USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 780 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 95 HIS : no HD1:sc= 0.875 K(o=3.2,f=-6.4!) USER MOD Set 1.2: A 97 LYS NZ :NH3+ -170:sc= 2.32 (180deg=1.14) USER MOD Set 2.1: A 6 SER OG : rot -24:sc= 1.91 USER MOD Set 2.2: A 91 LYS NZ :NH3+ -148:sc= 3.29 (180deg=1.78) USER MOD Set 3.1: A 38 GLN : amide:sc= 0.954 K(o=0.84,f=-0.36) USER MOD Set 3.2: A 77 MET CE :methyl -139:sc= -0.119 (180deg=-2.41!) USER MOD Set 4.1: A 53 THR OG1 : rot -55:sc= 1.31 USER MOD Set 4.2: A 55 GLN : amide:sc= 0.685 K(o=2,f=1.1) USER MOD Set 5.1: A 5 SER OG : rot -165:sc= 0.354 USER MOD Set 5.2: A 96 ASN : amide:sc= 0 K(o=0.35,f=-0.44) USER MOD Set 6.1: A 3 SER OG : rot 130:sc= 0.603 USER MOD Set 6.2: A 90 ASN : amide:sc= 1 K(o=1.6,f=-2.5!) USER MOD Single : A 1 GLY N :NH3+ -112:sc= 0.051 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 1.22 K(o=1.2,f=-0.39) USER MOD Single : A 14 GLN : amide:sc= 1.44 K(o=1.4,f=-4.7!) USER MOD Single : A 17 THR OG1 : rot 69:sc= 1.15 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -146:sc= 1.29 (180deg=1.05) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0.9 K(o=0.9,f=-0.3) USER MOD Single : A 45 THR OG1 : rot 178:sc= 0.158 USER MOD Single : A 46 HIS : no HD1:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 47 MET CE :methyl 135:sc=-0.00415 (180deg=-0.286) USER MOD Single : A 49 LYS NZ :NH3+ -157:sc= 2.41 (180deg=1.74) USER MOD Single : A 56 HIS : no HD1:sc= 1.31 K(o=1.3,f=-7.5!) USER MOD Single : A 57 GLN : amide:sc= 0.325 X(o=0.32,f=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl -169:sc= 0 (180deg=-0.129) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 178:sc= 1.13 (180deg=1.13) USER MOD Single : A 93 SER OG : rot 155:sc= 1.16 USER MOD Single : A 98 ASN : amide:sc= 0.0237 K(o=0.024,f=-2) USER MOD Single : A 100 SER OG : rot 180:sc= 0.013 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.894 -16.356 14.425 1.00 0.00 N ATOM 2 CA GLY A 1 -6.732 -15.568 13.493 1.00 0.00 C ATOM 3 C GLY A 1 -6.432 -14.078 13.584 1.00 0.00 C ATOM 4 O GLY A 1 -5.907 -13.610 14.596 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.224 -16.938 13.882 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.367 -15.711 15.048 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.501 -16.973 15.001 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.562 -15.911 12.473 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.785 -15.741 13.716 1.00 0.00 H new ATOM 10 N SER A 2 -6.795 -13.330 12.533 1.00 0.00 N ATOM 11 CA SER A 2 -6.556 -11.879 12.355 1.00 0.00 C ATOM 12 C SER A 2 -5.072 -11.452 12.314 1.00 0.00 C ATOM 13 O SER A 2 -4.159 -12.226 12.616 1.00 0.00 O ATOM 14 CB SER A 2 -7.360 -11.054 13.379 1.00 0.00 C ATOM 15 OG SER A 2 -8.745 -11.364 13.297 1.00 0.00 O ATOM 0 H SER A 2 -7.290 -13.736 11.739 1.00 0.00 H new ATOM 0 HA SER A 2 -6.923 -11.657 11.353 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.995 -11.259 14.385 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.209 -9.990 13.196 1.00 0.00 H new ATOM 0 HG SER A 2 -9.239 -10.832 13.955 1.00 0.00 H new ATOM 21 N SER A 3 -4.823 -10.203 11.905 1.00 0.00 N ATOM 22 CA SER A 3 -3.484 -9.584 11.882 1.00 0.00 C ATOM 23 C SER A 3 -2.992 -9.195 13.284 1.00 0.00 C ATOM 24 O SER A 3 -3.791 -9.005 14.208 1.00 0.00 O ATOM 25 CB SER A 3 -3.487 -8.345 10.980 1.00 0.00 C ATOM 26 OG SER A 3 -3.695 -8.726 9.630 1.00 0.00 O ATOM 0 H SER A 3 -5.558 -9.578 11.573 1.00 0.00 H new ATOM 0 HA SER A 3 -2.797 -10.332 11.486 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.271 -7.657 11.297 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.540 -7.814 11.075 1.00 0.00 H new ATOM 0 HG SER A 3 -4.412 -8.182 9.243 1.00 0.00 H new ATOM 32 N GLY A 4 -1.673 -9.041 13.442 1.00 0.00 N ATOM 33 CA GLY A 4 -1.055 -8.524 14.669 1.00 0.00 C ATOM 34 C GLY A 4 -1.374 -7.045 14.939 1.00 0.00 C ATOM 35 O GLY A 4 -1.846 -6.312 14.066 1.00 0.00 O ATOM 0 H GLY A 4 -0.997 -9.274 12.715 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.393 -9.121 15.516 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.026 -8.648 14.602 1.00 0.00 H new ATOM 39 N SER A 5 -1.119 -6.611 16.173 1.00 0.00 N ATOM 40 CA SER A 5 -1.527 -5.313 16.728 1.00 0.00 C ATOM 41 C SER A 5 -0.844 -4.074 16.125 1.00 0.00 C ATOM 42 O SER A 5 -1.428 -2.989 16.182 1.00 0.00 O ATOM 43 CB SER A 5 -1.323 -5.348 18.248 1.00 0.00 C ATOM 44 OG SER A 5 -0.036 -5.851 18.596 1.00 0.00 O ATOM 0 H SER A 5 -0.600 -7.176 16.845 1.00 0.00 H new ATOM 0 HA SER A 5 -2.576 -5.190 16.457 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.443 -4.344 18.654 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.093 -5.971 18.704 1.00 0.00 H new ATOM 0 HG SER A 5 -0.022 -6.083 19.548 1.00 0.00 H new ATOM 50 N SER A 6 0.336 -4.217 15.506 1.00 0.00 N ATOM 51 CA SER A 6 1.196 -3.141 14.961 1.00 0.00 C ATOM 52 C SER A 6 1.571 -2.055 15.998 1.00 0.00 C ATOM 53 O SER A 6 1.281 -2.200 17.190 1.00 0.00 O ATOM 54 CB SER A 6 0.600 -2.594 13.650 1.00 0.00 C ATOM 55 OG SER A 6 -0.563 -1.811 13.848 1.00 0.00 O ATOM 0 H SER A 6 0.746 -5.140 15.360 1.00 0.00 H new ATOM 0 HA SER A 6 2.162 -3.581 14.712 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.352 -1.992 13.140 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.360 -3.429 12.992 1.00 0.00 H new ATOM 0 HG SER A 6 -0.992 -2.070 14.690 1.00 0.00 H new ATOM 61 N GLY A 7 2.266 -0.982 15.596 1.00 0.00 N ATOM 62 CA GLY A 7 2.549 0.141 16.507 1.00 0.00 C ATOM 63 C GLY A 7 3.043 1.436 15.840 1.00 0.00 C ATOM 64 O GLY A 7 3.610 1.382 14.747 1.00 0.00 O ATOM 0 H GLY A 7 2.641 -0.866 14.654 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.642 0.367 17.068 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.298 -0.182 17.230 1.00 0.00 H new ATOM 68 N PRO A 8 2.872 2.608 16.488 1.00 0.00 N ATOM 69 CA PRO A 8 3.239 3.926 15.955 1.00 0.00 C ATOM 70 C PRO A 8 4.747 4.235 16.108 1.00 0.00 C ATOM 71 O PRO A 8 5.146 5.251 16.682 1.00 0.00 O ATOM 72 CB PRO A 8 2.315 4.905 16.694 1.00 0.00 C ATOM 73 CG PRO A 8 2.212 4.272 18.080 1.00 0.00 C ATOM 74 CD PRO A 8 2.176 2.776 17.761 1.00 0.00 C ATOM 0 HA PRO A 8 3.098 3.995 14.876 1.00 0.00 H new ATOM 0 HB2 PRO A 8 2.737 5.909 16.736 1.00 0.00 H new ATOM 0 HB3 PRO A 8 1.341 4.988 16.211 1.00 0.00 H new ATOM 0 HG2 PRO A 8 3.063 4.532 18.709 1.00 0.00 H new ATOM 0 HG3 PRO A 8 1.315 4.596 18.608 1.00 0.00 H new ATOM 0 HD2 PRO A 8 2.662 2.199 18.548 1.00 0.00 H new ATOM 0 HD3 PRO A 8 1.149 2.418 17.692 1.00 0.00 H new ATOM 82 N ILE A 9 5.602 3.338 15.609 1.00 0.00 N ATOM 83 CA ILE A 9 7.067 3.480 15.598 1.00 0.00 C ATOM 84 C ILE A 9 7.525 4.584 14.627 1.00 0.00 C ATOM 85 O ILE A 9 6.986 4.724 13.526 1.00 0.00 O ATOM 86 CB ILE A 9 7.741 2.108 15.331 1.00 0.00 C ATOM 87 CG1 ILE A 9 9.280 2.199 15.325 1.00 0.00 C ATOM 88 CG2 ILE A 9 7.229 1.443 14.041 1.00 0.00 C ATOM 89 CD1 ILE A 9 9.995 0.841 15.369 1.00 0.00 C ATOM 0 H ILE A 9 5.287 2.464 15.187 1.00 0.00 H new ATOM 0 HA ILE A 9 7.394 3.807 16.585 1.00 0.00 H new ATOM 0 HB ILE A 9 7.453 1.471 16.167 1.00 0.00 H new ATOM 0 HG12 ILE A 9 9.597 2.734 14.430 1.00 0.00 H new ATOM 0 HG13 ILE A 9 9.600 2.793 16.181 1.00 0.00 H new ATOM 0 HG21 ILE A 9 7.732 0.486 13.900 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.154 1.280 14.118 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.438 2.091 13.190 1.00 0.00 H new ATOM 0 HD11 ILE A 9 11.074 0.997 15.362 1.00 0.00 H new ATOM 0 HD12 ILE A 9 9.711 0.310 16.278 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.708 0.250 14.499 1.00 0.00 H new ATOM 101 N SER A 10 8.546 5.348 15.029 1.00 0.00 N ATOM 102 CA SER A 10 9.210 6.378 14.206 1.00 0.00 C ATOM 103 C SER A 10 10.634 5.980 13.782 1.00 0.00 C ATOM 104 O SER A 10 11.221 6.603 12.898 1.00 0.00 O ATOM 105 CB SER A 10 9.252 7.715 14.958 1.00 0.00 C ATOM 106 OG SER A 10 7.939 8.178 15.244 1.00 0.00 O ATOM 0 H SER A 10 8.949 5.269 15.963 1.00 0.00 H new ATOM 0 HA SER A 10 8.617 6.478 13.297 1.00 0.00 H new ATOM 0 HB2 SER A 10 9.811 7.597 15.887 1.00 0.00 H new ATOM 0 HB3 SER A 10 9.781 8.457 14.360 1.00 0.00 H new ATOM 0 HG SER A 10 7.990 9.030 15.725 1.00 0.00 H new ATOM 112 N GLU A 11 11.194 4.931 14.391 1.00 0.00 N ATOM 113 CA GLU A 11 12.565 4.443 14.160 1.00 0.00 C ATOM 114 C GLU A 11 12.675 3.520 12.925 1.00 0.00 C ATOM 115 O GLU A 11 13.774 3.280 12.415 1.00 0.00 O ATOM 116 CB GLU A 11 13.063 3.732 15.432 1.00 0.00 C ATOM 117 CG GLU A 11 13.323 4.665 16.631 1.00 0.00 C ATOM 118 CD GLU A 11 12.072 5.384 17.187 1.00 0.00 C ATOM 119 OE1 GLU A 11 10.983 4.766 17.277 1.00 0.00 O ATOM 120 OE2 GLU A 11 12.175 6.585 17.540 1.00 0.00 O ATOM 0 H GLU A 11 10.691 4.376 15.083 1.00 0.00 H new ATOM 0 HA GLU A 11 13.198 5.303 13.943 1.00 0.00 H new ATOM 0 HB2 GLU A 11 12.327 2.983 15.725 1.00 0.00 H new ATOM 0 HB3 GLU A 11 13.984 3.199 15.197 1.00 0.00 H new ATOM 0 HG2 GLU A 11 13.774 4.082 17.434 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.053 5.418 16.334 1.00 0.00 H new ATOM 127 N ARG A 12 11.531 3.034 12.423 1.00 0.00 N ATOM 128 CA ARG A 12 11.348 2.295 11.162 1.00 0.00 C ATOM 129 C ARG A 12 10.005 2.706 10.547 1.00 0.00 C ATOM 130 O ARG A 12 9.023 2.843 11.276 1.00 0.00 O ATOM 131 CB ARG A 12 11.399 0.778 11.445 1.00 0.00 C ATOM 132 CG ARG A 12 11.559 -0.069 10.167 1.00 0.00 C ATOM 133 CD ARG A 12 11.302 -1.566 10.400 1.00 0.00 C ATOM 134 NE ARG A 12 12.290 -2.188 11.303 1.00 0.00 N ATOM 135 CZ ARG A 12 12.336 -3.465 11.641 1.00 0.00 C ATOM 136 NH1 ARG A 12 13.254 -3.893 12.459 1.00 0.00 