 1.00 0.00 H new ATOM 0 HG LEU A 25 8.807 -2.419 -0.677 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.475 -2.576 1.689 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.892 -3.334 1.397 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.339 -4.348 1.605 1.00 0.00 H new ATOM 0 HD21 LEU A 25 11.195 -2.556 -0.079 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.127 -4.328 -0.234 1.00 0.00 H new ATOM 0 HD23 LEU A 25 10.867 -3.299 -1.662 1.00 0.00 H new ATOM 348 N ASP A 26 8.510 -6.958 -2.580 1.00 0.00 N ATOM 349 CA ASP A 26 8.020 -8.261 -3.014 1.00 0.00 C ATOM 350 C ASP A 26 7.052 -8.846 -1.991 1.00 0.00 C ATOM 351 O ASP A 26 7.038 -8.438 -0.829 1.00 0.00 O ATOM 352 CB ASP A 26 9.190 -9.222 -3.234 1.00 0.00 C ATOM 353 CG ASP A 26 10.255 -8.639 -4.142 1.00 0.00 C ATOM 354 OD1 ASP A 26 11.074 -7.832 -3.653 1.00 0.00 O ATOM 355 OD2 ASP A 26 10.269 -8.988 -5.341 1.00 0.00 O ATOM 0 H ASP A 26 9.256 -6.998 -1.886 1.00 0.00 H new ATOM 0 HA ASP A 26 7.488 -8.126 -3.956 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.635 -9.474 -2.272 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.817 -10.151 -3.666 1.00 0.00 H new ATOM 360 N LYS A 27 6.241 -9.803 -2.430 1.00 0.00 N ATOM 361 CA LYS A 27 5.269 -10.445 -1.553 1.00 0.00 C ATOM 362 C LYS A 27 5.944 -10.994 -0.301 1.00 0.00 C ATOM 363 O LYS A 27 5.430 -10.848 0.807 1.00 0.00 O ATOM 364 CB LYS A 27 4.550 -11.574 -2.295 1.00 0.00 C ATOM 365 CG LYS A 27 3.505 -11.085 -3.283 1.00 0.00 C ATOM 366 CD LYS A 27 2.334 -12.048 -3.379 1.00 0.00 C ATOM 367 CE LYS A 27 1.230 -11.683 -2.398 1.00 0.00 C ATOM 368 NZ LYS A 27 1.488 -12.240 -1.041 1.00 0.00 N ATOM 0 H LYS A 27 6.238 -10.151 -3.389 1.00 0.00 H new ATOM 0 HA LYS A 27 4.539 -9.694 -1.250 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.288 -12.175 -2.827 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.071 -12.228 -1.567 1.00 0.00 H new ATOM 0 HG2 LYS A 27 3.145 -10.103 -2.977 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.960 -10.965 -4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 27 1.937 -12.040 -4.394 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.679 -13.063 -3.179 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.144 -10.598 -2.335 1.00 0.00 H new ATOM 0 HE3 LYS A 27 0.276 -12.057 -2.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.589 -12.541 -0.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.127 -13.057 -1.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.928 -11.511 -0.444 1.00 0.00 H new ATOM 382 N ASN A 28 7.100 -11.625 -0.485 1.00 0.00 N ATOM 383 CA ASN A 28 7.846 -12.195 0.630 1.00 0.00 C ATOM 384 C ASN A 28 8.765 -11.153 1.259 1.00 0.00 C ATOM 385 O ASN A 28 9.787 -11.490 1.856 1.00 0.00 O ATOM 386 CB ASN A 28 8.666 -13.398 0.161 1.00 0.00 C ATOM 387 CG ASN A 28 7.909 -14.265 -0.826 1.00 0.00 C ATOM 388 OD1 ASN A 28 6.887 -14.863 -0.487 1.00 0.00 O ATOM 389 ND2 ASN A 28 8.407 -14.337 -2.055 1.00 0.00 N ATOM 0 H ASN A 28 7.540 -11.754 -1.396 1.00 0.00 H new ATOM 0 HA ASN A 28 7.130 -12.524 1.383 1.00 0.00 H new ATOM 0 HB2 ASN A 28 9.589 -13.047 -0.301 1.00 0.00 H new ATOM 0 HB3 ASN A 28 8.951 -13.999 1.025 1.00 0.00 H new ATOM 0 HD21 ASN A 28 7.940 -14.905 -2.762 1.00 0.00 H new ATOM 0 HD22 ASN A 28 9.257 -13.825 -2.292 1.00 0.00 H new ATOM 396 N ALA A 29 8.393 -9.884 1.122 1.00 0.00 N ATOM 397 CA ALA A 29 9.182 -8.792 1.679 1.00 0.00 C ATOM 398 C ALA A 29 9.229 -8.869 3.201 1.00 0.00 C ATOM 399 O ALA A 29 8.233 -9.195 3.848 1.00 0.00 O ATOM 400 CB ALA A 29 8.617 -7.452 1.233 1.00 0.00 C ATOM 0 H ALA A 29 7.550 -9.587 0.630 1.00 0.00 H new ATOM 0 HA ALA A 29 10.202 -8.886 1.306 1.00 0.00 H new ATOM 0 HB1 ALA A 29 9.216 -6.646 1.656 1.00 0.00 H new ATOM 0 HB2 ALA A 29 8.642 -7.390 0.145 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.587 -7.359 1.578 1.00 0.00 H new ATOM 406 N THR A 30 10.393 -8.569 3.769 1.00 0.00 N ATOM 407 CA THR A 30 10.570 -8.606 5.215 1.00 0.00 C ATOM 408 C THR A 30 10.078 -7.316 5.863 1.00 0.00 C ATOM 409 O THR A 30 10.078 -6.257 5.236 1.00 0.00 O ATOM 410 CB THR A 30 12.046 -8.827 5.595 1.00 0.00 C ATOM 411 OG1 THR A 30 12.890 -8.003 4.783 1.00 0.00 O ATOM 412 CG2 THR A 30 12.436 -10.287 5.422 1.00 0.00 C ATOM 0 H THR A 30 11.227 -8.298 3.249 1.00 0.00 H new ATOM 0 HA THR A 30 9.978 -9.444 5.584 1.00 0.00 H new ATOM 0 HB THR A 30 12.173 -8.555 6.643 1.00 0.00 H new ATOM 0 HG1 THR A 30 13.827 -8.148 5.032 1.00 0.00 H new ATOM 0 HG21 THR A 30 13.483 -10.419 5.696 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.812 -10.909 6.063 1.00 0.00 H new ATOM 0 HG23 THR A 30 12.294 -10.581 4.382 1.00 0.00 H new ATOM 420 N SER A 31 9.660 -7.413 7.121 1.00 0.00 N ATOM 421 CA SER A 31 9.163 -6.254 7.852 1.00 0.00 C ATOM 422 C SER A 31 10.179 -5.116 7.823 1.00 0.00 C ATOM 423 O SER A 31 9.819 -3.952 7.650 1.00 0.00 O ATOM 424 CB SER A 31 8.848 -6.635 9.300 1.00 0.00 C ATOM 425 OG SER A 31 9.955 -7.275 9.911 1.00 0.00 O ATOM 0 H SER A 31 9.656 -8.282 7.655 1.00 0.00 H new ATOM 0 HA SER A 31 8.249 -5.913 7.366 1.00 0.00 H new ATOM 0 HB2 SER A 31 8.583 -5.741 9.865 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.982 -7.296 9.325 1.00 0.00 H new ATOM 0 HG SER A 31 9.729 -7.507 10.836 1.00 0.00 H new ATOM 431 N ASP A 32 11.450 -5.462 7.994 1.00 0.00 N ATOM 432 CA ASP A 32 12.520 -4.472 7.987 1.00 0.00 C ATOM 433 C ASP A 32 12.567 -3.732 6.654 1.00 0.00 C ATOM 434 O ASP A 32 12.839 -2.532 6.607 1.00 0.00 O ATOM 435 CB ASP A 32 13.867 -5.143 8.260 1.00 0.00 C ATOM 436 CG ASP A 32 14.903 -4.169 8.787 1.00 0.00 C ATOM 437 OD1 ASP A 32 14.962 -3.032 8.275 1.00 0.00 O ATOM 438 OD2 ASP A 32 15.655 -4.545 9.710 1.00 0.00 O ATOM 0 H ASP A 32 11.764 -6.421 8.139 1.00 0.00 H new ATOM 0 HA ASP A 32 12.317 -3.749 8.777 1.00 0.00 H new ATOM 0 HB2 ASP A 32 13.729 -5.948 8.982 1.00 0.00 H new ATOM 0 HB3 ASP A 32 14.235 -5.599 7.341 1.00 0.00 H new ATOM 443 N ASP A 33 12.301 -4.456 5.572 1.00 0.00 N ATOM 444 CA ASP A 33 12.313 -3.869 4.237 1.00 0.00 C ATOM 445 C ASP A 33 11.103 -2.962 4.032 1.00 0.00 C ATOM 446 O ASP A 33 11.154 -2.012 3.250 1.00 0.00 O ATOM 447 CB ASP A 33 12.329 -4.968 3.173 1.00 0.00 C ATOM 448 CG ASP A 33 13.735 -5.397 2.805 1.00 0.00 C ATOM 449 OD1 ASP A 33 14.454 -5.902 3.693 1.00 0.00 O ATOM 450 OD2 ASP A 33 14.118 -5.228 1.628 1.00 0.00 O ATOM 0 H ASP A 33 12.074 -5.450 5.593 1.00 0.00 H new ATOM 0 HA ASP A 33 13.217 -3.267 4.139 1.00 0.00 H new ATOM 0 HB2 ASP A 33 11.773 -5.831 3.538 1.00 0.00 H new ATOM 0 HB3 ASP A 33 11.815 -4.612 2.280 1.00 0.00 H new ATOM 455 N ILE A 34 10.018 -3.264 4.737 1.00 0.00 N ATOM 456 CA ILE A 34 8.796 -2.476 4.631 1.00 0.00 C ATOM 457 C ILE A 34 8.875 -1.220 5.494 1.00 0.00 C ATOM 458 O ILE A 34 8.388 -0.157 5.109 1.00 0.00 O ATOM 459 CB ILE A 34 7.561 -3.295 5.049 1.00 0.00 C ATOM 460 CG1 ILE A 34 7.428 -4.541 4.172 1.00 0.00 C ATOM 461 CG2 ILE A 34 6.304 -2.441 4.959 1.00 0.00 C ATOM 462 CD1 ILE A 34 6.362 -5.504 4.647 1.00 0.00 C ATOM 0 H ILE A 34 9.960 -4.048 5.387 1.00 0.00 H new ATOM 0 HA ILE A 34 8.695 -2.189 3.584 1.00 0.00 H new ATOM 0 HB ILE A 34 7.688 -3.613 6.084 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.200 -4.234 3.151 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.387 -5.059 4.143 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.439 -3.034 5.258 1.00 0.00 H new ATOM 0 HG22 ILE A 34 6.400 -1.581 5.621 1.00 0.00 H new ATOM 0 HG23 ILE A 34 6.171 -2.096 3.934 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.324 -6.364 3.978 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.599 -5.840 5.656 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.394 -5.003 4.649 1.00 0.00 H new ATOM 474 N LYS A 35 9.494 -1.350 6.662 1.00 0.00 N ATOM 475 CA LYS A 35 9.641 -0.227 7.580 1.00 0.00 C ATOM 476 C LYS A 35 10.643 0.789 7.039 1.00 0.00 C ATOM 477 O LYS A 35 10.368 1.989 7.004 1.00 0.00 O ATOM 478 CB LYS A 35 10.092 -0.721 8.956 1.00 0.00 C ATOM 479 CG LYS A 35 9.002 -1.441 9.731 1.00 0.00 C ATOM 480 CD LYS A 35 9.526 -1.997 11.044 1.00 0.00 C ATOM 481 CE LYS A 35 8.394 -2.280 12.020 1.00 0.00 C ATOM 482 NZ LYS A 35 8.015 -1.069 12.798 1.00 0.00 N ATOM 0 H LYS A 35 9.902 -2.223 6.996 1.00 0.00 H new ATOM 0 HA LYS A 35 8.671 0.261 7.677 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.941 -1.393 8.831 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.441 0.129 9.542 1.00 0.00 H new ATOM 0 HG2 LYS A 35 8.180 -0.753 9.928 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.600 -2.253 9.126 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.083 -2.915 10.855 1.00 0.00 H new ATOM 0 HD3 LYS A 35 10.223 -1.287 11.489 1.00 0.00 H new ATOM 0 HE2 LYS A 35 7.526 -2.646 11.472 1.00 0.00 H new ATOM 0 HE3 LYS A 35 8.695 -3.072 12.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.241 -1.304 13.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 8.836 -0.734 13.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 7.703 -0.321 12.146 1.00 0.00 H new ATOM 496 N LYS A 36 11.804 0.301 6.618 1.00 0.00 N ATOM 497 CA LYS A 36 12.847 1.166 6.076 1.00 0.00 C ATOM 498 C LYS A 36 12.383 1.833 4.785 1.00 0.00 C ATOM 499 O LYS A 36 12.452 3.055 4.648 1.00 0.00 O ATOM 500 CB LYS A 36 14.122 0.360 5.817 1.00 0.00 C ATOM 501 CG LYS A 36 14.029 -0.553 4.607 1.00 0.00 C ATOM 502 CD LYS A 36 15.259 -1.436 4.480 1.00 0.00 C ATOM 503 CE LYS A 36 16.353 -0.755 3.672 1.00 0.00 C ATOM 504 NZ LYS A 36 17.249 0.066 4.533 1.00 0.00 N ATOM 0 H LYS A 36 12.048 -0.689 6.641 1.00 0.00 H new ATOM 0 HA LYS A 36 13.059 1.943 6.810 1.00 0.00 H new ATOM 0 HB2 LYS A 36 14.955 1.049 5.679 1.00 0.00 H new ATOM 0 HB3 LYS A 36 14.348 -0.240 6.698 1.00 0.00 H new ATOM 0 HG2 LYS A 36 13.139 -1.177 4.688 1.00 0.00 H new ATOM 0 HG3 LYS A 36 13.916 0.048 3.704 1.00 0.00 H new ATOM 0 HD2 LYS A 36 15.637 -1.680 5.473 1.00 0.00 H new ATOM 0 HD3 LYS A 36 14.985 -2.377 4.003 1.00 0.00 H new ATOM 0 HE2 LYS A 36 16.942 -1.509 3.150 1.00 0.00 H new ATOM 0 HE3 LYS A 36 15.900 -0.121 2.