N ATOM 137 NH2 ARG A 12 11.486 -4.343 11.184 1.00 0.00 N ATOM 0 H ARG A 12 10.648 3.154 12.920 1.00 0.00 H new ATOM 0 HA ARG A 12 12.144 2.531 10.455 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.229 0.568 12.120 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.486 0.479 11.960 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.870 0.298 9.406 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.567 0.064 9.774 1.00 0.00 H new ATOM 0 HD2 ARG A 12 10.304 -1.697 10.818 1.00 0.00 H new ATOM 0 HD3 ARG A 12 11.317 -2.085 9.442 1.00 0.00 H new ATOM 0 HE ARG A 12 13.002 -1.577 11.703 1.00 0.00 H new ATOM 0 HH11 ARG A 12 13.940 -3.242 12.841 1.00 0.00 H new ATOM 0 HH12 ARG A 12 13.287 -4.879 12.718 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.750 -4.053 10.540 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.557 -5.319 11.471 1.00 0.00 H new ATOM 151 N ASN A 13 9.926 2.855 9.223 1.00 0.00 N ATOM 152 CA ASN A 13 8.693 3.271 8.530 1.00 0.00 C ATOM 153 C ASN A 13 7.781 2.090 8.129 1.00 0.00 C ATOM 154 O ASN A 13 6.825 2.281 7.382 1.00 0.00 O ATOM 155 CB ASN A 13 9.042 4.190 7.339 1.00 0.00 C ATOM 156 CG ASN A 13 9.670 5.525 7.724 1.00 0.00 C ATOM 157 OD1 ASN A 13 9.856 5.869 8.884 1.00 0.00 O ATOM 158 ND2 ASN A 13 10.014 6.332 6.749 1.00 0.00 N ATOM 0 H ASN A 13 10.713 2.692 8.595 1.00 0.00 H new ATOM 0 HA ASN A 13 8.095 3.843 9.240 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.727 3.660 6.678 1.00 0.00 H new ATOM 0 HB3 ASN A 13 8.133 4.383 6.769 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.433 7.238 6.960 1.00 0.00 H new ATOM 0 HD22 ASN A 13 9.863 6.054 5.779 1.00 0.00 H new ATOM 165 N GLN A 14 8.042 0.867 8.606 1.00 0.00 N ATOM 166 CA GLN A 14 7.322 -0.345 8.184 1.00 0.00 C ATOM 167 C GLN A 14 5.841 -0.342 8.606 1.00 0.00 C ATOM 168 O GLN A 14 4.982 -0.735 7.824 1.00 0.00 O ATOM 169 CB GLN A 14 8.077 -1.571 8.720 1.00 0.00 C ATOM 170 CG GLN A 14 7.532 -2.895 8.161 1.00 0.00 C ATOM 171 CD GLN A 14 8.320 -4.121 8.621 1.00 0.00 C ATOM 172 OE1 GLN A 14 9.299 -4.049 9.356 1.00 0.00 O ATOM 173 NE2 GLN A 14 7.915 -5.303 8.212 1.00 0.00 N ATOM 0 H GLN A 14 8.765 0.687 9.302 1.00 0.00 H new ATOM 0 HA GLN A 14 7.299 -0.378 7.095 1.00 0.00 H new ATOM 0 HB2 GLN A 14 9.133 -1.482 8.466 1.00 0.00 H new ATOM 0 HB3 GLN A 14 8.011 -1.586 9.808 1.00 0.00 H new ATOM 0 HG2 GLN A 14 6.491 -3.007 8.464 1.00 0.00 H new ATOM 0 HG3 GLN A 14 7.544 -2.853 7.072 1.00 0.00 H new ATOM 0 HE21 GLN A 14 7.102 -5.380 7.600 1.00 0.00 H new ATOM 0 HE22 GLN A 14 8.413 -6.143 8.506 1.00 0.00 H new ATOM 182 N ASP A 15 5.515 0.164 9.798 1.00 0.00 N ATOM 183 CA ASP A 15 4.124 0.351 10.246 1.00 0.00 C ATOM 184 C ASP A 15 3.440 1.541 9.542 1.00 0.00 C ATOM 185 O ASP A 15 2.219 1.558 9.386 1.00 0.00 O ATOM 186 CB ASP A 15 4.095 0.534 11.769 1.00 0.00 C ATOM 187 CG ASP A 15 4.564 -0.722 12.510 1.00 0.00 C ATOM 188 OD1 ASP A 15 3.710 -1.482 13.025 1.00 0.00 O ATOM 189 OD2 ASP A 15 5.785 -1.001 12.538 1.00 0.00 O ATOM 0 H ASP A 15 6.208 0.458 10.486 1.00 0.00 H new ATOM 0 HA ASP A 15 3.561 -0.542 9.975 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.731 1.375 12.045 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.082 0.783 12.084 1.00 0.00 H new ATOM 194 N ALA A 16 4.232 2.506 9.062 1.00 0.00 N ATOM 195 CA ALA A 16 3.806 3.598 8.184 1.00 0.00 C ATOM 196 C ALA A 16 3.798 3.206 6.688 1.00 0.00 C ATOM 197 O ALA A 16 3.528 4.045 5.829 1.00 0.00 O ATOM 198 CB ALA A 16 4.678 4.828 8.474 1.00 0.00 C ATOM 0 H ALA A 16 5.227 2.548 9.284 1.00 0.00 H new ATOM 0 HA ALA A 16 2.766 3.839 8.402 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.373 5.651 7.827 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.557 5.122 9.517 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.724 4.586 8.284 1.00 0.00 H new ATOM 204 N THR A 17 4.064 1.938 6.363 1.00 0.00 N ATOM 205 CA THR A 17 3.986 1.380 5.007 1.00 0.00 C ATOM 206 C THR A 17 2.830 0.385 4.940 1.00 0.00 C ATOM 207 O THR A 17 2.609 -0.398 5.866 1.00 0.00 O ATOM 208 CB THR A 17 5.322 0.743 4.580 1.00 0.00 C ATOM 209 OG1 THR A 17 6.364 1.684 4.700 1.00 0.00 O ATOM 210 CG2 THR A 17 5.359 0.278 3.120 1.00 0.00 C ATOM 0 H THR A 17 4.349 1.248 7.058 1.00 0.00 H new ATOM 0 HA THR A 17 3.794 2.186 4.299 1.00 0.00 H new ATOM 0 HB THR A 17 5.437 -0.121 5.235 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.525 1.874 5.648 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.334 -0.158 2.902 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.582 -0.469 2.956 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.187 1.130 2.462 1.00 0.00 H new ATOM 218 N VAL A 18 2.080 0.402 3.840 1.00 0.00 N ATOM 219 CA VAL A 18 1.009 -0.563 3.557 1.00 0.00 C ATOM 220 C VAL A 18 1.472 -1.562 2.501 1.00 0.00 C ATOM 221 O VAL A 18 2.222 -1.205 1.593 1.00 0.00 O ATOM 222 CB VAL A 18 -0.323 0.115 3.172 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.676 1.237 4.154 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.320 0.725 1.771 1.00 0.00 C ATOM 0 H VAL A 18 2.198 1.098 3.104 1.00 0.00 H new ATOM 0 HA VAL A 18 0.800 -1.106 4.479 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.059 -0.688 3.203 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.619 1.696 3.858 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.773 0.824 5.158 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.113 1.989 4.146 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.289 1.183 1.571 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.460 1.483 1.706 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.129 -0.056 1.035 1.00 0.00 H new ATOM 234 N TYR A 19 1.010 -2.802 2.611 1.00 0.00 N ATOM 235 CA TYR A 19 1.142 -3.855 1.607 1.00 0.00 C ATOM 236 C TYR A 19 -0.126 -3.896 0.745 1.00 0.00 C ATOM 237 O TYR A 19 -1.231 -3.763 1.276 1.00 0.00 O ATOM 238 CB TYR A 19 1.372 -5.197 2.318 1.00 0.00 C ATOM 239 CG TYR A 19 1.204 -6.407 1.417 1.00 0.00 C ATOM 240 CD1 TYR A 19 2.245 -6.795 0.556 1.00 0.00 C ATOM 241 CD2 TYR A 19 -0.016 -7.113 1.408 1.00 0.00 C ATOM 242 CE1 TYR A 19 2.076 -7.896 -0.306 1.00 0.00 C ATOM 243 CE2 TYR A 19 -0.194 -8.210 0.542 1.00 0.00 C ATOM 244 CZ TYR A 19 0.855 -8.605 -0.318 1.00 0.00 C ATOM 245 OH TYR A 19 0.700 -9.668 -1.154 1.00 0.00 O ATOM 0 H TYR A 19 0.509 -3.117 3.442 1.00 0.00 H new ATOM 0 HA TYR A 19 1.993 -3.656 0.955 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.377 -5.206 2.739 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.676 -5.279 3.153 1.00 0.00 H new ATOM 0 HD1 TYR A 19 3.176 -6.248 0.555 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.817 -6.812 2.067 1.00 0.00 H new ATOM 0 HE1 TYR A 19 2.882 -8.198 -0.959 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.130 -8.748 0.536 1.00 0.00 H new ATOM 0 HH TYR A 19 -0.197 -10.046 -1.039 1.00 0.00 H new ATOM 255 N VAL A 20 0.028 -4.105 -0.564 1.00 0.00 N ATOM 256 CA VAL A 20 -1.058 -4.209 -1.549 1.00 0.00 C ATOM 257 C VAL A 20 -0.831 -5.447 -2.420 1.00 0.00 C ATOM 258 O VAL A 20 0.096 -5.472 -3.227 1.00 0.00 O ATOM 259 CB VAL A 20 -1.136 -2.945 -2.436 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.373 -3.008 -3.341 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.202 -1.643 -1.628 1.00 0.00 C ATOM 0 H VAL A 20 0.950 -4.211 -0.987 1.00 0.00 H new ATOM 0 HA VAL A 20 -2.004 -4.299 -1.015 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.218 -2.934 -3.023 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.417 -2.112 -3.961 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.312 -3.889 -3.980 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.271 -3.068 -2.726 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.255 -0.794 -2.310 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.087 -1.654 -0.992 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.311 -1.555 -1.007 1.00 0.00 H new ATOM 271 N GLY A 21 -1.674 -6.469 -2.282 1.00 0.00 N ATOM 272 CA GLY A 21 -1.643 -7.690 -3.096 1.00 0.00 C ATOM 273 C GLY A 21 -2.795 -7.763 -4.101 1.00 0.00 C ATOM 274 O GLY A 21 -3.891 -7.272 -3.831 1.00 0.00 O ATOM 0 H GLY A 21 -2.418 -6.474 -1.584 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.695 -7.739 -3.632 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.684 -8.560 -2.440 1.00 0.00 H new ATOM 278 N GLY A 22 -2.561 -8.405 -5.247 1.00 0.00 N ATOM 279 CA GLY A 22 -3.582 -8.679 -6.273 1.00 0.00 C ATOM 280 C GLY A 22 -3.638 -7.631 -7.391 1.00 0.00 C ATOM 281 O GLY A 22 -4.714 -7.329 -7.906 1.00 0.00 O ATOM 0 H GLY A 22 -1.638 -8.759 -5.498 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.386 -9.656 -6.714 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.559 -8.736 -5.793 1.00 0.00 H new ATOM 285 N LEU A 23 -2.489 -7.056 -7.750 1.00 0.00 N ATOM 286 CA LEU A 23 -2.352 -5.962 -8.708 1.00 0.00 C ATOM 287 C LEU A 23 -2.542 -6.449 -10.147 1.00 0.00 C ATOM 288 O LEU A 23 -2.245 -7.600 -10.478 1.00 0.00 O ATOM 289 CB LEU A 23 -0.970 -5.305 -8.542 1.00 0.00 C ATOM 290 CG LEU A 23 -0.694 -4.685 -7.162 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.696 -4.058 -7.166 1.00 0.00 C ATOM 292 CD2 LEU A 23 -1.721 -3.617 -6.795 1.00 0.00 C ATOM 0 H LEU A 23 -1.593 -7.353 -7.364 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.132 -5.228 -8.506 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.204 -6.054 -8.744 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.863 -4.527 -9.298 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.761 -5.481 -6.420 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.899 -3.616 -6.190 