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 17.280 1.041 4.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 16.886 0.070 5.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 18.207 -0.338 4.522 1.00 0.00 H new ATOM 518 N SER A 37 11.911 1.025 3.843 1.00 0.00 N ATOM 519 CA SER A 37 11.438 1.538 2.562 1.00 0.00 C ATOM 520 C SER A 37 10.303 2.537 2.763 1.00 0.00 C ATOM 521 O SER A 37 10.342 3.651 2.239 1.00 0.00 O ATOM 522 CB SER A 37 10.968 0.387 1.670 1.00 0.00 C ATOM 523 OG SER A 37 12.048 -0.463 1.324 1.00 0.00 O ATOM 0 H SER A 37 11.845 0.012 3.942 1.00 0.00 H new ATOM 0 HA SER A 37 12.268 2.050 2.075 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.200 -0.188 2.187 1.00 0.00 H new ATOM 0 HB3 SER A 37 10.511 0.787 0.765 1.00 0.00 H new ATOM 0 HG SER A 37 12.033 -1.259 1.895 1.00 0.00 H new ATOM 529 N TYR A 38 9.293 2.130 3.524 1.00 0.00 N ATOM 530 CA TYR A 38 8.145 2.988 3.792 1.00 0.00 C ATOM 531 C TYR A 38 8.581 4.437 3.986 1.00 0.00 C ATOM 532 O TYR A 38 8.256 5.308 3.178 1.00 0.00 O ATOM 533 CB TYR A 38 7.396 2.499 5.033 1.00 0.00 C ATOM 534 CG TYR A 38 6.701 3.604 5.796 1.00 0.00 C ATOM 535 CD1 TYR A 38 5.865 4.503 5.146 1.00 0.00 C ATOM 536 CD2 TYR A 38 6.882 3.750 7.166 1.00 0.00 C ATOM 537 CE1 TYR A 38 5.228 5.515 5.839 1.00 0.00 C ATOM 538 CE2 TYR A 38 6.249 4.758 7.867 1.00 0.00 C ATOM 539 CZ TYR A 38 5.423 5.638 7.199 1.00 0.00 C ATOM 540 OH TYR A 38 4.791 6.644 7.893 1.00 0.00 O ATOM 0 H TYR A 38 9.246 1.212 3.966 1.00 0.00 H new ATOM 0 HA TYR A 38 7.479 2.940 2.931 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.657 1.757 4.732 1.00 0.00 H new ATOM 0 HB3 TYR A 38 8.100 1.997 5.697 1.00 0.00 H new ATOM 0 HD1 TYR A 38 5.710 4.410 4.081 1.00 0.00 H new ATOM 0 HD2 TYR A 38 7.529 3.063 7.692 1.00 0.00 H new ATOM 0 HE1 TYR A 38 4.581 6.206 5.319 1.00 0.00 H new ATOM 0 HE2 TYR A 38 6.400 4.857 8.932 1.00 0.00 H new ATOM 0 HH TYR A 38 5.034 6.590 8.841 1.00 0.00 H new ATOM 550 N ARG A 39 9.319 4.687 5.062 1.00 0.00 N ATOM 551 CA ARG A 39 9.799 6.030 5.364 1.00 0.00 C ATOM 552 C ARG A 39 10.383 6.691 4.118 1.00 0.00 C ATOM 553 O ARG A 39 10.018 7.814 3.769 1.00 0.00 O ATOM 554 CB ARG A 39 10.855 5.981 6.470 1.00 0.00 C ATOM 555 CG ARG A 39 10.373 5.305 7.743 1.00 0.00 C ATOM 556 CD ARG A 39 11.388 5.443 8.866 1.00 0.00 C ATOM 557 NE ARG A 39 11.379 6.782 9.450 1.00 0.00 N ATOM 558 CZ ARG A 39 12.239 7.184 10.379 1.00 0.00 C ATOM 559 NH1 ARG A 39 13.172 6.356 10.827 1.00 0.00 N ATOM 560 NH2 ARG A 39 12.167 8.418 10.862 1.00 0.00 N ATOM 0 H ARG A 39 9.598 3.977 5.739 1.00 0.00 H new ATOM 0 HA ARG A 39 8.951 6.623 5.707 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.733 5.453 6.099 1.00 0.00 H new ATOM 0 HB3 ARG A 39 11.170 6.998 6.705 1.00 0.00 H new ATOM 0 HG2 ARG A 39 9.425 5.744 8.053 1.00 0.00 H new ATOM 0 HG3 ARG A 39 10.187 4.249 7.547 1.00 0.00 H new ATOM 0 HD2 ARG A 39 11.173 4.708 9.641 1.00 0.00 H new ATOM 0 HD3 ARG A 39 12.384 5.221 8.484 1.00 0.00 H new ATOM 0 HE ARG A 39 10.674 7.444 9.127 1.00 0.00 H new ATOM 0 HH11 ARG A 39 13.231 5.407 10.458 1.00 0.00 H new ATOM 0 HH12 ARG A 39 13.831 6.668 11.540 1.00 0.00 H new ATOM 0 HH21 ARG A 39 11.451 9.059 10.520 1.00 0.00 H new ATOM 0 HH22 ARG A 39 12.828 8.726 11.575 1.00 0.00 H new ATOM 574 N LYS A 40 11.291 5.987 3.452 1.00 0.00 N ATOM 575 CA LYS A 40 11.925 6.504 2.245 1.00 0.00 C ATOM 576 C LYS A 40 10.881 7.017 1.258 1.00 0.00 C ATOM 577 O LYS A 40 10.962 8.152 0.787 1.00 0.00 O ATOM 578 CB LYS A 40 12.774 5.415 1.584 1.00 0.00 C ATOM 579 CG LYS A 40 13.935 4.944 2.443 1.00 0.00 C ATOM 580 CD LYS A 40 15.070 4.395 1.595 1.00 0.00 C ATOM 581 CE LYS A 40 14.788 2.971 1.141 1.00 0.00 C ATOM 582 NZ LYS A 40 15.217 1.970 2.156 1.00 0.00 N ATOM 0 H LYS A 40 11.605 5.056 3.728 1.00 0.00 H new ATOM 0 HA LYS A 40 12.569 7.336 2.531 1.00 0.00 H new ATOM 0 HB2 LYS A 40 12.137 4.562 1.349 1.00 0.00 H new ATOM 0 HB3 LYS A 40 13.162 5.793 0.638 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.300 5.773 3.049 1.00 0.00 H new ATOM 0 HG3 LYS A 40 13.589 4.174 3.133 1.00 0.00 H new ATOM 0 HD2 LYS A 40 15.216 5.034 0.724 1.00 0.00 H new ATOM 0 HD3 LYS A 40 15.997 4.419 2.167 1.00 0.00 H new ATOM 0 HE2 LYS A 40 13.722 2.856 0.946 1.00 0.00 H new ATOM 0 HE3 LYS A 40 15.306 2.780 0.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 14.606 1.131 2.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 16.203 1.694 1.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 15.142 2.385 3.107 1.00 0.00 H new ATOM 596 N LEU A 41 9.900 6.176 0.951 1.00 0.00 N ATOM 597 CA LEU A 41 8.838 6.545 0.022 1.00 0.00 C ATOM 598 C LEU A 41 8.047 7.740 0.546 1.00 0.00 C ATOM 599 O LEU A 41 7.217 8.306 -0.164 1.00 0.00 O ATOM 600 CB LEU A 41 7.899 5.360 -0.208 1.00 0.00 C ATOM 601 CG LEU A 41 8.564 4.050 -0.634 1.00 0.00 C ATOM 602 CD1 LEU A 41 7.645 2.870 -0.357 1.00 0.00 C ATOM 603 CD2 LEU A 41 8.943 4.099 -2.107 1.00 0.00 C ATOM 0 H LEU A 41 9.818 5.233 1.332 1.00 0.00 H new ATOM 0 HA LEU A 41 9.299 6.824 -0.925 1.00 0.00 H new ATOM 0 HB2 LEU A 41 7.342 5.179 0.712 1.00 0.00 H new ATOM 0 HB3 LEU A 41 7.173 5.640 -0.971 1.00 0.00 H new ATOM 0 HG LEU A 41 9.475 3.920 -0.049 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.135 1.947 -0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.424 2.824 0.709 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.717 2.993 -0.915 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.415 3.159 -2.393 1.00 0.00 H new ATOM 0 HD22 LEU A 41 8.047 4.253 -2.708 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.639 4.921 -2.276 1.00 0.00 H new ATOM 615 N ALA A 42 8.313 8.119 1.792 1.00 0.00 N ATOM 616 CA ALA A 42 7.630 9.249 2.409 1.00 0.00 C ATOM 617 C ALA A 42 8.376 10.552 2.145 1.00 0.00 C ATOM 618 O ALA A 42 7.900 11.634 2.494 1.00 0.00 O ATOM 619 CB ALA A 42 7.477 9.020 3.905 1.00 0.00 C ATOM 0 H ALA A 42 8.997 7.660 2.394 1.00 0.00 H new ATOM 0 HA ALA A 42 6.639 9.331 1.962 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.965 9.872 4.353 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.894 8.115 4.077 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.462 8.909 4.359 1.00 0.00 H new ATOM 625 N LEU A 43 9.547 10.443 1.527 1.00 0.00 N ATOM 626 CA LEU A 43 10.360 11.614 1.216 1.00 0.00 C ATOM 627 C LEU A 43 10.011 12.170 -0.161 1.00 0.00 C ATOM 628 O LEU A 43 10.326 13.317 -0.478 1.00 0.00 O ATOM 629 CB LEU A 43 11.846 11.257 1.273 1.00 0.00 C ATOM 630 CG LEU A 43 12.444 11.090 2.670 1.00 0.00 C ATOM 631 CD1 LEU A 43 13.062 12.395 3.146 1.00 0.00 C ATOM 632 CD2 LEU A 43 11.382 10.612 3.650 1.00 0.00 C ATOM 0 H LEU A 43 9.955 9.556 1.231 1.00 0.00 H new ATOM 0 HA LEU A 43 10.148 12.381 1.961 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.997 10.329 0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 43 12.406 12.033 0.751 1.00 0.00 H new ATOM 0 HG LEU A 43 13.230 10.337 2.620 1.00 0.00 H new ATOM 0 HD11 LEU A 43 13.482 12.256 4.142 1.00 0.00 H new ATOM 0 HD12 LEU A 43 13.852 12.696 2.458 1.00 0.00 H new ATOM 0 HD13 LEU A 43 12.296 13.169 3.180 1.00 0.00 H new ATOM 0 HD21 LEU A 43 11.825 10.498 4.640 1.00 0.00 H new ATOM 0 HD22 LEU A 43 10.574 11.342 3.696 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.986 9.653 3.318 1.00 0.00 H new ATOM 644 N LYS A 44 9.356 11.349 -0.975 1.00 0.00 N ATOM 645 CA LYS A 44 8.960 11.758 -2.318 1.00 0.00 C ATOM 646 C LYS A 44 7.453 11.981 -2.396 1.00 0.00 C ATOM 647 O LYS A 44 6.976 12.795 -3.188 1.00 0.00 O ATOM 648 CB LYS A 44 9.383 10.702 -3.341 1.00 0.00 C ATOM 649 CG LYS A 44 8.397 9.555 -3.475 1.00 0.00 C ATOM 650 CD LYS A 44 8.758 8.398 -2.560 1.00 0.00 C ATOM 651 CE LYS A 44 9.684 7.408 -3.251 1.00 0.00 C ATOM 652 NZ LYS A 44 11.118 7.745 -3.033 1.00 0.00 N ATOM 0 H LYS A 44 9.088 10.396 -0.728 1.00 0.00 H new ATOM 0 HA LYS A 44 9.462 12.698 -2.547 1.00 0.00 H new ATOM 0 HB2 LYS A 44 9.506 11.179 -4.313 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.356 10.302 -3.056 1.00 0.00 H new ATOM 0 HG2 LYS A 44 7.393 9.908 -3.238 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.378 9.210 -4.509 1.00 0.00 H new ATOM 0 HD2 LYS A 44 9.239 8.781 -1.660 1.00 0.00 H new ATOM 0 HD3 LYS A 44 7.849 7.887 -2.242 1.00 0.00 H new ATOM 0 HE2 LYS A 44 9.486 6.404 -2.877 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.472 7.398 -4.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 11.702 6.900 -3.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.403 8.494 -3.