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.441 -4.825 -7.379 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.744 -3.284 -7.932 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.485 -3.208 -5.813 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.696 -2.818 -7.536 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.716 -4.061 -6.774 1.00 0.00 H new ATOM 304 N ASP A 24 -3.005 -5.556 -11.015 1.00 0.00 N ATOM 305 CA ASP A 24 -3.145 -5.809 -12.449 1.00 0.00 C ATOM 306 C ASP A 24 -1.875 -5.411 -13.229 1.00 0.00 C ATOM 307 O ASP A 24 -1.107 -4.556 -12.789 1.00 0.00 O ATOM 308 CB ASP A 24 -4.398 -5.075 -12.951 1.00 0.00 C ATOM 309 CG ASP A 24 -4.626 -5.271 -14.453 1.00 0.00 C ATOM 310 OD1 ASP A 24 -4.152 -4.421 -15.242 1.00 0.00 O ATOM 311 OD2 ASP A 24 -5.251 -6.280 -14.848 1.00 0.00 O ATOM 0 H ASP A 24 -3.299 -4.619 -10.739 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.267 -6.878 -12.623 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.270 -5.434 -12.404 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.303 -4.011 -12.736 1.00 0.00 H new ATOM 316 N GLU A 25 -1.644 -5.993 -14.408 1.00 0.00 N ATOM 317 CA GLU A 25 -0.466 -5.712 -15.250 1.00 0.00 C ATOM 318 C GLU A 25 -0.305 -4.232 -15.668 1.00 0.00 C ATOM 319 O GLU A 25 0.810 -3.809 -15.990 1.00 0.00 O ATOM 320 CB GLU A 25 -0.473 -6.640 -16.478 1.00 0.00 C ATOM 321 CG GLU A 25 -1.639 -6.398 -17.448 1.00 0.00 C ATOM 322 CD GLU A 25 -1.569 -7.367 -18.643 1.00 0.00 C ATOM 323 OE1 GLU A 25 -0.981 -7.005 -19.693 1.00 0.00 O ATOM 324 OE2 GLU A 25 -2.104 -8.499 -18.548 1.00 0.00 O ATOM 0 H GLU A 25 -2.275 -6.683 -14.815 1.00 0.00 H new ATOM 0 HA GLU A 25 0.406 -5.916 -14.629 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.465 -6.515 -17.018 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.509 -7.675 -16.137 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.586 -6.528 -16.924 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.612 -5.369 -17.807 1.00 0.00 H new ATOM 331 N LYS A 26 -1.379 -3.428 -15.626 1.00 0.00 N ATOM 332 CA LYS A 26 -1.353 -1.976 -15.895 1.00 0.00 C ATOM 333 C LYS A 26 -0.898 -1.123 -14.697 1.00 0.00 C ATOM 334 O LYS A 26 -0.609 0.063 -14.871 1.00 0.00 O ATOM 335 CB LYS A 26 -2.733 -1.531 -16.410 1.00 0.00 C ATOM 336 CG LYS A 26 -3.065 -2.171 -17.769 1.00 0.00 C ATOM 337 CD LYS A 26 -4.420 -1.719 -18.337 1.00 0.00 C ATOM 338 CE LYS A 26 -5.638 -2.097 -17.481 1.00 0.00 C ATOM 339 NZ LYS A 26 -5.772 -3.565 -17.300 1.00 0.00 N ATOM 0 H LYS A 26 -2.311 -3.774 -15.399 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.596 -1.805 -16.660 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.498 -1.803 -15.683 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.754 -0.445 -16.504 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.279 -1.923 -18.482 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.067 -3.256 -17.662 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.403 -0.636 -18.460 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.544 -2.151 -19.330 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.554 -1.620 -16.505 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.542 -1.708 -17.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.780 -3.819 -17.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.322 -4.056 -18.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.308 -3.849 -16.414 1.00 0.00 H new ATOM 353 N VAL A 27 -0.812 -1.695 -13.492 1.00 0.00 N ATOM 354 CA VAL A 27 -0.357 -1.006 -12.268 1.00 0.00 C ATOM 355 C VAL A 27 1.158 -0.772 -12.283 1.00 0.00 C ATOM 356 O VAL A 27 1.922 -1.641 -12.706 1.00 0.00 O ATOM 357 CB VAL A 27 -0.769 -1.788 -11.002 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.308 -1.101 -9.712 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.294 -1.948 -10.918 1.00 0.00 C ATOM 0 H VAL A 27 -1.061 -2.671 -13.331 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.847 -0.033 -12.246 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.283 -2.760 -11.089 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.623 -1.692 -8.852 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.779 -1.015 -9.714 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.751 -0.107 -9.651 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.553 -2.503 -10.016 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.762 -0.964 -10.886 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.652 -2.491 -11.793 1.00 0.00 H new ATOM 369 N SER A 28 1.596 0.385 -11.776 1.00 0.00 N ATOM 370 CA SER A 28 3.013 0.679 -11.502 1.00 0.00 C ATOM 371 C SER A 28 3.180 1.540 -10.242 1.00 0.00 C ATOM 372 O SER A 28 2.218 2.123 -9.742 1.00 0.00 O ATOM 373 CB SER A 28 3.654 1.348 -12.724 1.00 0.00 C ATOM 374 OG SER A 28 5.066 1.260 -12.639 1.00 0.00 O ATOM 0 H SER A 28 0.971 1.156 -11.540 1.00 0.00 H new ATOM 0 HA SER A 28 3.527 -0.263 -11.311 1.00 0.00 H new ATOM 0 HB2 SER A 28 3.306 0.866 -13.637 1.00 0.00 H new ATOM 0 HB3 SER A 28 3.349 2.393 -12.779 1.00 0.00 H new ATOM 0 HG SER A 28 5.468 1.688 -13.424 1.00 0.00 H new ATOM 380 N GLU A 29 4.401 1.660 -9.725 1.00 0.00 N ATOM 381 CA GLU A 29 4.717 2.438 -8.516 1.00 0.00 C ATOM 382 C GLU A 29 4.231 3.905 -8.523 1.00 0.00 C ATOM 383 O GLU A 29 3.690 4.330 -7.497 1.00 0.00 O ATOM 384 CB GLU A 29 6.239 2.395 -8.287 1.00 0.00 C ATOM 385 CG GLU A 29 6.660 1.154 -7.489 1.00 0.00 C ATOM 386 CD GLU A 29 7.974 0.528 -7.999 1.00 0.00 C ATOM 387 OE1 GLU A 29 8.877 0.245 -7.179 1.00 0.00 O ATOM 388 OE2 GLU A 29 8.088 0.240 -9.215 1.00 0.00 O ATOM 0 H GLU A 29 5.219 1.212 -10.139 1.00 0.00 H new ATOM 0 HA GLU A 29 4.165 1.966 -7.703 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.752 2.400 -9.249 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.552 3.293 -7.754 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.776 1.426 -6.440 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.866 0.409 -7.539 1.00 0.00 H new ATOM 395 N PRO A 30 4.351 4.698 -9.613 1.00 0.00 N ATOM 396 CA PRO A 30 3.819 6.062 -9.633 1.00 0.00 C ATOM 397 C PRO A 30 2.285 6.107 -9.662 1.00 0.00 C ATOM 398 O PRO A 30 1.702 7.075 -9.169 1.00 0.00 O ATOM 399 CB PRO A 30 4.434 6.732 -10.860 1.00 0.00 C ATOM 400 CG PRO A 30 4.684 5.568 -11.807 1.00 0.00 C ATOM 401 CD PRO A 30 5.062 4.432 -10.860 1.00 0.00 C ATOM 0 HA PRO A 30 4.084 6.588 -8.716 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.759 7.468 -11.297 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.358 7.254 -10.612 1.00 0.00 H new ATOM 0 HG2 PRO A 30 3.797 5.327 -12.393 1.00 0.00 H new ATOM 0 HG3 PRO A 30 5.484 5.787 -12.514 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.775 3.466 -11.275 1.00 0.00 H new ATOM 0 HD3 PRO A 30 6.139 4.402 -10.697 1.00 0.00 H new ATOM 409 N LEU A 31 1.618 5.055 -10.165 1.00 0.00 N ATOM 410 CA LEU A 31 0.164 4.924 -10.041 1.00 0.00 C ATOM 411 C LEU A 31 -0.202 4.752 -8.572 1.00 0.00 C ATOM 412 O LEU A 31 -1.004 5.526 -8.061 1.00 0.00 O ATOM 413 CB LEU A 31 -0.382 3.740 -10.858 1.00 0.00 C ATOM 414 CG LEU A 31 -1.919 3.607 -10.773 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.591 4.639 -11.664 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.319 2.217 -11.250 1.00 0.00 C ATOM 0 H LEU A 31 2.066 4.285 -10.661 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.290 5.831 -10.440 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.090 3.860 -11.901 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.077 2.818 -10.503 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.233 3.767 -9.741 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.673 4.532 -11.593 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.304 5.640 -11.342 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.279 4.486 -12.697 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.402 2.111 -11.195 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.993 2.078 -12.281 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.848 1.465 -10.616 1.00 0.00 H new ATOM 428 N LEU A 32 0.405 3.770 -7.894 1.00 0.00 N ATOM 429 CA LEU A 32 0.119 3.497 -6.484 1.00 0.00 C ATOM 430 C LEU A 32 0.315 4.748 -5.626 1.00 0.00 C ATOM 431 O LEU A 32 -0.528 5.050 -4.791 1.00 0.00 O ATOM 432 CB LEU A 32 1.012 2.368 -5.940 1.00 0.00 C ATOM 433 CG LEU A 32 0.829 0.989 -6.584 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.557 -0.062 -5.751 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.637 0.577 -6.640 1.00 0.00 C ATOM 0 H LEU A 32 1.102 3.149 -8.305 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.924 3.185 -6.428 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.053 2.667 -6.061 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.830 2.273 -4.870 1.00 0.00 H new ATOM 0 HG LEU A 32 1.227 1.054 -7.597 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.427 -1.043 -6.208 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.619 0.180 -5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.146 -0.075 -4.742 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.721 -0.406 -7.104 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.043 0.537 -5.629 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.197 1.304 -7.228 1.00 0.00 H new ATOM 447 N TRP A 33 1.378 5.509 -5.882 1.00 0.00 N ATOM 448 CA TRP A 33 1.664 6.754 -5.174 1.00 0.00 C ATOM 449 C TRP A 33 0.509 7.750 -5.309 1.00 0.00 C ATOM 450 O TRP A 33 -0.137 8.094 -4.320 1.00 0.00 O ATOM 451 CB TRP A 33 2.981 7.325 -5.712 1.00 0.00 C ATOM 452 CG TRP A 33 3.650 8.403 -4.918 1.00 0.00 C ATOM 453 CD1 TRP A 33 