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 11.252 8.077 -2.057 1.00 0.00 H new ATOM 666 N TYR A 45 6.708 11.255 -1.569 1.00 0.00 N ATOM 667 CA TYR A 45 5.255 11.373 -1.546 1.00 0.00 C ATOM 668 C TYR A 45 4.794 12.178 -0.335 1.00 0.00 C ATOM 669 O TYR A 45 3.640 12.085 0.084 1.00 0.00 O ATOM 670 CB TYR A 45 4.610 9.987 -1.527 1.00 0.00 C ATOM 671 CG TYR A 45 4.938 9.149 -2.742 1.00 0.00 C ATOM 672 CD1 TYR A 45 4.645 9.602 -4.022 1.00 0.00 C ATOM 673 CD2 TYR A 45 5.543 7.905 -2.610 1.00 0.00 C ATOM 674 CE1 TYR A 45 4.942 8.839 -5.135 1.00 0.00 C ATOM 675 CE2 TYR A 45 5.845 7.136 -3.717 1.00 0.00 C ATOM 676 CZ TYR A 45 5.543 7.608 -4.977 1.00 0.00 C ATOM 677 OH TYR A 45 5.842 6.846 -6.084 1.00 0.00 O ATOM 0 H TYR A 45 7.087 10.579 -0.906 1.00 0.00 H new ATOM 0 HA TYR A 45 4.944 11.898 -2.449 1.00 0.00 H new ATOM 0 HB2 TYR A 45 4.935 9.457 -0.632 1.00 0.00 H new ATOM 0 HB3 TYR A 45 3.528 10.100 -1.455 1.00 0.00 H new ATOM 0 HD1 TYR A 45 4.177 10.567 -4.149 1.00 0.00 H new ATOM 0 HD2 TYR A 45 5.781 7.533 -1.625 1.00 0.00 H new ATOM 0 HE1 TYR A 45 4.705 9.205 -6.123 1.00 0.00 H new ATOM 0 HE2 TYR A 45 6.315 6.171 -3.596 1.00 0.00 H new ATOM 0 HH TYR A 45 6.263 6.008 -5.800 1.00 0.00 H new ATOM 687 N HIS A 46 5.704 12.971 0.222 1.00 0.00 N ATOM 688 CA HIS A 46 5.391 13.794 1.385 1.00 0.00 C ATOM 689 C HIS A 46 4.448 14.933 1.007 1.00 0.00 C ATOM 690 O HIS A 46 4.570 15.545 -0.054 1.00 0.00 O ATOM 691 CB HIS A 46 6.674 14.360 1.995 1.00 0.00 C ATOM 692 CG HIS A 46 6.590 14.571 3.476 1.00 0.00 C ATOM 693 ND1 HIS A 46 6.229 15.774 4.046 1.00 0.00 N ATOM 694 CD2 HIS A 46 6.822 13.723 4.505 1.00 0.00 C ATOM 695 CE1 HIS A 46 6.244 15.657 5.361 1.00 0.00 C ATOM 696 NE2 HIS A 46 6.601 14.422 5.666 1.00 0.00 N ATOM 0 H HIS A 46 6.663 13.061 -0.113 1.00 0.00 H new ATOM 0 HA HIS A 46 4.894 13.164 2.122 1.00 0.00 H new ATOM 0 HB2 HIS A 46 7.499 13.682 1.779 1.00 0.00 H new ATOM 0 HB3 HIS A 46 6.907 15.310 1.513 1.00 0.00 H new ATOM 0 HD2 HIS A 46 7.125 12.689 4.427 1.00 0.00 H new ATOM 0 HE1 HIS A 46 6.005 16.438 6.067 1.00 0.00 H new ATOM 0 HE2 HIS A 46 6.697 14.049 6.610 1.00 0.00 H new ATOM 704 N PRO A 47 3.485 15.223 1.893 1.00 0.00 N ATOM 705 CA PRO A 47 2.503 16.289 1.674 1.00 0.00 C ATOM 706 C PRO A 47 3.127 17.678 1.750 1.00 0.00 C ATOM 707 O PRO A 47 2.492 18.675 1.407 1.00 0.00 O ATOM 708 CB PRO A 47 1.502 16.090 2.815 1.00 0.00 C ATOM 709 CG PRO A 47 2.280 15.406 3.886 1.00 0.00 C ATOM 710 CD PRO A 47 3.280 14.534 3.178 1.00 0.00 C ATOM 0 HA PRO A 47 2.056 16.232 0.681 1.00 0.00 H new ATOM 0 HB2 PRO A 47 1.103 17.043 3.163 1.00 0.00 H new ATOM 0 HB3 PRO A 47 0.652 15.486 2.496 1.00 0.00 H new ATOM 0 HG2 PRO A 47 2.780 16.131 4.529 1.00 0.00 H new ATOM 0 HG3 PRO A 47 1.626 14.811 4.524 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.209 14.450 3.741 1.00 0.00 H new ATOM 0 HD3 PRO A 47 2.901 13.522 3.035 1.00 0.00 H new ATOM 718 N ASP A 48 4.376 17.736 2.201 1.00 0.00 N ATOM 719 CA ASP A 48 5.087 19.003 2.321 1.00 0.00 C ATOM 720 C ASP A 48 6.138 19.142 1.224 1.00 0.00 C ATOM 721 O ASP A 48 6.824 20.160 1.131 1.00 0.00 O ATOM 722 CB ASP A 48 5.749 19.113 3.695 1.00 0.00 C ATOM 723 CG ASP A 48 6.395 20.466 3.920 1.00 0.00 C ATOM 724 OD1 ASP A 48 5.718 21.492 3.698 1.00 0.00 O ATOM 725 OD2 ASP A 48 7.578 20.499 4.319 1.00 0.00 O ATOM 0 H ASP A 48 4.916 16.920 2.489 1.00 0.00 H new ATOM 0 HA ASP A 48 4.362 19.810 2.210 1.00 0.00 H new ATOM 0 HB2 ASP A 48 5.003 18.937 4.470 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.503 18.332 3.795 1.00 0.00 H new ATOM 730 N LYS A 49 6.260 18.111 0.394 1.00 0.00 N ATOM 731 CA LYS A 49 7.227 18.117 -0.697 1.00 0.00 C ATOM 732 C LYS A 49 6.523 18.224 -2.046 1.00 0.00 C ATOM 733 O LYS A 49 7.122 18.642 -3.037 1.00 0.00 O ATOM 734 CB LYS A 49 8.081 16.848 -0.655 1.00 0.00 C ATOM 735 CG LYS A 49 8.733 16.598 0.694 1.00 0.00 C ATOM 736 CD LYS A 49 10.102 17.253 0.781 1.00 0.00 C ATOM 737 CE LYS A 49 11.139 16.486 -0.024 1.00 0.00 C ATOM 738 NZ LYS A 49 11.736 15.370 0.761 1.00 0.00 N ATOM 0 H LYS A 49 5.701 17.260 0.457 1.00 0.00 H new ATOM 0 HA LYS A 49 7.873 18.987 -0.573 1.00 0.00 H new ATOM 0 HB2 LYS A 49 7.457 15.992 -0.912 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.857 16.917 -1.417 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.092 16.985 1.486 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.831 15.525 0.859 1.00 0.00 H new ATOM 0 HD2 LYS A 49 10.040 18.278 0.414 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.416 17.306 1.824 1.00 0.00 H new ATOM 0 HE2 LYS A 49 10.676 16.088 -0.927 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.927 17.167 -0.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 12.773 15.419 0.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 11.442 15.449 1.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 11.410 14.461 0.375 1.00 0.00 H new ATOM 752 N ASN A 50 5.250 17.846 -2.076 1.00 0.00 N ATOM 753 CA ASN A 50 4.465 17.901 -3.304 1.00 0.00 C ATOM 754 C ASN A 50 3.805 19.267 -3.468 1.00 0.00 C ATOM 755 O ASN A 50 2.942 19.665 -2.685 1.00 0.00 O ATOM 756 CB ASN A 50 3.398 16.805 -3.302 1.00 0.00 C ATOM 757 CG ASN A 50 3.819 15.590 -2.498 1.00 0.00 C ATOM 758 OD1 ASN A 50 2.988 14.913 -1.893 1.00 0.00 O ATOM 759 ND2 ASN A 50 5.117 15.308 -2.488 1.00 0.00 N ATOM 0 H ASN A 50 4.740 17.498 -1.264 1.00 0.00 H new ATOM 0 HA ASN A 50 5.141 17.740 -4.144 1.00 0.00 H new ATOM 0 HB2 ASN A 50 2.471 17.205 -2.892 1.00 0.00 H new ATOM 0 HB3 ASN A 50 3.189 16.503 -4.328 1.00 0.00 H new ATOM 0 HD21 ASN A 50 5.460 14.503 -1.964 1.00 0.00 H new ATOM 0 HD22 ASN A 50 5.771 15.897 -3.004 1.00 0.00 H new ATOM 766 N PRO A 51 4.219 20.004 -4.510 1.00 0.00 N ATOM 767 CA PRO A 51 3.681 21.336 -4.801 1.00 0.00 C ATOM 768 C PRO A 51 2.236 21.284 -5.286 1.00 0.00 C ATOM 769 O PRO A 51 1.975 21.031 -6.462 1.00 0.00 O ATOM 770 CB PRO A 51 4.599 21.854 -5.911 1.00 0.00 C ATOM 771 CG PRO A 51 5.129 20.627 -6.569 1.00 0.00 C ATOM 772 CD PRO A 51 5.244 19.592 -5.484 1.00 0.00 C ATOM 0 HA PRO A 51 3.661 21.970 -3.915 1.00 0.00 H new ATOM 0 HB2 PRO A 51 4.052 22.477 -6.618 1.00 0.00 H new ATOM 0 HB3 PRO A 51 5.405 22.465 -5.505 1.00 0.00 H new ATOM 0 HG2 PRO A 51 4.461 20.289 -7.361 1.00 0.00 H new ATOM 0 HG3 PRO A 51 6.098 20.819 -7.030 1.00 0.00 H new ATOM 0 HD2 PRO A 51 5.056 18.588 -5.865 1.00 0.00 H new ATOM 0 HD3 PRO A 51 6.240 19.584 -5.040 1.00 0.00 H new ATOM 780 N ASP A 52 1.302 21.526 -4.374 1.00 0.00 N ATOM 781 CA ASP A 52 -0.117 21.509 -4.709 1.00 0.00 C ATOM 782 C ASP A 52 -0.454 20.304 -5.583 1.00 0.00 C ATOM 783 O ASP A 52 -1.417 20.331 -6.348 1.00 0.00 O ATOM 784 CB ASP A 52 -0.509 22.801 -5.427 1.00 0.00 C ATOM 785 CG ASP A 52 -0.453 24.010 -4.514 1.00 0.00 C ATOM 786 OD1 ASP A 52 0.369 24.007 -3.574 1.00 0.00 O ATOM 787 OD2 ASP A 52 -1.232 24.960 -4.740 1.00 0.00 O ATOM 0 H ASP A 52 1.502 21.736 -3.396 1.00 0.00 H new ATOM 0 HA ASP A 52 -0.684 21.432 -3.781 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.157 22.959 -6.275 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -1.517 22.699 -5.828 1.00 0.00 H new ATOM 792 N ASN A 53 0.346 19.250 -5.463 1.00 0.00 N ATOM 793 CA ASN A 53 0.134 18.037 -6.243 1.00 0.00 C ATOM 794 C ASN A 53 -0.956 17.171 -5.617 1.00 0.00 C ATOM 795 O ASN A 53 -0.839 16.707 -4.483 1.00 0.00 O ATOM 796 CB ASN A 53 1.435 17.239 -6.350 1.00 0.00 C ATOM 797 CG ASN A 53 1.480 16.368 -7.591 1.00 0.00 C ATOM 798 OD1 ASN A 53 0.830 16.664 -8.594 1.00 0.00 O ATOM 799 ND2 ASN A 53 2.249 15.288 -7.527 1.00 0.00 N ATOM 0 H ASN A 53 1.147 19.212 -4.833 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.188 18.330 -7.242 1.00 0.00 H new ATOM 0 HB2 ASN A 53 2.280 17.927 -6.362 1.00 0.00 H new ATOM 0 HB3 ASN A 53 1.547 16.612 -5.465 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.319 14.664 -8.330 1.00 0.00 H new ATOM 0 HD22 ASN A 53 2.770 15.083 -6.674 1.00 0.00 H new ATOM 806 N PRO A 54 -2.041 16.948 -6.373 1.00 0.00 N ATOM 807 CA PRO A 54 -3.172 16.136 -5.914 1.00 0.00 C ATOM 808 C PRO A 54 -2.819 14.656 -5.810 1.00 0.00 C ATOM 809 O PRO A 54 -3.054 14.024 -4.780 1.00 0.00 O ATOM 810 CB PRO A 54 -4.231 16.358 -6.997 1.00 0.00 C ATOM 811 CG PRO A 54 -3.455 16.715 -8.218 1.00 0.00 C ATOM 812 CD PRO A 54 -2.247 17.469 -7.735 1.00 0.00 C ATOM 0 HA PRO A 54 -3.499 16.421 -4.914 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.829 15.460 -7.156 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.921 17.155 -6.719 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -3.163 15.822 -8.770 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.052 17.326 -8.895 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -1.380 17.288 -8.370 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -2.420 18.545 -7.732 1.00 0.00 H new ATOM 820 N GLU A 55 -2.253 14.110 -6.881 1.00 0.00 N ATOM 821 CA GLU A 55 -1.868 12.704 -6.909 1.00 0.00 C ATOM 822 C GLU A 55 -1.033 12.345 -5.683 1.00 0.00 C ATOM 823 O GLU A 55 -1.344 11.397 -4.963 1.00 0.00 O ATOM 824 CB GLU A 55 -1.083 12.392 -8.184 1.00 0.00 C ATOM 825 CG GLU A 55 0.112 13.305 -8.402 1.00 0.00 C ATOM 826 CD GLU A 55 0.698 13.177 -9.795 1.00 0.00 C ATOM 827 OE1 GLU A 55 1.072 12.050 -10.181 1.00 0.00 O ATOM 828 OE2 GLU A 55 0.782 14.205 -10.499 1.00 0.00 O ATOM 0 H GLU A 55 -2.051 14.620 -7.741 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.778 12.104 -6.896 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -0.738 11.359 -8.144 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.752 12.472 -9.041 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -0.190 14.339 -8.232 1.00 0.00 H new ATOM 0 HG3 GLU A 55 0.881 13.072 -7.666 1.00 0.00 H new ATOM 835 N ALA A 56 0.030 13.109 -5.454 1.00 0.00 N ATOM 836 CA ALA A 56 0.910 12.873 -4.316 1.00 0.00 C ATOM 837 C ALA A 56 0.107 12.589 -3.051 1.00 0.00 C ATOM 838 O ALA A 56 0.432 11.679 -2.290 1.00 0.00 O ATOM 839 CB ALA A 56 1.829 14.066 -4.103 1.00 0.00 C ATOM 0 H ALA A 56 0.303 13.897 -6.042 1.00 0.00 H new ATOM 0 HA ALA A 56 1.518 11.995 -4.534 1.00 0.00 H new ATOM 0 HB1 ALA A 56 2.480 13.876 -3.250 1.00 0.00 H new ATOM 0 HB2 ALA A 56 2.436 14.222 -4.995 1.00 0.00 H new ATOM 0 HB3 ALA A 56 1.231 14.957 -3.911 1.00 0.00 H new ATOM 845 N ALA A 57 -0.942 13.376 -2.833 1.00 0.00 N ATOM 846 CA ALA A 57 -1.792 13.208 -1.661 1.00 0.00 C ATOM 847 C ALA A 57 -2.447 11.831 -1.650 1.00 0.00 C ATOM 848 O ALA A 57 -2.543 11.186 -0.606 1.00 0.00 O ATOM 849 CB ALA A 57 -2.852 14.299 -1.617 1.00 0.00 C ATOM 0 H ALA A 57 -1.223 14.136 -3.453 1.00 0.00 H new ATOM 0 HA ALA A 57 -1.165 13.290 -0.773 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -3.480 14.161 -0.737 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.368 15.275 -1.569 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -3.468 14.244 -2.514 1.00 0.00 H new ATOM 855 N ASP A 58 -2.897 11.386 -2.818 1.00 0.00 N ATOM 856 CA ASP A 58 -3.543 10.084 -2.944 1.00 0.00 C ATOM 857 C ASP A 58 -2.565 8.959 -2.622 1.00 0.00 C ATOM 858 O ASP A 58 -2.964 7.883 -2.176 1.00 0.00 O ATOM 859 CB ASP A 58 -4.103 9.903 -4.355 1.00 0.00 C ATOM 860 CG ASP A 58 -5.230 8.890 -4.405 1.00 0.00 C ATOM 861 OD1 ASP A 58 -6.398 9.292 -4.225 1.00 0.00 O ATOM 862 OD2 ASP A 58 -4.943 7.695 -4.626 1.00 0.00 O ATOM 0 H ASP A 58 -2.826 11.908 -3.692 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.364 10.042 -2.228 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.464 10.862 -4.725 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -3.302 9.585 -5.023 1.00 0.00 H new ATOM 867 N LYS A 59 -1.281 9.213 -2.854 1.00 0.00 N ATOM 868 CA LYS A 59 -0.244 8.223 -2.589 1.00 0.00 C ATOM 869 C LYS A 59 0.027 8.106 -1.093 1.00 0.00 C ATOM 870 O LYS A 59 -0.212 7.060 -0.488 1.00 0.00 O ATOM 871 CB LYS A 59 1.045 8.595 -3.325 1.00 0.00 C ATOM 872 CG LYS A 59 1.043 8.203 -4.792 1.00 0.00 C ATOM 873 CD LYS A 59 1.140 6.696 -4.967 1.00 0.00 C ATOM 874 CE LYS A 59 2.578 6.214 -4.851 1.00 0.00 C ATOM 875 NZ LYS A 59 2.936 5.867 -3.448 1.00 0.00 N ATOM 0 H LYS A 59 -0.934 10.097 -3.225 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.597 7.258 -2.952 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.201 9.671 -3.245 1.00 0.00 H new ATOM 0 HB3 LYS A 59 1.888 8.113 -2.830 1.00 0.00 H new ATOM 0 HG2 LYS A 59 0.131 8.567 -5.266 1.00 0.00 H new ATOM 0 HG3 LYS A 59 1.880 8.684 -5.299 1.00 0.00 H new ATOM 0 HD2 LYS A 59 0.527 6.201 -4.214 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.738 6.415 -5.940 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.721 5.341 -5.488 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.251 6.989 -5.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 3.819 6.350 -3.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 2.173 6.170 -2.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.067 4.838 -3.367 1.00 0.00 H new ATOM 889 N PHE A 60 0.527 9.186 -0.501 1.00 0.00 N ATOM 890 CA PHE A 60 0.831 9.204 0.925 1.00 0.00 C ATOM 891 C PHE A 60 -0.230 8.444 1.717 1.00 0.00 C ATOM 892 O PHE A 60 0.074 7.473 2.410 1.00 0.00 O ATOM 893 CB PHE A 60 0.924 10.645 1.430 1.00 0.00 C ATOM 894 CG PHE A 60 1.346 10.751 2.868 1.00 0.00 C ATOM 895 CD1 PHE A 60 2.602 10.326 3.269 1.00 0.00 C ATOM 896 CD2 PHE A 60 0.485 11.276 3.819 1.00 0.00 C ATOM 897 CE1 PHE A 60 2.992 10.421 4.591 1.00 0.00 C ATOM 898 CE2 PHE A 60 0.870 11.374 5.143 1.00 0.00 C ATOM 899 CZ PHE A 60 2.125 10.947 5.529 1.00 0.00 C ATOM 0 H PHE A 60 0.730 10.060 -0.987 1.00 0.00 H new ATOM 0 HA PHE A 60 1.792 8.711 1.072 1.00 0.00 H new ATOM 0 HB2 PHE A 60 1.633 11.194 0.810 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -0.046 11.128 1.308 1.00 0.00 H new ATOM 0 HD1 PHE A 60 3.284 9.916 2.540 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -0.498 11.612 3.522 1.00 0.00 H new ATOM 0 HE1 PHE A 60 3.973 10.084 4.891 1.00 0.00 H new ATOM 0 HE2 PHE A 60 0.190 11.784 5.875 1.00 0.00 H new ATOM 0 HZ PHE A 60 2.428 11.024 6.563 1.00 0.00 H new ATOM 909 N LYS A 61 -1.475 8.894 1.609 1.00 0.00 N ATOM 910 CA LYS A 61 -2.582 8.258 2.313 1.00 0.00 C ATOM 911 C LYS A 61 -2.551 6.745 2.123 1.00 0.00 C ATOM 912 O LYS A 61 -2.888 5.989 3.033 1.00 0.00 O ATOM 913 CB LYS A 61 -3.918 8.817 1.817 1.00 0.00 C ATOM 914 CG LYS A 61 -4.334 8.282 0.458 1.00 0.00 C ATOM 915 CD LYS A 61 -5.798 8.570 0.170 1.00 0.00 C ATOM 916 CE LYS A 61 -6.409 7.503 -0.726 1.00 0.00 C ATOM 917 NZ LYS A 61 -6.995 6.385 0.064 1.00 0.00 N ATOM 0 H LYS A 61 -1.743 9.697 1.040 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.476 8.475 3.376 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -4.694 8.580 2.545 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -3.851 9.904 1.765 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.714 8.733 -0.317 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.159 7.207 0.420 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -6.352 8.620 1.108 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -5.891 9.545 -0.308 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -7.182 7.952 -1.350 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -5.645 7.112 -1.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -6.406 5.535 -0.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -7.031 6.652 1.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -7.957 6.186 -0.276 1.00 0.00 H new ATOM 931 N GLU A 62 -2.143 6.311 0.935 1.00 0.00 N ATOM 932 CA GLU A 62 -2.067 4.887 0.627 1.00 0.00 C ATOM 933 C GLU A 62 -0.842 4.254 1.280 1.00 0.00 C ATOM 934 O GLU A 62 -0.938 3.204 1.916 1.00 0.00 O ATOM 935 CB GLU A 62 -2.020 4.672 -0.887 1.00 0.00 C ATOM 936 CG GLU A 62 -3.391 4.511 -1.522 1.00 0.00 C ATOM 937 CD GLU A 62 -4.240 3.469 -0.821 1.00 0.00 C ATOM 938 OE1 GLU A 62 -3.842 2.285 -0.815 1.00 0.00 O ATOM 939 OE2 GLU A 62 -5.302 3.837 -0.278 1.00 0.00 O ATOM 0 H GLU A 62 -1.860 6.924 0.170 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.960 4.407 1.027 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.512 5.518 -1.350 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -1.423 3.785 -1.101 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.910 5.469 -1.504 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.272 4.233 -2.569 1.00 0.00 H new ATOM 946 N ILE A 63 0.308 4.899 1.117 1.00 0.00 N ATOM 947 CA ILE A 63 1.552 4.400 1.691 1.00 0.00 C ATOM 948 C ILE A 63 1.377 4.054 3.166 1.00 0.00 C ATOM 949 O ILE A 63 1.676 2.940 3.592 1.00 0.00 O ATOM 950 CB ILE A 63 2.690 5.427 1.548 1.00 0.00 C ATOM 951 CG1 ILE A 63 2.770 5.935 0.107 1.00 0.00 C ATOM 952 CG2 ILE A 63 4.015 4.811 1.972 1.00 0.00 C ATOM 953 CD1 ILE A 63 3.985 6.794 -0.165 1.00 0.00 C ATOM 0 H ILE A 63 0.404 5.768 0.592 1.00 0.00 H new ATOM 0 HA ILE A 63 1.815 3.499 1.137 1.00 0.00 H new ATOM 0 HB ILE A 63 2.479 6.274 2.201 1.00 0.00 H new ATOM 0 HG12 ILE A 63 2.780 5.081 -0.571 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.871 6.510 -0.117 1.00 0.00 H new ATOM 0 HG21 ILE A 63 4.810 5.549 1.865 1.00 0.00 H new ATOM 0 HG22 ILE A 63 3.952 4.493 3.013 1.00 0.00 H new ATOM 0 HG23 ILE A 63 4.234 3.949 1.342 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.976 7.118 -1.206 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.967 7.667 0.487 1.00 0.00 H new ATOM 0 HD13 ILE A 63 4.889 6.216 0.027 1.00 0.00 H new ATOM 965 N ASN A 64 0.888 5.017 3.940 1.00 0.00 N ATOM 966 CA ASN A 64 0.671 4.815 5.368 1.00 0.00 C ATOM 967 C ASN A 64 -0.230 3.609 5.615 1.00 0.00 C ATOM 968 O ASN A 64 0.064 2.765 6.461 1.00 0.00 O ATOM 969 CB ASN A 64 0.051 6.066 5.993 1.00 0.00 C ATOM 970 CG ASN A 64 -1.465 6.035 5.966 1.00 0.00 C ATOM 971 OD1 ASN A 64 -2.089 5.150 6.552 1.00 0.00 O ATOM 972 ND2 ASN A 64 -2.064 7.004 5.284 1.00 0.00 N ATOM 0 H ASN A 64 0.634 5.945 3.602 1.00 0.00 H new ATOM 0 HA ASN A 64 1.638 4.626 5.834 1.00 0.00 H new ATOM 0 HB2 ASN A 64 0.391 6.161 7.024 1.00 0.00 H new ATOM 0 HB3 ASN A 64 0.403 6.948 5.459 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.082 7.036 5.230 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.506 7.717 4.814 1.00 0.00 H new ATOM 979 N ASN A 65 -1.328 3.535 4.871 1.00 0.00 N ATOM 980 CA ASN A 65 -2.273 2.432 5.009 1.00 0.00 C ATOM 981 C ASN A 65 -1.605 1.100 4.683 1.00 0.00 C ATOM 982 O ASN A 65 -1.432 0.250 5.556 1.00 0.00 O ATOM 983 CB ASN A 65 -3.479 2.649 4.094 1.00 0.00 C ATOM 984 CG ASN A 65 -4.505 1.538 4.217 1.00 0.00 C ATOM 985 OD1 ASN A 65 -5.161 1.396 5.248 1.00 0.00 O ATOM 986 ND2 ASN A 65 -4.647 0.745 3.161 1.00 0.00 N ATOM 0 H ASN A 65 -1.586 4.226 4.166 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.612 2.404 6.044 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.949 3.602 4.336 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.140 2.714 3.060 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.322 -0.019 3.184 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.081 0.900 2.327 1.00 0.00 H new ATOM 993 N ALA A 66 -1.231 0.925 3.420 1.00 0.00 N ATOM 994 CA ALA A 66 -0.580 -0.302 2.978 1.00 0.00 C ATOM 995 C ALA A 66 0.487 -0.745 3.973 1.00 0.00 C ATOM 996 O ALA A 66 0.515 -1.902 4.395 1.00 0.00 O ATOM 997 CB ALA A 66 0.030 -0.108 1.598 1.00 0.00 C ATOM 0 H ALA A 66 -1.368 1.618 2.684 1.00 0.00 H new ATOM 0 HA ALA A 66 -1.335 -1.086 2.922 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.513 -1.032 1.280 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.754 0.155 0.887 1.00 0.00 H new ATOM 0 HB3 ALA A 66 0.769 0.693 1.636 1.00 0.00 H new ATOM 1003 N HIS A 67 1.366 0.181 4.343 1.00 0.00 N ATOM 1004 CA HIS A 67 2.436 -0.116 5.289 1.00 0.00 C ATOM 1005 C HIS A 67 1.868 -0.627 6.610 1.00 0.00 C ATOM 1006 O HIS A 67 2.366 -1.600 7.175 1.00 0.00 O ATOM 1007 CB HIS A 67 3.287 1.130 5.535 1.00 0.00 C ATOM 1008 CG HIS A 67 4.116 1.053 6.780 1.00 0.00 C ATOM 1009 ND1 HIS A 67 3.616 1.327 8.035 1.00 0.00 N ATOM 1010 CD2 HIS A 67 5.418 0.728 6.958 1.00 0.00 C ATOM 1011 CE1 HIS A 67 4.575 1.176 8.932 1.00 0.00 C ATOM 1012 NE2 HIS A 67 5.678 0.813 8.304 1.00 0.00 N ATOM 0 H HIS A 67 1.359 1.142 4.003 1.00 0.00 H new ATOM 0 HA HIS A 67 3.063 -0.896 4.857 1.00 0.00 H new ATOM 0 HB2 HIS A 67 3.944 1.286 4.680 1.00 0.00 H new ATOM 0 HB3 HIS A 67 2.633 2.000 5.597 1.00 0.00 H new ATOM 0 HD2 HIS A 67 6.121 0.453 6.186 1.00 0.00 H new ATOM 0 