3.074 9.459 -4.295 1.00 0.00 C ATOM 454 CD2 TRP A 33 5.080 8.541 -4.688 1.00 0.00 C ATOM 455 NE1 TRP A 33 4.052 10.222 -3.679 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.313 9.709 -3.905 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.202 7.788 -5.085 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.603 10.113 -3.536 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.504 8.184 -4.725 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.705 9.346 -3.956 1.00 0.00 C ATOM 0 H TRP A 33 2.071 5.276 -6.593 1.00 0.00 H new ATOM 0 HA TRP A 33 1.769 6.557 -4.107 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.686 6.500 -5.817 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.794 7.714 -6.713 1.00 0.00 H new ATOM 0 HD1 TRP A 33 2.015 9.673 -4.281 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.864 11.059 -3.127 1.00 0.00 H new ATOM 0 HE3 TRP A 33 6.061 6.894 -5.674 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.749 11.000 -2.938 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.352 7.594 -5.040 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.706 9.649 -3.688 1.00 0.00 H new ATOM 471 N GLU A 34 0.211 8.178 -6.536 1.00 0.00 N ATOM 472 CA GLU A 34 -0.833 9.176 -6.814 1.00 0.00 C ATOM 473 C GLU A 34 -2.254 8.705 -6.459 1.00 0.00 C ATOM 474 O GLU A 34 -3.098 9.519 -6.079 1.00 0.00 O ATOM 475 CB GLU A 34 -0.774 9.590 -8.292 1.00 0.00 C ATOM 476 CG GLU A 34 0.503 10.379 -8.598 1.00 0.00 C ATOM 477 CD GLU A 34 0.428 11.047 -9.985 1.00 0.00 C ATOM 478 OE1 GLU A 34 -0.039 12.209 -10.077 1.00 0.00 O ATOM 479 OE2 GLU A 34 0.841 10.427 -10.996 1.00 0.00 O ATOM 0 H GLU A 34 0.688 7.843 -7.373 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.624 10.028 -6.167 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.815 8.702 -8.923 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.646 10.196 -8.537 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.655 11.140 -7.833 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.364 9.712 -8.559 1.00 0.00 H new ATOM 486 N LEU A 35 -2.517 7.400 -6.533 1.00 0.00 N ATOM 487 CA LEU A 35 -3.798 6.791 -6.155 1.00 0.00 C ATOM 488 C LEU A 35 -4.007 6.792 -4.629 1.00 0.00 C ATOM 489 O LEU A 35 -5.128 6.997 -4.164 1.00 0.00 O ATOM 490 CB LEU A 35 -3.854 5.358 -6.723 1.00 0.00 C ATOM 491 CG LEU A 35 -5.269 4.773 -6.819 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.014 5.280 -8.054 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.217 3.248 -6.850 1.00 0.00 C ATOM 0 H LEU A 35 -1.833 6.720 -6.864 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.609 7.385 -6.577 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.404 5.355 -7.716 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.246 4.707 -6.095 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.812 5.104 -5.934 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.011 4.841 -8.083 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.097 6.366 -8.009 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.466 4.995 -8.952 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.230 2.851 -6.918 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.640 2.921 -7.715 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.744 2.881 -5.939 1.00 0.00 H new ATOM 505 N PHE A 36 -2.948 6.588 -3.840 1.00 0.00 N ATOM 506 CA PHE A 36 -2.994 6.485 -2.375 1.00 0.00 C ATOM 507 C PHE A 36 -2.862 7.842 -1.662 1.00 0.00 C ATOM 508 O PHE A 36 -3.177 7.933 -0.474 1.00 0.00 O ATOM 509 CB PHE A 36 -1.959 5.454 -1.903 1.00 0.00 C ATOM 510 CG PHE A 36 -2.414 3.997 -1.955 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.678 3.361 -3.184 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.555 3.259 -0.763 1.00 0.00 C ATOM 513 CE1 PHE A 36 -3.072 2.011 -3.225 1.00 0.00 C ATOM 514 CE2 PHE A 36 -2.980 1.917 -0.799 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.240 1.293 -2.029 1.00 0.00 C ATOM 0 H PHE A 36 -2.004 6.487 -4.213 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.986 6.133 -2.091 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.062 5.559 -2.514 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.676 5.692 -0.878 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.577 3.916 -4.105 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.335 3.726 0.186 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.245 1.527 -4.175 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.106 1.367 0.122 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.568 0.264 -2.056 1.00 0.00 H new ATOM 525 N LEU A 37 -2.513 8.918 -2.382 1.00 0.00 N ATOM 526 CA LEU A 37 -2.577 10.306 -1.887 1.00 0.00 C ATOM 527 C LEU A 37 -3.960 10.709 -1.326 1.00 0.00 C ATOM 528 O LEU A 37 -4.063 11.635 -0.521 1.00 0.00 O ATOM 529 CB LEU A 37 -2.190 11.270 -3.024 1.00 0.00 C ATOM 530 CG LEU A 37 -0.688 11.392 -3.332 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.472 12.414 -4.448 1.00 0.00 C ATOM 532 CD2 LEU A 37 0.119 11.845 -2.118 1.00 0.00 C ATOM 0 H LEU A 37 -2.172 8.850 -3.341 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.875 10.370 -1.055 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.701 10.950 -3.932 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.570 12.261 -2.777 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.345 10.401 -3.629 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.593 12.498 -4.663 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.999 12.090 -5.345 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.856 13.384 -4.132 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.173 11.916 -2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.237 12.821 -1.788 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.002 11.123 -1.311 1.00 0.00 H new ATOM 544 N GLN A 38 -5.018 9.996 -1.723 1.00 0.00 N ATOM 545 CA GLN A 38 -6.387 10.149 -1.204 1.00 0.00 C ATOM 546 C GLN A 38 -6.493 9.813 0.293 1.00 0.00 C ATOM 547 O GLN A 38 -7.303 10.409 1.006 1.00 0.00 O ATOM 548 CB GLN A 38 -7.350 9.231 -1.977 1.00 0.00 C ATOM 549 CG GLN A 38 -7.289 9.464 -3.488 1.00 0.00 C ATOM 550 CD GLN A 38 -8.297 8.604 -4.244 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.448 8.972 -4.453 1.00 0.00 O ATOM 552 NE2 GLN A 38 -7.911 7.421 -4.670 1.00 0.00 N ATOM 0 H GLN A 38 -4.946 9.272 -2.438 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.655 11.197 -1.339 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.107 8.190 -1.762 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.368 9.399 -1.627 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.480 10.516 -3.700 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.284 9.244 -3.848 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.956 7.105 -4.502 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.567 6.820 -5.169 1.00 0.00 H new ATOM 561 N ALA A 39 -5.675 8.869 0.770 1.00 0.00 N ATOM 562 CA ALA A 39 -5.622 8.489 2.181 1.00 0.00 C ATOM 563 C ALA A 39 -4.818 9.489 3.031 1.00 0.00 C ATOM 564 O ALA A 39 -5.247 9.871 4.121 1.00 0.00 O ATOM 565 CB ALA A 39 -5.009 7.093 2.282 1.00 0.00 C ATOM 0 H ALA A 39 -5.027 8.345 0.182 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.637 8.494 2.578 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.961 6.792 3.328 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.625 6.384 1.728 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.003 7.106 1.862 1.00 0.00 H new ATOM 571 N GLY A 40 -3.657 9.914 2.526 1.00 0.00 N ATOM 572 CA GLY A 40 -2.746 10.839 3.202 1.00 0.00 C ATOM 573 C GLY A 40 -1.457 11.099 2.410 1.00 0.00 C ATOM 574 O GLY A 40 -1.335 10.645 1.270 1.00 0.00 O ATOM 0 H GLY A 40 -3.317 9.616 1.612 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.259 11.786 3.372 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.489 10.436 4.181 1.00 0.00 H new ATOM 578 N PRO A 41 -0.479 11.817 2.987 1.00 0.00 N ATOM 579 CA PRO A 41 0.782 12.152 2.326 1.00 0.00 C ATOM 580 C PRO A 41 1.650 10.905 2.091 1.00 0.00 C ATOM 581 O PRO A 41 2.204 10.321 3.028 1.00 0.00 O ATOM 582 CB PRO A 41 1.456 13.182 3.241 1.00 0.00 C ATOM 583 CG PRO A 41 0.888 12.856 4.621 1.00 0.00 C ATOM 584 CD PRO A 41 -0.538 12.407 4.314 1.00 0.00 C ATOM 0 HA PRO A 41 0.624 12.562 1.329 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.542 13.087 3.221 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.219 14.203 2.940 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.459 12.071 5.116 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.904 13.725 5.279 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.889 11.684 5.050 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -1.229 13.249 4.339 1.00 0.00 H new ATOM 592 N VAL A 42 1.783 10.515 0.820 1.00 0.00 N ATOM 593 CA VAL A 42 2.659 9.425 0.361 1.00 0.00 C ATOM 594 C VAL A 42 4.076 9.957 0.124 1.00 0.00 C ATOM 595 O VAL A 42 4.269 11.014 -0.482 1.00 0.00 O ATOM 596 CB VAL A 42 2.107 8.735 -0.903 1.00 0.00 C ATOM 597 CG1 VAL A 42 3.042 7.616 -1.382 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.726 8.114 -0.659 1.00 0.00 C ATOM 0 H VAL A 42 1.271 10.959 0.058 1.00 0.00 H new ATOM 0 HA VAL A 42 2.692 8.668 1.144 1.00 0.00 H new ATOM 0 HB VAL A 42 2.031 9.515 -1.660 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.624 7.150 -2.274 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.021 8.035 -1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.146 6.867 -0.596 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.374 7.639 -1.574 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.797 7.368 0.133 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.024 8.893 -0.362 1.00 0.00 H new ATOM 608 N VAL A 43 5.063 9.203 0.604 1.00 0.00 N ATOM 609 CA VAL A 43 6.491 9.565 0.655 1.00 0.00 C ATOM 610 C VAL A 43 7.327 8.736 -0.329 1.00 0.00 C ATOM 611 O VAL A 43 8.322 9.231 -0.861 1.00 0.00 O ATOM 612 CB VAL A 43 7.028 9.359 2.091 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.395 10.013 2.313 1.00 0.00 C ATOM 614 CG2 VAL A 43 6.095 9.941 3.156 1.00 0.00 C ATOM 0 H VAL A 43 4.887 8.275 0.989 1.00 0.00 H new ATOM 0 HA VAL A 43 6.579 10.613 0.367 1.00 0.00 H new ATOM 0 HB VAL A 43 7.102 8.276 2.192 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.721 9.836 3.338 1.00 0.00 H new ATOM 0 HG12 VAL A 43 9.120 9.584 1.622 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.318 11.086 2.138 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.520 9.769 4.145 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.979 11.012 2.992 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.121 9.457 3.090 1.00 0.00 H new ATOM 624 N ASN A 44 6.946 7.471 -0.541 1.00 0.00 N ATOM 625 CA ASN A 44 7.664 6.484 -1.355 1.00 0.00 C ATOM 626 C ASN A 44 6.728 5.315 -1.765 1.00 0.00 C ATOM 627 O ASN A 44 5.702 5.078 -1.125 1.00 0.00 O ATOM 628 CB ASN A 44 8.884 6.034 -0.520 1.00 0.00 C ATOM 629 CG ASN A 44 9.660 4.866 -1.098 1.00 0.00 C ATOM 630 OD1 ASN A 44 10.041 4.860 -2.261 1.00 0.00 O ATOM 631 ND2 ASN A 44 9.920 3.851 -0.306 1.00 0.00 N ATOM 0 H ASN A 44 6.092 7.091 -0.132 1.00 0.00 H new ATOM 0 HA ASN A 44 8.008 6.906 -2.299 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.561 6.881 -0.408 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.542 5.765 0.479 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.443 3.050 -0.659 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.599 3.864 0.662 1.00 0.00 H new ATOM 638 N THR A 45 7.094 4.555 -2.800 1.00 0.00 N ATOM 639 CA THR A 45 6.429 3.308 -3.236 1.00 0.00 C ATOM 640 C THR A 45 7.442 2.221 -3.608 1.00 0.00 C ATOM 641 O THR A 45 8.579 2.521 -3.983 1.00 0.00 O ATOM 642 CB THR A 45 5.486 3.521 -4.436 1.00 0.00 C ATOM 643 OG1 THR A 45 6.040 4.364 -5.417 1.00 0.00 O ATOM 644 CG2 THR A 45 4.154 4.121 -4.023 1.00 0.00 C ATOM 0 H THR A 45 7.894 4.795 -3.386 1.00 0.00 H new ATOM 0 HA THR A 45 5.839 2.987 -2.377 1.00 0.00 H new ATOM 0 HB THR A 45 5.336 2.523 -4.848 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.416 4.446 -6.168 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.525 4.252 -4.904 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.657 3.454 -3.318 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.322 5.089 -3.550 1.00 0.00 H new ATOM 652 N HIS A 46 7.041 0.947 -3.508 1.00 0.00 N ATOM 653 CA HIS A 46 7.881 -0.202 -3.872 1.00 0.00 C ATOM 654 C HIS A 46 7.059 -1.312 -4.540 1.00 0.00 C ATOM 655 O HIS A 46 6.031 -1.714 -4.001 1.00 0.00 O ATOM 656 CB HIS A 46 8.596 -0.732 -2.615 1.00 0.00 C ATOM 657 CG HIS A 46 9.864 -1.487 -2.935 1.00 0.00 C ATOM 658 ND1 HIS A 46 9.953 -2.624 -3.743 1.00 0.00 N ATOM 659 CD2 HIS A 46 11.116 -1.157 -2.503 1.00 0.00 C ATOM 660 CE1 HIS A 46 11.255 -2.954 -3.778 1.00 0.00 C ATOM 661 NE2 HIS A 46 11.976 -2.091 -3.041 1.00 0.00 N ATOM 0 H HIS A 46 6.116 0.682 -3.169 1.00 0.00 H new ATOM 0 HA HIS A 46 8.624 0.128 -4.598 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.833 0.105 -1.958 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.918 -1.386 -2.066 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.381 -0.327 -1.865 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.664 -3.793 -4.321 1.00 0.00 H new ATOM 0 HE2 HIS A 46 12.986 -2.122 -2.903 1.00 0.00 H new ATOM 669 N MET A 47 7.494 -1.836 -5.685 1.00 0.00 N ATOM 670 CA MET A 47 6.929 -3.036 -6.322 1.00 0.00 C ATOM 671 C MET A 47 8.069 -3.967 -6.769 1.00 0.00 C ATOM 672 O MET A 47 8.695 -3.690 -7.797 1.00 0.00 O ATOM 673 CB MET A 47 6.024 -2.642 -7.505 1.00 0.00 C ATOM 674 CG MET A 47 4.675 -2.086 -7.030 1.00 0.00 C ATOM 675 SD MET A 47 3.632 -1.301 -8.287 1.00 0.00 S ATOM 676 CE MET A 47 3.377 -2.695 -9.399 1.00 0.00 C ATOM 0 H MET A 47 8.268 -1.432 -6.212 1.00 0.00 H new ATOM 0 HA MET A 47 6.310 -3.572 -5.602 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.530 -1.895 -8.117 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.855 -3.512 -8.139 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.110 -2.902 -6.580 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.865 -1.357 -6.242 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.326 -2.747 -9.682 1.00 0.00 H new ATOM 0 HE2 MET A 47 3.987 -2.564 -10.293 1.00 0.00 H new ATOM 0 HE3 MET A 47 3.663 -3.619 -8.896 1.00 0.00 H new ATOM 686 N PRO A 48 8.364 -5.061 -6.038 1.00 0.00 N ATOM 687 CA PRO A 48 9.455 -5.978 -6.378 1.00 0.00 C ATOM 688 C PRO A 48 9.269 -6.658 -7.745 1.00 0.00 C ATOM 689 O PRO A 48 8.219 -7.252 -8.019 1.00 0.00 O ATOM 690 CB PRO A 48 9.519 -6.988 -5.226 1.00 0.00 C ATOM 691 CG PRO A 48 8.964 -6.196 -4.045 1.00 0.00 C ATOM 692 CD PRO A 48 7.866 -5.360 -4.701 1.00 0.00 C ATOM 0 HA PRO A 48 10.395 -5.436 -6.486 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.921 -7.876 -5.434 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.539 -7.326 -5.042 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.568 -6.849 -3.267 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.727 -5.572 -3.579 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.925 -5.909 -4.744 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.676 -4.446 -4.138 1.00 0.00 H new ATOM 700 N LYS A 49 10.296 -6.597 -8.602 1.00 0.00 N ATOM 701 CA LYS A 49 10.245 -7.060 -10.002 1.00 0.00 C ATOM 702 C LYS A 49 10.697 -8.514 -10.187 1.00 0.00 C ATOM 703 O LYS A 49 11.544 -9.026 -9.456 1.00 0.00 O ATOM 704 CB LYS A 49 11.057 -6.124 -10.922 1.00 0.00 C ATOM 705 CG LYS A 49 10.701 -4.628 -10.845 1.00 0.00 C ATOM 706 CD LYS A 49 9.214 -4.322 -11.101 1.00 0.00 C ATOM 707 CE LYS A 49 8.922 -2.815 -11.204 1.00 0.00 C ATOM 708 NZ LYS A 49 9.349 -2.072 -9.992 1.00 0.00 N ATOM 0 H LYS A 49 11.206 -6.217 -8.340 1.00 0.00 H new ATOM 0 HA LYS A 49 9.194 -7.026 -10.287 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.114 -6.239 -10.682 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.926 -6.456 -11.952 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.974 -4.251 -9.860 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.303 -4.084 -11.573 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.901 -4.811 -12.023 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.617 -4.748 -10.295 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.434 -2.407 -12.076 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.854 -2.665 -11.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.811 -1.185 -9.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.171 -2.653 -9.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.365 -1.857 -10.056 1.00 0.00 H new ATOM 722 N ASP A 50 10.148 -9.155 -11.214 1.00 0.00 N ATOM 723 CA ASP A 50 10.508 -10.489 -11.701 1.00 0.00 C ATOM 724 C ASP A 50 11.934 -10.533 -12.292 1.00 0.00 C ATOM 725 O ASP A 50 12.361 -9.610 -12.989 1.00 0.00 O ATOM 726 CB ASP A 50 9.471 -10.903 -12.755 1.00 0.00 C ATOM 727 CG ASP A 50 9.827 -12.244 -13.392 1.00 0.00 C ATOM 728 OD1 ASP A 50 9.601 -13.302 -12.763 1.00 0.00 O ATOM 729 OD2 ASP A 50 10.396 -12.208 -14.505 1.00 0.00 O ATOM 0 H ASP A 50 9.397 -8.736 -11.762 1.00 0.00 H new ATOM 0 HA ASP A 50 10.505 -11.186 -10.863 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.486 -10.969 -12.292 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.410 -10.137 -13.528 1.00 0.00 H new ATOM 734 N ARG A 51 12.661 -11.634 -12.059 1.00 0.00 N ATOM 735 CA ARG A 51 14.080 -11.801 -12.440 1.00 0.00 C ATOM 736 C ARG A 51 14.340 -12.254 -13.890 1.00 0.00 C ATOM 737 O ARG A 51 15.483 -12.573 -14.224 1.00 0.00 O ATOM 738 CB ARG A 51 14.801 -12.667 -11.390 1.00 0.00 C ATOM 739 CG ARG A 51 14.356 -14.140 -11.398 1.00 0.00 C ATOM 740 CD ARG A 51 15.067 -14.953 -10.310 1.00 0.00 C ATOM 741 NE ARG A 51 16.521 -15.075 -10.549 1.00 0.00 N ATOM 742 CZ ARG A 51 17.138 -15.937 -11.340 1.00 0.00 C ATOM 743 NH1 ARG A 51 16.494 -16.833 -12.036 1.00 0.00 N ATOM 744 NH2 ARG A 51 18.435 -15.917 -11.450 1.00 0.00 N ATOM 0 H ARG A 51 12.276 -12.454 -11.591 1.00 0.00 H new ATOM 0 HA ARG A 51 14.514 -10.801 -12.438 1.00 0.00 H new ATOM 0 HB2 ARG A 51 15.875 -12.619 -11.567 1.00 0.00 H new ATOM 0 HB3 ARG A 51 14.622 -12.247 -10.400 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.278 -14.195 -11.247 1.00 0.00 H new ATOM 0 HG3 ARG A 51 14.564 -14.578 -12.374 1.00 0.00 H new ATOM 0 HD2 ARG A 51 14.900 -14.481 -9.342 1.00 0.00 H new ATOM 0 HD3 ARG A 51 14.626 -15.949 -10.259 1.00 0.00 H new ATOM 0 HE ARG A 51 17.117 -14.418 -10.046 1.00 0.00 H new ATOM 0 HH11 ARG A 51 15.477 -16.887 -11.982 1.00 0.00 H new ATOM 0 HH12 ARG A 51 17.008 -17.480 -12.635 1.00 0.00 H new ATOM 0 HH21 ARG A 51 18.981 -15.234 -10.925 1.00 0.00 H new ATOM 0 HH22 ARG A 51 18.905 -16.584 -12.062 1.00 0.00 H new ATOM 758 N VAL A 52 13.313 -12.306 -14.746 1.00 0.00 N ATOM 759 CA VAL A 52 13.386 -12.844 -16.124 1.00 0.00 C ATOM 760 C VAL A 52 12.757 -11.882 -17.136 1.00 0.00 C ATOM 761 O VAL A 52 13.286 -11.708 -18.235 1.00 0.00 O ATOM 762 CB VAL A 52 12.701 -14.231 -16.214 1.00 0.00 C ATOM 763 CG1 VAL A 52 12.888 -14.870 -17.596 1.00 0.00 C ATOM 764 CG2 VAL A 52 13.250 -15.221 -15.176 1.00 0.00 C ATOM 0 H VAL A 52 12.382 -11.969 -14.501 1.00 0.00 H new ATOM 0 HA VAL A 52 