HE1 HIS A 67 4.474 1.324 9.997 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.578 0.626 8.747 1.00 0.00 H new ATOM 1020 N ALA A 68 0.823 0.036 7.095 1.00 0.00 N ATOM 1021 CA ALA A 68 0.187 -0.352 8.348 1.00 0.00 C ATOM 1022 C ALA A 68 -0.363 -1.772 8.267 1.00 0.00 C ATOM 1023 O ALA A 68 -0.079 -2.607 9.127 1.00 0.00 O ATOM 1024 CB ALA A 68 -0.922 0.627 8.702 1.00 0.00 C ATOM 0 H ALA A 68 0.399 0.844 6.639 1.00 0.00 H new ATOM 0 HA ALA A 68 0.942 -0.327 9.134 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.388 0.325 9.640 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -0.503 1.627 8.811 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.670 0.631 7.910 1.00 0.00 H new ATOM 1030 N ILE A 69 -1.150 -2.038 7.231 1.00 0.00 N ATOM 1031 CA ILE A 69 -1.740 -3.358 7.039 1.00 0.00 C ATOM 1032 C ILE A 69 -0.662 -4.432 6.939 1.00 0.00 C ATOM 1033 O ILE A 69 -0.870 -5.576 7.344 1.00 0.00 O ATOM 1034 CB ILE A 69 -2.615 -3.405 5.773 1.00 0.00 C ATOM 1035 CG1 ILE A 69 -3.787 -2.429 5.901 1.00 0.00 C ATOM 1036 CG2 ILE A 69 -3.121 -4.819 5.531 1.00 0.00 C ATOM 1037 CD1 ILE A 69 -4.436 -2.087 4.577 1.00 0.00 C ATOM 0 H ILE A 69 -1.394 -1.358 6.511 1.00 0.00 H new ATOM 0 HA ILE A 69 -2.365 -3.554 7.910 1.00 0.00 H new ATOM 0 HB ILE A 69 -2.008 -3.106 4.918 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -4.537 -2.860 6.564 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -3.435 -1.511 6.372 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -3.738 -4.836 4.633 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.273 -5.492 5.402 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.715 -5.144 6.385 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.258 -1.391 4.744 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -3.699 -1.627 3.919 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -4.819 -2.996 4.114 1.00 0.00 H new ATOM 1049 N LEU A 70 0.491 -4.055 6.397 1.00 0.00 N ATOM 1050 CA LEU A 70 1.605 -4.986 6.245 1.00 0.00 C ATOM 1051 C LEU A 70 2.316 -5.207 7.576 1.00 0.00 C ATOM 1052 O LEU A 70 2.351 -6.323 8.096 1.00 0.00 O ATOM 1053 CB LEU A 70 2.596 -4.460 5.205 1.00 0.00 C ATOM 1054 CG LEU A 70 2.171 -4.596 3.743 1.00 0.00 C ATOM 1055 CD1 LEU A 70 3.218 -3.988 2.823 1.00 0.00 C ATOM 1056 CD2 LEU A 70 1.934 -6.058 3.391 1.00 0.00 C ATOM 0 H LEU A 70 0.679 -3.112 6.056 1.00 0.00 H new ATOM 0 HA LEU A 70 1.204 -5.941 5.906 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.783 -3.406 5.411 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.543 -4.984 5.337 1.00 0.00 H new ATOM 0 HG LEU A 70 1.236 -4.052 3.604 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.898 -4.095 1.787 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.339 -2.931 3.058 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.169 -4.502 2.964 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.632 -6.136 2.347 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.853 -6.623 3.547 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.147 -6.463 4.027 1.00 0.00 H new ATOM 1068 N THR A 71 2.881 -4.136 8.125 1.00 0.00 N ATOM 1069 CA THR A 71 3.590 -4.212 9.396 1.00 0.00 C ATOM 1070 C THR A 71 2.827 -5.068 10.400 1.00 0.00 C ATOM 1071 O THR A 71 3.427 -5.755 11.227 1.00 0.00 O ATOM 1072 CB THR A 71 3.816 -2.813 9.998 1.00 0.00 C ATOM 1073 OG1 THR A 71 2.590 -2.073 9.994 1.00 0.00 O ATOM 1074 CG2 THR A 71 4.876 -2.052 9.215 1.00 0.00 C ATOM 0 H THR A 71 2.861 -3.205 7.709 1.00 0.00 H new ATOM 0 HA THR A 71 4.557 -4.671 9.192 1.00 0.00 H new ATOM 0 HB THR A 71 4.162 -2.935 11.024 1.00 0.00 H new ATOM 0 HG1 THR A 71 2.345 -1.851 9.071 1.00 0.00 H new ATOM 0 HG21 THR A 71 5.019 -1.067 9.659 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.816 -2.603 9.245 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.554 -1.941 8.180 1.00 0.00 H new ATOM 1082 N ASP A 72 1.501 -5.023 10.323 1.00 0.00 N ATOM 1083 CA ASP A 72 0.656 -5.796 11.225 1.00 0.00 C ATOM 1084 C ASP A 72 0.621 -7.264 10.813 1.00 0.00 C ATOM 1085 O ASP A 72 0.709 -7.589 9.630 1.00 0.00 O ATOM 1086 CB ASP A 72 -0.763 -5.225 11.243 1.00 0.00 C ATOM 1087 CG ASP A 72 -1.554 -5.677 12.455 1.00 0.00 C ATOM 1088 OD1 ASP A 72 -1.279 -5.174 13.564 1.00 0.00 O ATOM 1089 OD2 ASP A 72 -2.447 -6.536 12.294 1.00 0.00 O ATOM 0 H ASP A 72 0.989 -4.459 9.645 1.00 0.00 H new ATOM 0 HA ASP A 72 1.080 -5.729 12.227 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.713 -4.136 11.231 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -1.286 -5.531 10.337 1.00 0.00 H new ATOM 1094 N ALA A 73 0.494 -8.147 11.798 1.00 0.00 N ATOM 1095 CA ALA A 73 0.447 -9.580 11.538 1.00 0.00 C ATOM 1096 C ALA A 73 -0.983 -10.046 11.285 1.00 0.00 C ATOM 1097 O ALA A 73 -1.261 -10.720 10.292 1.00 0.00 O ATOM 1098 CB ALA A 73 1.056 -10.348 12.702 1.00 0.00 C ATOM 0 H ALA A 73 0.422 -7.895 12.784 1.00 0.00 H new ATOM 0 HA ALA A 73 1.031 -9.780 10.640 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.014 -11.417 12.494 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.094 -10.044 12.835 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.496 -10.133 13.612 1.00 0.00 H new ATOM 1104 N THR A 74 -1.888 -9.682 12.188 1.00 0.00 N ATOM 1105 CA THR A 74 -3.289 -10.064 12.063 1.00 0.00 C ATOM 1106 C THR A 74 -3.800 -9.822 10.648 1.00 0.00 C ATOM 1107 O THR A 74 -4.392 -10.708 10.030 1.00 0.00 O ATOM 1108 CB THR A 74 -4.173 -9.287 13.056 1.00 0.00 C ATOM 1109 OG1 THR A 74 -3.654 -9.421 14.384 1.00 0.00 O ATOM 1110 CG2 THR A 74 -5.607 -9.794 13.014 1.00 0.00 C ATOM 0 H THR A 74 -1.676 -9.123 13.014 1.00 0.00 H new ATOM 0 HA THR A 74 -3.349 -11.128 12.291 1.00 0.00 H new ATOM 0 HB THR A 74 -4.166 -8.236 12.768 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.221 -8.922 15.009 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.213 -9.231 13.724 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.010 -9.664 12.009 1.00 0.00 H new ATOM 0 HG23 THR A 74 -5.627 -10.851 13.279 1.00 0.00 H new ATOM 1118 N LYS A 75 -3.569 -8.617 10.138 1.00 0.00 N ATOM 1119 CA LYS A 75 -4.004 -8.258 8.793 1.00 0.00 C ATOM 1120 C LYS A 75 -3.230 -9.047 7.742 1.00 0.00 C ATOM 1121 O LYS A 75 -3.822 -9.711 6.891 1.00 0.00 O ATOM 1122 CB LYS A 75 -3.819 -6.757 8.559 1.00 0.00 C ATOM 1123 CG LYS A 75 -4.461 -5.891 9.628 1.00 0.00 C ATOM 1124 CD LYS A 75 -4.905 -4.550 9.068 1.00 0.00 C ATOM 1125 CE LYS A 75 -6.309 -4.626 8.488 1.00 0.00 C ATOM 1126 NZ LYS A 75 -6.897 -3.274 8.278 1.00 0.00 N ATOM 0 H LYS A 75 -3.083 -7.872 10.636 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.061 -8.506 8.701 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.753 -6.534 8.514 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.241 -6.494 7.589 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -5.320 -6.412 10.052 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.753 -5.730 10.441 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.876 -3.798 9.856 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.207 -4.228 8.295 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.281 -5.161 7.539 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -6.948 -5.200 9.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -7.933 -3.350 8.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.632 -2.653 9.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -6.537 -2.873 7.388 1.00 0.00 H new ATOM 1140 N ARG A 76 -1.905 -8.971 7.808 1.00 0.00 N ATOM 1141 CA ARG A 76 -1.051 -9.678 6.862 1.00 0.00 C ATOM 1142 C ARG A 76 -1.671 -11.014 6.463 1.00 0.00 C ATOM 1143 O ARG A 76 -1.751 -11.344 5.280 1.00 0.00 O ATOM 1144 CB ARG A 76 0.335 -9.908 7.466 1.00 0.00 C ATOM 1145 CG ARG A 76 1.319 -8.786 7.178 1.00 0.00 C ATOM 1146 CD ARG A 76 1.697 -8.741 5.705 1.00 0.00 C ATOM 1147 NE ARG A 76 2.819 -9.625 5.402 1.00 0.00 N ATOM 1148 CZ ARG A 76 2.679 -10.901 5.062 1.00 0.00 C ATOM 1149 NH1 ARG A 76 1.470 -11.440 4.982 1.00 0.00 N ATOM 1150 NH2 ARG A 76 3.748 -11.641 4.800 1.00 0.00 N ATOM 0 H ARG A 76 -1.400 -8.427 8.507 1.00 0.00 H new ATOM 0 HA ARG A 76 -0.953 -9.061 5.969 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.237 -10.025 8.545 1.00 0.00 H new ATOM 0 HB3 ARG A 76 0.740 -10.843 7.079 1.00 0.00 H new ATOM 0 HG2 ARG A 76 0.881 -7.832 7.472 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.216 -8.924 7.781 1.00 0.00 H new ATOM 0 HD2 ARG A 76 0.836 -9.027 5.101 1.00 0.00 H new ATOM 0 HD3 ARG A 76 1.955 -7.719 5.428 1.00 0.00 H new ATOM 0 HE ARG A 76 3.763 -9.241 5.454 1.00 0.00 H new ATOM 0 HH11 ARG A 76 0.645 -10.874 5.182 1.00 0.00 H new ATOM 0 HH12 ARG A 76 1.365 -12.420 4.721 1.00 0.00 H new ATOM 0 HH21 ARG A 76 4.680 -11.230 4.860 1.00 0.00 H new ATOM 0 HH22 ARG A 76 3.638 -12.621 4.539 1.00 0.00 H new ATOM 1164 N ASN A 77 -2.108 -11.779 7.458 1.00 0.00 N ATOM 1165 CA ASN A 77 -2.720 -13.079 7.212 1.00 0.00 C ATOM 1166 C ASN A 77 -3.989 -12.934 6.377 1.00 0.00 C ATOM 1167 O ASN A 77 -4.119 -13.545 5.316 1.00 0.00 O ATOM 1168 CB ASN A 77 -3.044 -13.773 8.536 1.00 0.00 C ATOM 1169 CG ASN A 77 -3.321 -15.254 8.360 1.00 0.00 C ATOM 1170 OD1 ASN A 77 -2.455 -16.011 7.922 1.00 0.00 O ATOM 1171 ND2 ASN A 77 -4.534 -15.674 8.703 1.00 0.00 N ATOM 0 H ASN A 77 -2.049 -11.521 8.443 1.00 0.00 H new ATOM 0 HA ASN A 77 -2.008 -13.688 6.655 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -2.210 -13.642 9.226 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -3.912 -13.295 8.991 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -4.778 -16.660 8.607 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -5.221 -15.011 9.062 1.00 0.00 H new ATOM 1178 N ILE A 78 -4.920 -12.121 6.863 1.00 0.00 N ATOM 1179 CA ILE A 78 -6.177 -11.894 6.161 1.00 0.00 C ATOM 1180 C ILE A 78 -5.931 -11.436 4.727 1.00 0.00 C ATOM 1181 O ILE A 78 -6.723 -11.723 3.828 1.00 0.00 O ATOM 1182 CB ILE A 78 -7.043 -10.844 6.881 1.00 0.00 C ATOM 1183 CG1 ILE A 78 -7.376 -11.312 8.299 1.00 0.00 C ATOM 1184 CG2 ILE A 78 -8.316 -10.576 6.093 1.00 0.00 C ATOM 1185 CD1 ILE A 78 -7.877 -10.204 9.200 1.00 0.00 C ATOM 0 H ILE A 78 -4.828 -11.608 7.740 1.00 0.00 H new ATOM 0 HA ILE A 78 -6.708 -12.846 6.150 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.479 -9.914 6.948 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.132 -12.096 8.246 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.486 -11.757 8.744 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -8.917 -9.832 6.615 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -8.059 -10.204 5.101 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -8.886 -11.500 5.997 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -8.093 -10.609 10.189 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -7.114 -9.430 9.284 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -8.785 -9.774 8.778 1.00 0.00 H new ATOM 1197 N TYR A 79 -4.829 -10.725 4.520 1.00 0.00 N ATOM 1198 CA TYR A 79 -4.478 -10.227 3.195 1.00 0.00 C ATOM 1199 C TYR A 79 -3.836 -11.325 2.353 1.00 0.00 C ATOM 1200 O TYR A 79 -4.008 -11.369 1.135 1.00 0.00 O ATOM 1201 CB TYR A 79 -3.526 -9.035 3.311 1.00 0.00 C ATOM 1202 CG TYR A 79 -3.318 -8.297 2.007 1.00 0.00 C ATOM 1203 CD1 TYR A 79 -4.318 -7.493 1.475 1.00 0.00 C ATOM 1204 CD2 TYR A 79 -2.123 -8.405 1.308 1.00 0.00 C ATOM 1205 CE1 TYR A 79 -4.133 -6.817 0.284 1.00 0.00 C ATOM 1206 CE2 TYR A 79 -1.928 -7.733 0.118 1.00 0.00 C ATOM 1207 CZ TYR A 79 -2.936 -6.940 -0.391 1.00 0.00 C ATOM 1208 OH TYR A 79 -2.747 -6.270 -1.577 1.00 0.00 O ATOM 0 H TYR A 79 -4.163 -10.480 5.253 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.395 -9.905 2.701 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -3.917 -8.340 4.054 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -2.561 -9.385 3.678 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.256 -7.395 2.001 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.332 -9.026 1.702 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -4.921 -6.196 -0.116 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -0.992 -7.827 -0.412 1.00 0.00 H new ATOM 0 HH TYR A 79 -2.784 -6.906 -2.322 1.00 0.00 H new ATOM 1218 N ASP A 80 -3.095 -12.209 3.011 1.00 0.00 N ATOM 1219 CA ASP A 80 -2.427 -13.309 2.325 1.00 0.00 C ATOM 1220 C ASP A 80 -3.436 -14.361 1.874 1.00 0.00 C ATOM 1221 O ASP A 80 -3.341 -14.895 0.769 1.00 0.00 O ATOM 1222 CB ASP A 80 -1.380 -13.948 3.238 1.00 0.00 C ATOM 1223 CG ASP A 80 -0.655 -15.100 2.571 1.00 0.00 C ATOM 1224 OD1 ASP A 80 0.164 -14.840 1.666 1.00 0.00 O ATOM 1225 OD2 ASP A 80 -0.908 -16.262 2.954 1.00 0.00 O ATOM 0 H ASP A 80 -2.941 -12.186 4.019 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.930 -12.905 1.443 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.655 -13.192 3.539 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.864 -14.305 4.147 1.00 0.00 H new ATOM 1230 N LYS A 81 -4.403 -14.654 2.737 1.00 0.00 N ATOM 1231 CA LYS A 81 -5.431 -15.642 2.429 1.00 0.00 C ATOM 1232 C LYS A 81 -6.470 -15.065 1.473 1.00 0.00 C ATOM 1233 O LYS A 81 -6.729 -15.627 0.409 1.00 0.00 O ATOM 1234 CB LYS A 81 -6.112 -16.117 3.714 1.00 0.00 C ATOM 1235 CG LYS A 81 -6.685 -17.520 3.615 1.00 0.00 C ATOM 1236 CD LYS A 81 -7.768 -17.755 4.655 1.00 0.00 C ATOM 1237 CE LYS A 81 -7.180 -18.240 5.972 1.00 0.00 C ATOM 1238 NZ LYS A 81 -6.432 -17.162 6.676 1.00 0.00 N ATOM 0 H LYS A 81 -4.497 -14.221 3.656 1.00 0.00 H new ATOM 0 HA LYS A 81 -4.950 -16.492 1.945 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.391 -16.085 4.531 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -6.913 -15.423 3.969 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.097 -17.676 2.618 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -5.887 -18.250 3.748 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.321 -16.831 4.821 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.480 -18.490 4.281 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.981 -18.605 6.615 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.513 -19.081 5.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.514 -17.297 7.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.430 -17.198 6.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -6.829 -16.237 6.415 1.00 0.00 H new ATOM 1252 N TYR A 82 -7.062 -13.940 1.859 1.00 0.00 N ATOM 1253 CA TYR A 82 -8.074 -13.287 1.037 1.00 0.00 C ATOM 1254 C TYR A 82 -7.461 -12.163 0.208 1.00 0.00 C ATOM 1255 O TYR A 82 -7.348 -12.266 -1.012 1.00 0.00 O ATOM 1256 CB TYR A 82 -9.197 -12.734 1.916 1.00 0.00 C ATOM 1257 CG TYR A 82 -9.674 -13.706 2.972 1.00 0.00 C ATOM 1258 CD1 TYR A 82 -9.730 -15.070 2.713 1.00 0.00 C ATOM 1259 CD2 TYR A 82 -10.068 -13.261 4.227 1.00 0.00 C ATOM 1260 CE1 TYR A 82 -10.166 -15.962 3.674 1.00 0.00 C ATOM 1261 CE2 TYR A 82 -10.504 -14.145 5.195 1.00 0.00 C ATOM 1262 CZ TYR A 82 -10.551 -15.495 4.914 1.00 0.00 C ATOM 1263 OH TYR A 82 -10.986 -16.379 5.874 1.00 0.00 O ATOM 0 H TYR A 82 -6.858 -13.461 2.736 1.00 0.00 H new ATOM 0 HA TYR A 82 -8.488 -14.031 0.357 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -8.850 -11.823 2.403 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -10.040 -12.456 1.283 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -9.428 -15.439 1.744 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -10.033 -12.205 4.450 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -10.205 -17.019 3.456 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -10.806 -13.781 6.166 1.00 0.00 H new ATOM 0 HH TYR A 82 -11.218 -15.888 6.690 1.00 0.00 H new ATOM 1273 N GLY A 83 -7.065 -11.087 0.883 1.00 0.00 N ATOM 1274 CA GLY A 83 -6.468 -9.958 0.195 1.00 0.00 C ATOM 1275 C GLY A 83 -7.264 -8.681 0.375 1.00 0.00 C ATOM 1276 O GLY A 83 -7.551 -8.275 1.501 1.00 0.00 O ATOM 0 H GLY A 83 -7.147 -10.978 1.894 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.454 -9.806 0.566 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -6.388 -10.186 -0.868 1.00 0.00 H new ATOM 1280 N SER A 84 -7.622 -8.046 -0.737 1.00 0.00 N ATOM 1281 CA SER A 84 -8.385 -6.805 -0.696 1.00 0.00 C ATOM 1282 C SER A 84 -9.754 -7.030 -0.060 1.00 0.00 C ATOM 1283 O SER A 84 -10.192 -6.253 0.790 1.00 0.00 O ATOM 1284 CB SER A 84 -8.553 -6.238 -2.107 1.00 0.00 C ATOM 1285 OG SER A 84 -9.190 -7.173 -2.960 1.00 0.00 O ATOM 0 H SER A 84 -7.396 -8.371 -1.677 1.00 0.00 H new ATOM 0 HA SER A 84 -7.834 -6.088 -0.087 1.00 0.00 H new ATOM 0 HB2 SER A 84 -9.139 -5.320 -2.066 1.00 0.00 H new ATOM 0 HB3 SER A 84 -7.577 -5.975 -2.515 1.00 0.00 H new ATOM 0 HG SER A 84 -9.287 -6.786 -3.855 1.00 0.00 H new ATOM 1291 N LEU A 85 -10.425 -8.097 -0.479 1.00 0.00 N ATOM 1292 CA LEU A 85 -11.745 -8.426 0.049 1.00 0.00 C ATOM 1293 C LEU A 85 -11.686 -8.666 1.554 1.00 0.00 C ATOM 1294 O LEU A 85 -12.470 -8.100 2.315 1.00 0.00 O ATOM 1295 CB LEU A 85 -12.303 -9.664 -0.655 1.00 0.00 C ATOM 1296 CG LEU A 85 -13.813 -9.879 -0.538 1.00 0.00 C ATOM 1297 CD1 LEU A 85 -14.567 -8.778 -1.267 1.00 0.00 C ATOM 1298 CD2 LEU A 85 -14.200 -11.245 -1.084 1.00 0.00 C ATOM 0 H LEU A 85 -10.077 -8.749 -1.182 1.00 0.00 H new ATOM 0 HA LEU A 85 -12.406 -7.580 -0.139 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -12.046 -9.603 -1.712 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.799 -10.543 -0.254 1.00 0.00 H new ATOM 0 HG LEU A 85 -14.086 -9.841 0.517 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -15.640 -8.948 -1.173 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -14.313 -7.812 -0.830 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -14.290 -8.784 -2.321 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -15.278 -11.381 -0.993 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.913 -11.312 -2.133 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.687 -12.022 -0.517 1.00 0.00 H new ATOM 1310 N GLY A 86 -10.748 -9.508 1.977 1.00 0.00 N ATOM 1311 CA GLY A 86 -10.601 -9.806 3.390 1.00 0.00 C ATOM 1312 C GLY A 86 -10.559 -8.556 4.245 1.00 0.00 C ATOM 1313 O GLY A 86 -11.322 -8.424 5.203 1.00 0.00 O ATOM 0 H GLY A 86 -10.087 -9.989 1.367 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.430 -10.436 3.713 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -9.686 -10.379 3.544 1.00 0.00 H new ATOM 1317 N LEU A 87 -9.665 -7.636 3.902 1.00 0.00 N ATOM 1318 CA LEU A 87 -9.524 -6.389 4.646 1.00 0.00 C ATOM 1319 C LEU A 87 -10.807 -5.567 4.578 1.00 0.00 C ATOM 1320 O LEU A 87 -11.283 -5.054 5.592 1.00 0.00 O ATOM 1321 CB LEU A 87 -8.352 -5.574 4.098 1.00 0.00 C ATOM 1322 CG LEU A 87 -6.993 -6.275 4.088 1.00 0.00 C ATOM 1323 CD1 LEU A 87 -5.987 -5.475 3.276 1.00 0.00 C ATOM 1324 CD2 LEU A 87 -6.490 -6.483 5.509 1.00 0.00 C ATOM 0 H LEU A 87 -9.026 -7.730 3.113 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.328 -6.637 5.689 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -8.590 -5.273 3.078 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.263 -4.661 4.687 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.112 -7.252 3.620 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.026 -5.989 3.280 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.342 -5.378 2.250 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.871 -4.484 3.715 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.522 -6.983 5.483 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -6.386 -5.517 6.003 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.201 -7.098 6.060 1.00 0.00 H new ATOM 1336 N TYR A 88 -11.364 -5.447 3.378 1.00 0.00 N ATOM 1337 CA TYR A 88 -12.591 -4.687 3.177 1.00 0.00 C ATOM 1338 C TYR A 88 -13.613 -5.004 4.266 1.00 0.00 C ATOM 1339 O TYR A 88 -14.023 -4.125 5.024 1.00 0.00 O ATOM 1340 CB TYR A 88 -13.185 -4.991 1.801 1.00 0.00 C ATOM 1341 CG TYR A 88 -14.685 -4.812 1.736 1.00 0.00 C ATOM 1342 CD1 TYR A 88 -15.270 -3.577 1.989 1.00 0.00 C ATOM 1343 CD2 TYR A 88 -15.518 -5.879 1.420 1.00 0.00 C ATOM 1344 CE1 TYR A 88 -16.640 -3.410 1.931 1.00 0.00 C ATOM 1345 CE2 TYR A 88 -16.889 -5.720 1.358 1.00 0.00 C ATOM 1346 CZ TYR A 88 -17.445 -4.484 1.615 1.00 0.00 C ATOM 1347 OH TYR A 88 -18.810 -4.321 1.555 1.00 0.00 O ATOM 0 H TYR A 88 -10.985 -5.867 2.529 1.00 0.00 H new ATOM 0 HA TYR A 88 -12.344 -3.627 3.232 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -12.718 -4.341 1.061 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -12.938 -6.016 1.526 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -14.643 -2.733 2.235 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -15.086 -6.848 1.220 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -17.078 -2.444 2.132 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -17.522 -6.559 1.110 1.00 0.00 H new ATOM 0 HH TYR A 88 -19.231 -5.174 1.319 1.00 0.00 H new ATOM 1357 N VAL A 89 -14.019 -6.267 4.336 1.00 0.00 N ATOM 1358 CA VAL A 89 -14.991 -6.703 5.332 1.00 0.00 C ATOM 1359 C VAL A 89 -14.507 -6.393 6.744 1.00 0.00 C ATOM 1360 O VAL A 89 -15.206 -5.744 7.522 1.00 0.00 O ATOM 1361 CB VAL A 89 -15.273 -8.213 5.218 1.00 0.00 C ATOM 1362 CG1 VAL A 89 -16.298 -8.645 6.256 1.00 0.00 C ATOM 1363 CG2 VAL A 89 -15.744 -8.562 3.814 1.00 0.00 C ATOM 0 H VAL A 89 -13.690 -7.007 3.715 1.00 0.00 H new ATOM 0 HA VAL A 89 -15.912 -6.153 5.137 1.00 0.00 H new ATOM 0 HB VAL A 89 -14.346 -8.754 5.411 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -16.484 -9.715 6.160 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -15.917 -8.431 7.255 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -17.228 -8.099 6.098 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -15.939 -9.633 3.751 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -16.659 -8.013 3.590 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -14.972 -8.291 3.093 1.00 0.00 H new ATOM 1373 N ALA A 90 -13.306 -6.861 7.069 1.00 0.00 N ATOM 1374 CA ALA A 90 -12.727 -6.632 8.387 1.00 0.00 C ATOM 1375 C ALA A 90 -12.796 -5.157 8.768 1.00 0.00 C ATOM 1376 O ALA A 90 -12.703 -4.806 9.943 1.00 0.00 O ATOM 1377 CB ALA A 90 -11.287 -7.121 8.423 1.00 0.00 C ATOM 0 H ALA A 90 -12.715 -7.401 6.437 1.00 0.00 H new ATOM 0 HA ALA A 90 -13.309 -7.196 9.115 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -10.867 -6.944 9.413 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -11.260 -8.188 8.203 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.701 -6.582 7.679 1.00 0.00 H new ATOM 1383 N GLU A 91 -12.961 -4.299 7.766 1.00 0.00 N ATOM 1384 CA GLU A 91 -13.040 -2.861 7.998 1.00 0.00 C ATOM 1385 C GLU A 91 -14.432 -2.465 8.482 1.00 0.00 C ATOM 1386 O GLU A 91 -14.574 -1.690 9.427 1.00 0.00 O ATOM 1387 CB GLU A 91 -12.696 -2.096 6.718 1.00 0.00 C ATOM 1388 CG GLU A 91 -12.231 -0.671 6.967 1.00 0.00 C ATOM 1389 CD GLU A 91 -11.395 -0.123 5.827 1.00 0.00 C ATOM 1390 OE1 GLU A 91 -10.504 -0.849 5.341 1.00 0.00 O ATOM 1391 OE2 GLU A 91 -11.634 1.034 5.421 1.00 0.00 O ATOM 0 H GLU A 91 -13.042 -4.574 6.787 1.00 0.00 H new ATOM 0 HA GLU A 91 -12.317 -2.603 8.772 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -11.916 -2.635 6.181 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -13.573 -2.075 6.070 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -13.100 -0.030 7.116 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -11.649 -0.638 7.888 1.00 0.00 H new ATOM 1398 N GLN A 92 -15.456 -3.002 7.825 1.00 0.00 N ATOM 1399 CA GLN A 92 -16.836 -2.703 8.188 1.00 0.00 C ATOM 1400 C GLN A 92 -17.251 -3.477 9.435 1.00 0.00 C ATOM 1401 O GLN A 92 -17.748 -2.897 10.401 1.00 0.00 O ATOM 1402 CB GLN A 92 -17.775 -3.041 7.028 1.00 0.00 C ATOM 1403 CG GLN A 92 -17.473 -2.265 5.756 1.00 0.00 C ATOM 1404 CD GLN A 92 -18.129 -0.898 5.737 1.00 0.00 C ATOM 1405 OE1 GLN A 92 -19.199 -0.702 6.315 1.00 0.00 O ATOM 1406 NE2 GLN A 92 -17.489 0.057 5.072 1.00 0.00 N ATOM 0 H GLN A 92 -15.356 -3.645 7.040 1.00 0.00 H new ATOM 0 HA GLN A 92 -16.905 -1.637 8.404 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -17.709 -4.108 6.817 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -18.802 -2.839 7.332 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -16.394 -2.148 5.654 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -17.814 -2.840 4.895 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -16.605 -0.150 4.608 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -17.882 0.997 5.026 1.00 0.00 H new ATOM 1415 N PHE A 93 -17.044 -4.789 9.407 1.00 0.00 N ATOM 1416 CA PHE A 93 -17.398 -5.643 10.535 1.00 0.00 C ATOM 1417 C PHE A 93 -16.244 -5.738 11.529 1.00 0.00 C ATOM 1418 O PHE A 93 -16.300 -5.171 12.619 1.00 0.00 O ATOM 1419 CB PHE A 93 -17.779 -7.041 10.044 1.00 0.00 C ATOM 1420 CG PHE A 93 -18.829 -7.033 8.970 1.00 0.00 C ATOM 1421 CD1 PHE A 93 -18.486 -6.785 7.650 1.00 0.00 C ATOM 1422 CD2 PHE A 93 -20.158 -7.274 9.279 1.00 0.00 C ATOM 1423 CE1 PHE A 93 -19.450 -6.777 6.659 1.00 0.00 C ATOM 1424 CE2 PHE A 93 -21.125 -7.268 8.292 1.00 0.00 C ATOM 1425 CZ PHE A 93 -20.771 -7.018 6.980 1.00 0.00 C ATOM 0 H PHE A 93 -16.633 -5.284 8.616 1.00 0.00 H new ATOM 0 HA PHE A 93 -18.254 -5.197 11.041 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -16.887 -7.540 9.665 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -18.139 -7.629 10.889 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -17.454 -6.596 7.393 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -20.441 -7.469 10.303 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -19.170 -6.582 5.634 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -22.157 -7.459 8.546 1.00 0.00 H new ATOM 0 HZ PHE A 93 -21.526 -7.011 6.208 1.00 0.00 H new ATOM 1435 N GLY A 94 -15.196 -6.461 11.143 1.00 0.00 N ATOM 1436 CA GLY A 94 -14.044 -6.618 12.010 1.00 0.00 C ATOM 1437 C GLY A 94 -13.257 -7.877 11.706 1.00 0.00 C ATOM 1438 O GLY A 94 -13.769 -8.798 11.069 1.00 0.00 O ATOM 0 H GLY A 94 -15.125 -6.940 10.245 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.392 -5.751 11.903 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.375 -6.642 13.048 1.00 0.00 H new ATOM 1442 N GLU A 95 -12.008 -7.917 12.160 1.00 0.00 N ATOM 1443 CA GLU A 95 -11.149 -9.073 11.929 1.00 0.00 C ATOM 1444 C GLU A 95 -11.823 -10.356 12.405 1.00 0.00 C ATOM 1445 O GLU A 95 -11.742 -11.392 11.746 1.00 0.00 O ATOM 1446 CB GLU A 95 -9.809 -8.891 12.647 1.00 0.00 C ATOM 1447 CG GLU A 95 -9.194 -7.517 12.449 1.00 0.00 C ATOM 1448 CD GLU A 95 -9.165 -7.095 10.992 1.00 0.00 C ATOM 1449 OE1 GLU A 95 -9.039 -7.981 10.121 1.00 0.00 O ATOM 1450 OE2 GLU A 95 -9.268 -5.880 10.724 1.00 0.00 O ATOM 0 H GLU A 95 -11.569 -7.164 12.689 1.00 0.00 H new ATOM 0 HA GLU A 95 -10.971 -9.153 10.857 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.951 -9.066 13.713 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.110 -9.647 12.291 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.759 -6.784 13.025 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.178 -7.518 12.844 1.00 0.00 H new ATOM 1457 N GLU A 96 -12.488 -10.278 13.553 1.00 0.00 N ATOM 1458 CA GLU A 96 -13.176 -11.433 14.118 1.00 0.00 C ATOM 1459 C GLU A 96 -14.353 -11.848 13.241 1.00 0.00 C ATOM 1460 O GLU A 96 -14.610 -13.035 13.048 1.00 0.00 O ATOM 1461 CB GLU A 96 -13.665 -11.122 15.534 1.00 0.00 C ATOM 1462 CG GLU A 96 -14.682 -9.995 15.593 1.00 0.00 C ATOM 1463 CD GLU A 96 -15.279 -9.820 16.975 1.00 0.00 C ATOM 1464 OE1 GLU A 96 -14.530 -9.946 17.966 1.00 0.00 O ATOM 1465 OE2 GLU A 96 -16.497 -9.557 17.066 1.00 0.00 O ATOM 0 H GLU A 96 -12.565 -9.427 14.110 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.467 -12.260 14.160 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -14.107 -12.022 15.962 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -12.809 -10.860 16.156 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -14.205 -9.064 15.287 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -15.481 -10.194 14.879 1.00 0.00 H new ATOM 1472 N ASN A 97 -15.066 -10.859 12.712 1.00 0.00 N ATOM 1473 CA ASN A 97 -16.218 -11.120 11.856 1.00 0.00 C ATOM 1474 C ASN A 97 -15.789 -11.801 10.560 1.00 0.00 C ATOM 1475 O ASN A 97 -16.457 -12.716 10.076 1.00 0.00 O ATOM 1476 CB ASN A 97 -16.951 -9.814 11.540 1.00 0.00 C ATOM 1477 CG ASN A 97 -18.286 -10.051 10.859 1.00 0.00 C ATOM 1478 OD1 ASN A 97 -18.476 -9.688 9.698 1.00 0.00 O ATOM 1479 ND2 ASN A 97 -19.218 -10.661 11.582 1.00 0.00 N ATOM 0 H ASN A 97 -14.867 -9.870 12.861 1.00 0.00 H new ATOM 0 HA ASN A 97 -16.893 -11.788 12.391 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -17.111 -9.257 12.463 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -16.324 -9.194 10.899 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -20.136 -10.846 11.179 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -19.016 -10.944 12.541 1.00 0.00 H new ATOM 1486 N VAL A 98 -14.670 -11.350 10.002 1.00 0.00 N ATOM 1487 CA VAL A 98 -14.151 -11.917 8.764 1.00 0.00 C ATOM 1488 C VAL A 98 -14.195 -13.441 8.796 1.00 0.00 C ATOM 1489 O VAL A 98 -14.555 -14.082 7.810 1.00 0.00 O ATOM 1490 CB VAL A 98 -12.703 -11.462 8.502 1.00 0.00 C ATOM 1491 CG1 VAL A 98 -12.161 -12.107 7.235 1.00 0.00 C ATOM 1492 CG2 VAL A 98 -12.630 -9.945 8.411 