14.442 -12.957 -16.371 1.00 0.00 H new ATOM 0 HB VAL A 52 11.645 -14.041 -16.023 1.00 0.00 H new ATOM 0 HG11 VAL A 52 12.393 -15.841 -17.618 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.452 -14.223 -18.358 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.952 -15.000 -17.796 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.738 -16.178 -15.280 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.319 -15.362 -15.337 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.083 -14.827 -14.174 1.00 0.00 H new ATOM 774 N THR A 53 11.658 -11.222 -16.760 1.00 0.00 N ATOM 775 CA THR A 53 10.871 -10.320 -17.615 1.00 0.00 C ATOM 776 C THR A 53 10.877 -8.878 -17.108 1.00 0.00 C ATOM 777 O THR A 53 10.542 -7.955 -17.853 1.00 0.00 O ATOM 778 CB THR A 53 9.414 -10.795 -17.733 1.00 0.00 C ATOM 779 OG1 THR A 53 8.775 -10.791 -16.471 1.00 0.00 O ATOM 780 CG2 THR A 53 9.287 -12.204 -18.311 1.00 0.00 C ATOM 0 H THR A 53 11.275 -11.302 -15.818 1.00 0.00 H new ATOM 0 HA THR A 53 11.350 -10.345 -18.594 1.00 0.00 H new ATOM 0 HB THR A 53 8.937 -10.091 -18.415 1.00 0.00 H new ATOM 0 HG1 THR A 53 9.298 -11.325 -15.838 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.234 -12.480 -18.368 1.00 0.00 H new ATOM 0 HG22 THR A 53 9.724 -12.228 -19.309 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.813 -12.910 -17.668 1.00 0.00 H new ATOM 788 N GLY A 54 11.246 -8.673 -15.839 1.00 0.00 N ATOM 789 CA GLY A 54 11.277 -7.370 -15.181 1.00 0.00 C ATOM 790 C GLY A 54 9.896 -6.759 -14.886 1.00 0.00 C ATOM 791 O GLY A 54 9.811 -5.596 -14.486 1.00 0.00 O ATOM 0 H GLY A 54 11.539 -9.434 -15.227 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.823 -7.466 -14.243 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.838 -6.677 -15.807 1.00 0.00 H new ATOM 795 N GLN A 55 8.816 -7.527 -15.071 1.00 0.00 N ATOM 796 CA GLN A 55 7.442 -7.158 -14.706 1.00 0.00 C ATOM 797 C GLN A 55 7.263 -7.148 -13.178 1.00 0.00 C ATOM 798 O GLN A 55 8.060 -7.747 -12.454 1.00 0.00 O ATOM 799 CB GLN A 55 6.465 -8.162 -15.343 1.00 0.00 C ATOM 800 CG GLN A 55 6.517 -8.184 -16.880 1.00 0.00 C ATOM 801 CD GLN A 55 5.599 -9.262 -17.449 1.00 0.00 C ATOM 802 OE1 GLN A 55 4.506 -9.002 -17.938 1.00 0.00 O ATOM 803 NE2 GLN A 55 6.000 -10.515 -17.398 1.00 0.00 N ATOM 0 H GLN A 55 8.876 -8.454 -15.493 1.00 0.00 H new ATOM 0 HA GLN A 55 7.236 -6.154 -15.076 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.687 -9.160 -14.966 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.451 -7.920 -15.026 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.223 -7.210 -17.270 1.00 0.00 H new ATOM 0 HG3 GLN A 55 7.540 -8.364 -17.209 1.00 0.00 H new ATOM 0 HE21 GLN A 55 6.908 -10.744 -16.993 1.00 0.00 H new ATOM 0 HE22 GLN A 55 5.403 -11.257 -17.763 1.00 0.00 H new ATOM 812 N HIS A 56 6.208 -6.514 -12.655 1.00 0.00 N ATOM 813 CA HIS A 56 5.860 -6.657 -11.231 1.00 0.00 C ATOM 814 C HIS A 56 5.272 -8.048 -10.930 1.00 0.00 C ATOM 815 O HIS A 56 4.735 -8.719 -11.815 1.00 0.00 O ATOM 816 CB HIS A 56 4.966 -5.503 -10.753 1.00 0.00 C ATOM 817 CG HIS A 56 3.511 -5.601 -11.144 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.582 -6.475 -10.571 1.00 0.00 N ATOM 819 CD2 HIS A 56 2.863 -4.788 -12.029 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.401 -6.180 -11.139 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.539 -5.165 -12.004 1.00 0.00 N ATOM 0 H HIS A 56 5.586 -5.904 -13.185 1.00 0.00 H new ATOM 0 HA HIS A 56 6.779 -6.588 -10.650 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.029 -5.444 -9.666 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.367 -4.569 -11.146 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.302 -4.005 -12.629 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.472 -6.689 -10.929 1.00 0.00 H new ATOM 0 HE2 HIS A 56 0.789 -4.743 -12.552 1.00 0.00 H new ATOM 829 N GLN A 57 5.390 -8.492 -9.677 1.00 0.00 N ATOM 830 CA GLN A 57 5.055 -9.861 -9.248 1.00 0.00 C ATOM 831 C GLN A 57 3.630 -9.998 -8.661 1.00 0.00 C ATOM 832 O GLN A 57 3.345 -10.929 -7.906 1.00 0.00 O ATOM 833 CB GLN A 57 6.167 -10.379 -8.319 1.00 0.00 C ATOM 834 CG GLN A 57 7.505 -10.531 -9.064 1.00 0.00 C ATOM 835 CD GLN A 57 8.633 -10.923 -8.118 1.00 0.00 C ATOM 836 OE1 GLN A 57 9.102 -12.053 -8.084 1.00 0.00 O ATOM 837 NE2 GLN A 57 9.103 -9.999 -7.311 1.00 0.00 N ATOM 0 H GLN A 57 5.727 -7.904 -8.915 1.00 0.00 H new ATOM 0 HA GLN A 57 5.018 -10.502 -10.128 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.292 -9.692 -7.482 1.00 0.00 H new ATOM 0 HB3 GLN A 57 5.872 -11.341 -7.900 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.404 -11.286 -9.843 1.00 0.00 H new ATOM 0 HG3 GLN A 57 7.755 -9.593 -9.560 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.716 -9.056 -7.335 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.855 -10.225 -6.660 1.00 0.00 H new ATOM 846 N GLY A 58 2.724 -9.072 -8.997 1.00 0.00 N ATOM 847 CA GLY A 58 1.325 -9.058 -8.546 1.00 0.00 C ATOM 848 C GLY A 58 1.080 -8.358 -7.204 1.00 0.00 C ATOM 849 O GLY A 58 -0.058 -8.345 -6.731 1.00 0.00 O ATOM 0 H GLY A 58 2.950 -8.288 -9.609 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.719 -8.569 -9.309 1.00 0.00 H new ATOM 0 HA3 GLY A 58 0.974 -10.087 -8.471 1.00 0.00 H new ATOM 853 N TYR A 59 2.108 -7.766 -6.590 1.00 0.00 N ATOM 854 CA TYR A 59 2.012 -7.038 -5.319 1.00 0.00 C ATOM 855 C TYR A 59 2.944 -5.813 -5.257 1.00 0.00 C ATOM 856 O TYR A 59 3.916 -5.703 -6.010 1.00 0.00 O ATOM 857 CB TYR A 59 2.270 -7.994 -4.143 1.00 0.00 C ATOM 858 CG TYR A 59 3.694 -8.511 -4.039 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.630 -7.851 -3.219 1.00 0.00 C ATOM 860 CD2 TYR A 59 4.079 -9.658 -4.761 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.946 -8.339 -3.120 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.400 -10.140 -4.676 1.00 0.00 C ATOM 863 CZ TYR A 59 6.339 -9.479 -3.854 1.00 0.00 C ATOM 864 OH TYR A 59 7.617 -9.938 -3.756 1.00 0.00 O ATOM 0 H TYR A 59 3.054 -7.779 -6.971 1.00 0.00 H new ATOM 0 HA TYR A 59 0.997 -6.647 -5.246 1.00 0.00 H new ATOM 0 HB2 TYR A 59 2.016 -7.482 -3.215 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.595 -8.846 -4.231 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.338 -6.970 -2.666 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.359 -10.170 -5.382 1.00 0.00 H new ATOM 0 HE1 TYR A 59 6.658 -7.839 -2.480 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.694 -11.014 -5.239 1.00 0.00 H new ATOM 0 HH TYR A 59 7.724 -10.730 -4.323 1.00 0.00 H new ATOM 874 N GLY A 60 2.633 -4.892 -4.344 1.00 0.00 N ATOM 875 CA GLY A 60 3.347 -3.640 -4.114 1.00 0.00 C ATOM 876 C GLY A 60 3.186 -3.099 -2.690 1.00 0.00 C ATOM 877 O GLY A 60 2.538 -3.710 -1.837 1.00 0.00 O ATOM 0 H GLY A 60 1.838 -5.006 -3.716 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.407 -3.792 -4.319 1.00 0.00 H new ATOM 0 HA3 GLY A 60 2.990 -2.892 -4.821 1.00 0.00 H new ATOM 881 N PHE A 61 3.775 -1.931 -2.450 1.00 0.00 N ATOM 882 CA PHE A 61 3.798 -1.225 -1.171 1.00 0.00 C ATOM 883 C PHE A 61 3.698 0.294 -1.362 1.00 0.00 C ATOM 884 O PHE A 61 4.221 0.840 -2.340 1.00 0.00 O ATOM 885 CB PHE A 61 5.099 -1.530 -0.413 1.00 0.00 C ATOM 886 CG PHE A 61 5.359 -2.984 -0.071 1.00 0.00 C ATOM 887 CD1 PHE A 61 6.072 -3.806 -0.965 1.00 0.00 C ATOM 888 CD2 PHE A 61 4.939 -3.500 1.170 1.00 0.00 C ATOM 889 CE1 PHE A 61 6.364 -5.137 -0.620 1.00 0.00 C ATOM 890 CE2 PHE A 61 5.243 -4.828 1.521 1.00 0.00 C ATOM 891 CZ PHE A 61 5.954 -5.648 0.625 1.00 0.00 C ATOM 0 H PHE A 61 4.276 -1.424 -3.180 1.00 0.00 H new ATOM 0 HA PHE A 61 2.936 -1.572 -0.601 1.00 0.00 H new ATOM 0 HB2 PHE A 61 5.935 -1.165 -1.010 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.096 -0.957 0.514 1.00 0.00 H new ATOM 0 HD1 PHE A 61 6.395 -3.413 -1.918 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.383 -2.875 1.853 1.00 0.00 H new ATOM 0 HE1 PHE A 61 6.903 -5.768 -1.311 1.00 0.00 H new ATOM 0 HE2 PHE A 61 4.931 -5.218 2.478 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.185 -6.669 0.893 1.00 0.00 H new ATOM 901 N VAL A 62 3.096 0.982 -0.386 1.00 0.00 N ATOM 902 CA VAL A 62 3.001 2.453 -0.335 1.00 0.00 C ATOM 903 C VAL A 62 3.398 2.960 1.051 1.00 0.00 C ATOM 904 O VAL A 62 2.858 2.506 2.059 1.00 0.00 O ATOM 905 CB VAL A 62 1.594 2.961 -0.721 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.607 4.479 -0.895 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.067 2.319 -2.011 1.00 0.00 C ATOM 0 H VAL A 62 2.650 0.526 0.410 1.00 0.00 H new ATOM 0 HA VAL A 62 3.697 2.852 -1.073 1.00 0.00 H new ATOM 0 HB VAL A 62 0.928 2.676 0.094 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.609 4.823 -1.167 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.911 4.950 0.040 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.311 4.749 -1.682 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.075 2.712 -2.234 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.743 2.550 -2.835 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.008 1.238 -1.882 1.00 0.00 H new ATOM 917 N GLU A 63 4.346 3.892 1.113 1.00 0.00 N ATOM 918 CA GLU A 63 4.905 4.454 2.347 1.00 0.00 C ATOM 919 C GLU A 63 4.313 5.840 2.624 1.00 0.00 C ATOM 920 O GLU A 63 4.431 6.749 1.800 1.00 0.00 O ATOM 921 CB GLU A 63 6.429 4.513 2.205 1.00 0.00 C ATOM 922 CG GLU A 63 7.162 4.926 3.488 1.00 0.00 C ATOM 923 CD GLU A 63 8.700 4.879 3.338 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.233 4.180 2.440 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.392 5.561 4.131 1.00 0.00 O ATOM 0 H GLU A 63 4.764 4.294 0.274 1.00 0.00 H new ATOM 0 HA GLU A 63 4.648 3.822 3.197 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.792 3.534 1.891 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.682 5.217 1.412 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.859 5.935 3.766 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.860 4.267 4.302 1.00 0.00 H new ATOM 932 N PHE A 64 3.705 6.014 3.793 1.00 0.00 N ATOM 933 CA PHE A 64 3.110 7.265 4.255 1.00 0.00 C ATOM 934 C PHE A 64 4.013 8.009 5.242 1.00 0.00 C ATOM 935 O PHE A 64 4.914 7.432 5.856 1.00 0.00 O ATOM 936 CB PHE A 64 1.739 6.979 4.876 1.00 0.00 C ATOM 937 CG PHE A 64 0.690 6.623 3.847 1.00 0.00 C ATOM 938 CD1 PHE A 64 0.500 5.286 3.446 1.00 0.00 C ATOM 939 CD2 PHE A 64 -0.072 7.650 3.263 1.00 0.00 C ATOM 940 CE1 PHE A 64 -0.476 4.977 2.482 1.00 0.00 C ATOM 941 CE2 PHE A 64 -1.046 7.340 2.303 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.255 6.006 1.922 1.00 0.00 C ATOM 0 H PHE A 64 3.609 5.259 4.472 1.00 0.00 H new ATOM 0 HA PHE A 64 2.990 7.920 3.392 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.833 6.161 5.590 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.409 7.854 5.436 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.102 4.500 3.878 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.093 8.677 3.554 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.627 3.953 2.173 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.635 8.128 1.857 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.018 5.768 1.195 1.00 0.00 H new ATOM 952 N LEU A 65 3.744 9.307 5.417 1.00 0.00 N ATOM 953 CA LEU A 65 4.478 10.159 6.355 1.00 0.00 C ATOM 954 C LEU A 65 4.325 9.691 7.814 1.00 0.00 C ATOM 955 O LEU A 65 5.276 9.787 8.593 1.00 0.00 O ATOM 956 CB LEU A 65 3.980 11.603 6.180 1.00 0.00 C ATOM 957 CG LEU A 65 4.908 12.654 6.809 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.164 12.872 5.962 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.176 13.994 6.913 1.00 0.00 C ATOM 0 H LEU A 65 3.008 9.797 4.909 1.00 0.00 H new ATOM 0 HA LEU A 65 5.543 10.097 6.132 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.873 11.815 5.116 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.989 11.693 6.624 1.00 0.00 H new ATOM 0 HG LEU A 65 5.196 12.286 7.794 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.797 13.621 6.437 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.713 11.934 5.877 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.877 13.216 4.968 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.838 14.736 7.360 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.879 14.325 5.918 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.289 13.877 7.536 1.00 0.00 H new ATOM 971 N SER A 66 3.150 9.152 8.161 1.00 0.00 N ATOM 972 CA SER A 66 2.807 8.708 9.518 1.00 0.00 C ATOM 973 C SER A 66 1.968 7.425 9.508 1.00 0.00 C ATOM 974 O SER A 66 1.257 7.123 8.549 1.00 0.00 O ATOM 975 CB SER A 66 2.054 9.814 10.278 1.00 0.00 C ATOM 976 OG SER A 66 2.737 11.060 10.235 1.00 0.00 O ATOM 0 H SER A 66 2.394 9.009 7.491 1.00 0.00 H new ATOM 0 HA SER A 66 3.746 8.493 10.029 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.059 9.933 9.850 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.920 9.511 11.317 1.00 0.00 H new ATOM 0 HG SER A 66 2.222 11.732 10.729 1.00 0.00 H new ATOM 982 N GLU A 67 2.020 6.671 10.605 1.00 0.00 N ATOM 983 CA GLU A 67 1.322 5.385 10.764 1.00 0.00 C ATOM 984 C GLU A 67 -0.209 5.516 10.726 1.00 0.00 C ATOM 985 O GLU A 67 -0.880 4.649 10.170 1.00 0.00 O ATOM 986 CB GLU A 67 1.833 4.750 12.062 1.00 0.00 C ATOM 987 CG GLU A 67 1.243 3.376 12.423 1.00 0.00 C ATOM 988 CD GLU A 67 -0.100 3.410 13.185 1.00 0.00 C ATOM 989 OE1 GLU A 67 -0.796 2.366 13.182 1.00 0.00 O ATOM 990 OE2 GLU A 67 -0.446 4.430 13.827 1.00 0.00 O ATOM 0 H GLU A 67 2.559 6.938 11.429 1.00 0.00 H new ATOM 0 HA GLU A 67 1.546 4.738 9.916 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.916 4.650 11.991 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.629 5.437 12.883 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.105 2.806 11.504 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.971 2.835 13.028 1.00 0.00 H new ATOM 997 N GLU A 68 -0.768 6.621 11.225 1.00 0.00 N ATOM 998 CA GLU A 68 -2.217 6.876 11.177 1.00 0.00 C ATOM 999 C GLU A 68 -2.739 7.145 9.752 1.00 0.00 C ATOM 1000 O GLU A 68 -3.894 6.844 9.448 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.589 8.012 12.147 1.00 0.00 C ATOM 1002 CG GLU A 68 -1.990 9.380 11.782 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.364 10.439 12.838 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -1.561 10.681 13.773 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -3.462 11.041 12.743 1.00 0.00 O ATOM 0 H GLU A 68 -0.234 7.365 11.674 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.716 5.963 11.501 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.675 8.102 12.183 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.259 7.740 13.150 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.905 9.300 11.709 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.353 9.692 10.803 1.00 0.00 H new ATOM 1012 N ASP A 69 -1.884 7.650 8.855 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.202 7.820 7.433 1.00 0.00 C ATOM 1014 C ASP A 69 -2.136 6.481 6.680 1.00 0.00 C ATOM 1015 O ASP A 69 -2.963 6.232 5.798 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.260 8.863 6.814 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.541 10.276 7.345 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -2.644 10.814 7.084 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -0.649 10.863 8.000 1.00 0.00 O ATOM 0 H ASP A 69 -0.942 7.955 9.099 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.227 8.181 7.343 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.227 8.593 7.031 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.371 8.854 5.730 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.227 5.580 7.074 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.166 4.228 6.520 1.00 0.00 C ATOM 1026 C ALA A 70 -2.368 3.379 6.973 1.00 0.00 C ATOM 1027 O ALA A 70 -3.011 2.720 6.158 1.00 0.00 O ATOM 1028 CB ALA A 70 0.171 3.599 6.931 1.00 0.00 C ATOM 0 H ALA A 70 -0.518 5.770 7.782 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.223 4.271 5.432 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.237 2.589 6.527 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.992 4.200 6.540 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.236 3.560 8.018 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.731 3.449 8.257 1.00 0.00 N ATOM 1035 CA ASP A 71 -3.869 2.715 8.828 1.00 0.00 C ATOM 1036 C ASP A 71 -5.216 3.109 8.184 1.00 0.00 C ATOM 1037 O ASP A 71 -6.105 2.268 8.027 1.00 0.00 O ATOM 1038 CB ASP A 71 -3.874 2.915 10.349 1.00 0.00 C ATOM 1039 CG ASP A 71 -4.555 1.742 11.065 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -5.715 1.889 11.517 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -3.902 0.677 11.193 1.00 0.00 O ATOM 0 H ASP A 71 -2.238 4.024 8.940 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.748 1.655 8.605 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.850 3.017 10.708 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.391 3.843 10.594 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.341 4.360 7.726 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.504 4.848 6.977 1.00 0.00 C ATOM 1048 C TYR A 72 -6.499 4.409 5.504 1.00 0.00 C ATOM 1049 O TYR A 72 -7.553 4.088 4.956 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.563 6.375 7.075 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.833 6.956 6.478 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -9.073 6.746 7.115 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -7.780 7.671 5.267 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -10.257 7.247 6.537 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -8.960 8.176 4.686 1.00 0.00 C ATOM 1056 CZ TYR A 72 -10.204 7.962 5.320 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.352 8.447 4.773 1.00 0.00 O ATOM 0 H TYR A 72 -4.625 5.073 7.868 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.392 4.404 7.427 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.491 6.670 8.122 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.699 6.801 6.564 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -9.116 6.201 8.046 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -6.830 7.833 4.780 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -11.206 7.084 7.026 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -8.913 8.726 3.758 1.00 0.00 H new ATOM 0 HH TYR A 72 -11.144 8.915 3.938 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.331 4.317 4.860 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.220 3.817 3.488 1.00 0.00 C ATOM 1069 C ALA A 73 -5.675 2.352 3.393 1.00 0.00 C ATOM 1070 O ALA A 73 -6.390 1.981 2.464 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.776 4.019 3.025 1.00 0.00 C ATOM 0 H ALA A 73 -4.439 4.586 5.275 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.883 4.373 2.825 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.667 3.654 2.004 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.528 5.080 3.059 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.103 3.467 3.681 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.359 1.547 4.411 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.818 