1.00 0.00 C ATOM 0 H VAL A 98 -14.106 -10.593 10.388 1.00 0.00 H new ATOM 0 HA VAL A 98 -14.790 -11.555 7.958 1.00 0.00 H new ATOM 0 HB VAL A 98 -12.082 -11.784 9.338 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -11.137 -11.774 7.066 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -12.176 -13.191 7.344 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -12.781 -11.819 6.386 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -11.600 -9.641 8.226 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -13.263 -9.599 7.594 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -12.975 -9.507 9.348 1.00 0.00 H new ATOM 1502 N ASN A 99 -13.827 -14.014 9.937 1.00 0.00 N ATOM 1503 CA ASN A 99 -13.824 -15.463 10.098 1.00 0.00 C ATOM 1504 C ASN A 99 -15.227 -16.034 9.917 1.00 0.00 C ATOM 1505 O ASN A 99 -15.480 -16.810 8.995 1.00 0.00 O ATOM 1506 CB ASN A 99 -13.281 -15.843 11.477 1.00 0.00 C ATOM 1507 CG ASN A 99 -12.273 -14.837 11.999 1.00 0.00 C ATOM 1508 OD1 ASN A 99 -12.377 -14.368 13.132 1.00 0.00 O ATOM 1509 ND2 ASN A 99 -11.290 -14.502 11.172 1.00 0.00 N ATOM 0 H ASN A 99 -13.527 -13.497 10.764 1.00 0.00 H new ATOM 0 HA ASN A 99 -13.177 -15.887 9.330 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -14.109 -15.922 12.181 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -12.814 -16.826 11.422 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -10.581 -13.830 11.468 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -11.243 -14.916 10.241 1.00 0.00 H new ATOM 1516 N THR A 100 -16.138 -15.642 10.802 1.00 0.00 N ATOM 1517 CA THR A 100 -17.516 -16.114 10.741 1.00 0.00 C ATOM 1518 C THR A 100 -18.191 -15.673 9.447 1.00 0.00 C ATOM 1519 O THR A 100 -19.198 -16.248 9.034 1.00 0.00 O ATOM 1520 CB THR A 100 -18.339 -15.600 11.937 1.00 0.00 C ATOM 1521 OG1 THR A 100 -18.988 -14.370 11.593 1.00 0.00 O ATOM 1522 CG2 THR A 100 -17.452 -15.388 13.154 1.00 0.00 C ATOM 0 H THR A 100 -15.946 -14.999 11.570 1.00 0.00 H new ATOM 0 HA THR A 100 -17.479 -17.203 10.776 1.00 0.00 H new ATOM 0 HB THR A 100 -19.090 -16.351 12.182 1.00 0.00 H new ATOM 0 HG1 THR A 100 -19.510 -14.051 12.358 1.00 0.00 H new ATOM 0 HG21 THR A 100 -18.056 -15.025 13.986 1.00 0.00 H new ATOM 0 HG22 THR A 100 -16.983 -16.332 13.431 1.00 0.00 H new ATOM 0 HG23 THR A 100 -16.680 -14.655 12.919 1.00 0.00 H new ATOM 1530 N TYR A 101 -17.630 -14.651 8.811 1.00 0.00 N ATOM 1531 CA TYR A 101 -18.179 -14.132 7.564 1.00 0.00 C ATOM 1532 C TYR A 101 -17.785 -15.017 6.385 1.00 0.00 C ATOM 1533 O TYR A 101 -18.594 -15.285 5.497 1.00 0.00 O ATOM 1534 CB TYR A 101 -17.695 -12.701 7.326 1.00 0.00 C ATOM 1535 CG TYR A 101 -18.621 -11.887 6.450 1.00 0.00 C ATOM 1536 CD1 TYR A 101 -19.904 -11.564 6.873 1.00 0.00 C ATOM 1537 CD2 TYR A 101 -18.212 -11.440 5.200 1.00 0.00 C ATOM 1538 CE1 TYR A 101 -20.753 -10.821 6.076 1.00 0.00 C ATOM 1539 CE2 TYR A 101 -19.053 -10.695 4.396 1.00 0.00 C ATOM 1540 CZ TYR A 101 -20.323 -10.389 4.839 1.00 0.00 C ATOM 1541 OH TYR A 101 -21.166 -9.647 4.042 1.00 0.00 O ATOM 0 H TYR A 101 -16.795 -14.165 9.138 1.00 0.00 H new ATOM 0 HA TYR A 101 -19.266 -14.132 7.647 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -17.583 -12.199 8.287 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -16.707 -12.732 6.866 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -20.244 -11.900 7.842 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -17.219 -11.679 4.850 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -21.748 -10.580 6.420 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -18.718 -10.355 3.427 1.00 0.00 H new ATOM 0 HH TYR A 101 -20.710 -9.421 3.204 1.00 0.00 H new ATOM 1551 N PHE A 102 -16.535 -15.468 6.385 1.00 0.00 N ATOM 1552 CA PHE A 102 -16.031 -16.323 5.316 1.00 0.00 C ATOM 1553 C PHE A 102 -16.437 -17.776 5.545 1.00 0.00 C ATOM 1554 O PHE A 102 -16.304 -18.616 4.655 1.00 0.00 O ATOM 1555 CB PHE A 102 -14.507 -16.215 5.224 1.00 0.00 C ATOM 1556 CG PHE A 102 -14.037 -15.065 4.381 1.00 0.00 C ATOM 1557 CD1 PHE A 102 -14.516 -13.784 4.604 1.00 0.00 C ATOM 1558 CD2 PHE A 102 -13.117 -15.264 3.364 1.00 0.00 C ATOM 1559 CE1 PHE A 102 -14.085 -12.723 3.830 1.00 0.00 C ATOM 1560 CE2 PHE A 102 -12.683 -14.207 2.587 1.00 0.00 C ATOM 1561 CZ PHE A 102 -13.168 -12.935 2.820 1.00 0.00 C ATOM 0 H PHE A 102 -15.853 -15.256 7.113 1.00 0.00 H new ATOM 0 HA PHE A 102 -16.469 -15.986 4.377 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -14.097 -16.110 6.228 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -14.109 -17.143 4.813 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -15.235 -13.613 5.392 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -12.735 -16.257 3.177 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -14.465 -11.729 4.015 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -11.965 -14.375 1.798 1.00 0.00 H new ATOM 0 HZ PHE A 102 -12.831 -12.108 2.213 1.00 0.00 H new ATOM 1571 N VAL A 103 -16.931 -18.064 6.744 1.00 0.00 N ATOM 1572 CA VAL A 103 -17.357 -19.415 7.091 1.00 0.00 C ATOM 1573 C VAL A 103 -18.877 -19.509 7.169 1.00 0.00 C ATOM 1574 O VAL A 103 -19.522 -18.735 7.876 1.00 0.00 O ATOM 1575 CB VAL A 103 -16.757 -19.864 8.436 1.00 0.00 C ATOM 1576 CG1 VAL A 103 -17.681 -20.855 9.129 1.00 0.00 C ATOM 1577 CG2 VAL A 103 -15.376 -20.467 8.228 1.00 0.00 C ATOM 0 H VAL A 103 -17.046 -17.380 7.492 1.00 0.00 H new ATOM 0 HA VAL A 103 -16.995 -20.074 6.302 1.00 0.00 H new ATOM 0 HB VAL A 103 -16.654 -18.989 9.078 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -17.240 -21.161 10.078 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -18.647 -20.385 9.312 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -17.818 -21.730 8.494 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -14.967 -20.779 9.189 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -15.452 -21.331 7.568 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -14.718 -19.723 7.778 1.00 0.00 H new ATOM 1587 N SER A 104 -19.444 -20.463 6.437 1.00 0.00 N ATOM 1588 CA SER A 104 -20.889 -20.656 6.420 1.00 0.00 C ATOM 1589 C SER A 104 -21.309 -21.704 7.447 1.00 0.00 C ATOM 1590 O SER A 104 -22.119 -21.432 8.331 1.00 0.00 O ATOM 1591 CB SER A 104 -21.351 -21.080 5.024 1.00 0.00 C ATOM 1592 OG SER A 104 -21.290 -19.994 4.115 1.00 0.00 O ATOM 0 H SER A 104 -18.925 -21.114 5.848 1.00 0.00 H new ATOM 0 HA SER A 104 -21.361 -19.708 6.679 1.00 0.00 H new ATOM 0 HB2 SER A 104 -20.725 -21.896 4.663 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.372 -21.459 5.075 1.00 0.00 H new ATOM 0 HG SER A 104 -21.588 -20.291 3.230 1.00 0.00 H new ATOM 1598 N GLY A 105 -20.749 -22.904 7.322 1.00 0.00 N ATOM 1599 CA GLY A 105 -21.077 -23.975 8.244 1.00 0.00 C ATOM 1600 C GLY A 105 -21.087 -25.334 7.574 1.00 0.00 C ATOM 1601 O GLY A 105 -20.472 -25.539 6.528 1.00 0.00 O ATOM 0 H GLY A 105 -20.074 -23.153 6.599 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -20.355 -23.981 9.060 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -22.055 -23.784 8.685 1.00 0.00 H new ATOM 1605 N PRO A 106 -21.798 -26.294 8.185 1.00 0.00 N ATOM 1606 CA PRO A 106 -21.902 -27.658 7.659 1.00 0.00 C ATOM 1607 C PRO A 106 -22.727 -27.725 6.379 1.00 0.00 C ATOM 1608 O PRO A 106 -23.919 -27.418 6.380 1.00 0.00 O ATOM 1609 CB PRO A 106 -22.602 -28.421 8.787 1.00 0.00 C ATOM 1610 CG PRO A 106 -23.371 -27.382 9.527 1.00 0.00 C ATOM 1611 CD PRO A 106 -22.556 -26.121 9.435 1.00 0.00 C ATOM 0 HA PRO A 106 -20.928 -28.066 7.390 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -23.261 -29.195 8.392 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -21.881 -28.917 9.436 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -24.359 -27.241 9.089 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -23.522 -27.674 10.566 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -23.190 -25.235 9.401 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -21.894 -26.007 10.294 1.00 0.00 H new ATOM 1619 N SER A 107 -22.086 -28.129 5.287 1.00 0.00 N ATOM 1620 CA SER A 107 -22.760 -28.232 3.998 1.00 0.00 C ATOM 1621 C SER A 107 -23.538 -29.541 3.896 1.00 0.00 C ATOM 1622 O SER A 107 -22.969 -30.593 3.607 1.00 0.00 O ATOM 1623 CB SER A 107 -21.745 -28.139 2.858 1.00 0.00 C ATOM 1624 OG SER A 107 -21.208 -26.832 2.758 1.00 0.00 O ATOM 0 H SER A 107 -21.100 -28.390 5.269 1.00 0.00 H new ATOM 0 HA SER A 107 -23.463 -27.403 3.916 1.00 0.00 H new ATOM 0 HB2 SER A 107 -20.940 -28.854 3.025 1.00 0.00 H new ATOM 0 HB3 SER A 107 -22.224 -28.412 1.918 1.00 0.00 H new ATOM 0 HG SER A 107 -20.561 -26.800 2.023 1.00 0.00 H new ATOM 1630 N SER A 108 -24.843 -29.466 4.135 1.00 0.00 N ATOM 1631 CA SER A 108 -25.700 -30.645 4.074 1.00 0.00 C ATOM 1632 C SER A 108 -27.059 -30.298 3.473 1.00 0.00 C ATOM 1633 O SER A 108 -27.649 -29.268 3.796 1.00 0.00 O ATOM 1634 CB SER A 108 -25.885 -31.239 5.472 1.00 0.00 C ATOM 1635 OG SER A 108 -26.558 -30.332 6.327 1.00 0.00 O ATOM 0 H SER A 108 -25.330 -28.602 4.373 1.00 0.00 H new ATOM 0 HA SER A 108 -25.217 -31.383 3.434 1.00 0.00 H new ATOM 0 HB2 SER A 108 -26.452 -32.168 5.404 1.00 0.00 H new ATOM 0 HB3 SER A 108 -24.912 -31.489 5.896 1.00 0.00 H new ATOM 0 HG SER A 108 -26.665 -30.736 7.213 1.00 0.00 H new ATOM 1641 N GLY A 109 -27.549 -31.167 2.594 1.00 0.00 N ATOM 1642 CA GLY A 109 -28.834 -30.936 1.961 1.00 0.00 C ATOM 1643 C GLY A 109 -29.641 -32.210 1.804 1.00 0.00 C ATOM 1644 O GLY A 109 -29.902 -32.653 0.685 1.00 0.00 O ATOM 0 H GLY A 109 -27.079 -32.026 2.309 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -29.404 -30.220 2.553 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -28.677 -30.486 0.981 1.00 0.00 H new TER 1648 GLY A 109