0.156 4.556 1.00 0.00 C ATOM 1079 C ILE A 74 -7.346 0.089 4.719 1.00 0.00 C ATOM 1080 O ILE A 74 -7.983 -0.811 4.169 1.00 0.00 O ATOM 1081 CB ILE A 74 -5.079 -0.499 5.746 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.557 -0.499 5.491 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.556 -1.944 5.985 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.731 -0.655 6.759 1.00 0.00 C ATOM 0 H ILE A 74 -4.761 1.850 5.180 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.580 -0.401 3.650 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.306 0.088 6.636 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.311 -1.309 4.804 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.279 0.432 4.998 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.014 -2.371 6.829 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.624 -1.943 6.202 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.368 -2.542 5.093 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.671 -0.647 6.506 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.948 0.169 7.439 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -2.981 -1.599 7.242 1.00 0.00 H new ATOM 1096 N LYS A 75 -7.953 1.064 5.408 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.411 1.162 5.583 1.00 0.00 C ATOM 1098 C LYS A 75 -10.144 1.428 4.261 1.00 0.00 C ATOM 1099 O LYS A 75 -11.190 0.820 4.027 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.722 2.218 6.661 1.00 0.00 C ATOM 1101 CG LYS A 75 -11.223 2.338 6.953 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.485 3.254 8.157 1.00 0.00 C ATOM 1103 CE LYS A 75 -12.993 3.355 8.419 1.00 0.00 C ATOM 1104 NZ LYS A 75 -13.289 4.214 9.596 1.00 0.00 N ATOM 0 H LYS A 75 -7.440 1.817 5.866 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.790 0.199 5.924 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.196 1.959 7.580 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.340 3.186 6.337 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.736 2.731 6.075 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.638 1.349 7.148 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -10.979 2.862 9.040 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -11.073 4.245 7.967 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.489 3.761 7.538 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.402 2.358 8.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.318 4.259 9.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.836 3.812 10.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.921 5.172 9.428 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.607 2.291 3.388 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.275 2.679 2.133 1.00 0.00 C ATOM 1120 C ILE A 76 -9.903 1.821 0.910 1.00 0.00 C ATOM 1121 O ILE A 76 -10.777 1.561 0.087 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.123 4.190 1.844 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.666 4.654 1.650 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.813 5.004 2.955 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.569 6.076 1.093 1.00 0.00 C ATOM 0 H ILE A 76 -8.702 2.739 3.528 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.331 2.470 2.306 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.611 4.371 0.887 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.143 4.606 2.605 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.157 3.967 0.973 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.704 6.068 2.748 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.872 4.748 2.989 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.352 4.772 3.915 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.521 6.350 0.977 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.066 6.122 0.124 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.051 6.770 1.781 1.00 0.00 H new ATOM 1137 N MET A 77 -8.653 1.358 0.776 1.00 0.00 N ATOM 1138 CA MET A 77 -8.150 0.680 -0.439 1.00 0.00 C ATOM 1139 C MET A 77 -8.288 -0.847 -0.437 1.00 0.00 C ATOM 1140 O MET A 77 -7.919 -1.513 -1.402 1.00 0.00 O ATOM 1141 CB MET A 77 -6.716 1.127 -0.748 1.00 0.00 C ATOM 1142 CG MET A 77 -6.661 2.561 -1.275 1.00 0.00 C ATOM 1143 SD MET A 77 -6.922 2.679 -3.062 1.00 0.00 S ATOM 1144 CE MET A 77 -6.425 4.399 -3.304 1.00 0.00 C ATOM 0 H MET A 77 -7.951 1.442 1.512 1.00 0.00 H new ATOM 0 HA MET A 77 -8.807 1.000 -1.247 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.110 1.050 0.155 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.278 0.454 -1.485 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.417 3.157 -0.764 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.692 2.995 -1.027 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.107 4.880 -4.005 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.456 4.925 -2.350 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.411 4.432 -3.703 1.00 0.00 H new ATOM 1154 N ASP A 78 -8.848 -1.417 0.623 1.00 0.00 N ATOM 1155 CA ASP A 78 -9.050 -2.863 0.745 1.00 0.00 C ATOM 1156 C ASP A 78 -10.353 -3.328 0.072 1.00 0.00 C ATOM 1157 O ASP A 78 -11.398 -2.684 0.193 1.00 0.00 O ATOM 1158 CB ASP A 78 -8.967 -3.295 2.213 1.00 0.00 C ATOM 1159 CG ASP A 78 -9.016 -4.820 2.334 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -9.985 -5.361 2.914 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -8.072 -5.478 1.838 1.00 0.00 O ATOM 0 H ASP A 78 -9.179 -0.888 1.430 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.243 -3.359 0.206 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.044 -2.920 2.656 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.791 -2.854 2.774 1.00 0.00 H new ATOM 1166 N MET A 79 -10.281 -4.447 -0.657 1.00 0.00 N ATOM 1167 CA MET A 79 -11.343 -4.993 -1.519 1.00 0.00 C ATOM 1168 C MET A 79 -11.799 -4.051 -2.661 1.00 0.00 C ATOM 1169 O MET A 79 -12.801 -4.307 -3.332 1.00 0.00 O ATOM 1170 CB MET A 79 -12.481 -5.571 -0.656 1.00 0.00 C ATOM 1171 CG MET A 79 -13.213 -6.735 -1.337 1.00 0.00 C ATOM 1172 SD MET A 79 -14.463 -7.561 -0.308 1.00 0.00 S ATOM 1173 CE MET A 79 -13.398 -8.402 0.899 1.00 0.00 C ATOM 0 H MET A 79 -9.442 -5.027 -0.665 1.00 0.00 H new ATOM 0 HA MET A 79 -10.914 -5.823 -2.080 1.00 0.00 H new ATOM 0 HB2 MET A 79 -12.072 -5.912 0.295 1.00 0.00 H new ATOM 0 HB3 MET A 79 -13.197 -4.780 -0.430 1.00 0.00 H new ATOM 0 HG2 MET A 79 -13.696 -6.362 -2.240 1.00 0.00 H new ATOM 0 HG3 MET A 79 -12.476 -7.474 -1.651 1.00 0.00 H new ATOM 0 HE1 MET A 79 -13.993 -9.107 1.480 1.00 0.00 H new ATOM 0 HE2 MET A 79 -12.608 -8.939 0.375 1.00 0.00 H new ATOM 0 HE3 MET A 79 -12.954 -7.665 1.568 1.00 0.00 H new ATOM 1183 N ILE A 80 -11.048 -2.974 -2.921 1.00 0.00 N ATOM 1184 CA ILE A 80 -11.192 -2.106 -4.099 1.00 0.00 C ATOM 1185 C ILE A 80 -10.741 -2.857 -5.361 1.00 0.00 C ATOM 1186 O ILE A 80 -9.889 -3.740 -5.293 1.00 0.00 O ATOM 1187 CB ILE A 80 -10.443 -0.767 -3.853 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -11.399 0.226 -3.149 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -9.782 -0.159 -5.097 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -10.896 1.674 -3.062 1.00 0.00 C ATOM 0 H ILE A 80 -10.299 -2.672 -2.298 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.237 -1.846 -4.264 1.00 0.00 H new ATOM 0 HB ILE A 80 -9.597 -0.990 -3.203 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.353 0.222 -3.676 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.592 -0.135 -2.139 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.285 0.772 -4.826 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.049 -0.859 -5.498 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.542 0.042 -5.852 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.639 2.287 -2.552 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.959 1.701 -2.506 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.732 2.063 -4.067 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.301 -2.511 -6.524 1.00 0.00 N ATOM 1203 CA LYS A 81 -11.059 -3.184 -7.811 1.00 0.00 C ATOM 1204 C LYS A 81 -10.284 -2.301 -8.798 1.00 0.00 C ATOM 1205 O LYS A 81 -10.824 -1.863 -9.816 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.398 -3.690 -8.366 1.00 0.00 C ATOM 1207 CG LYS A 81 -13.037 -4.760 -7.462 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.269 -5.425 -8.093 1.00 0.00 C ATOM 1209 CE LYS A 81 -13.880 -6.432 -9.184 1.00 0.00 C ATOM 1210 NZ LYS A 81 -15.079 -6.986 -9.870 1.00 0.00 N ATOM 0 H LYS A 81 -11.955 -1.732 -6.602 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.409 -4.044 -7.651 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.085 -2.851 -8.473 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.243 -4.104 -9.362 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.295 -5.525 -7.235 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.324 -4.303 -6.515 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.844 -5.933 -7.319 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.916 -4.659 -8.520 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.234 -5.946 -9.915 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.305 -7.245 -8.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.779 -7.663 -10.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.683 -7.471 -9.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.614 -6.212 -10.313 1.00 0.00 H new ATOM 1224 N LEU A 82 -9.005 -2.055 -8.508 1.00 0.00 N ATOM 1225 CA LEU A 82 -8.084 -1.323 -9.393 1.00 0.00 C ATOM 1226 C LEU A 82 -7.999 -2.026 -10.763 1.00 0.00 C ATOM 1227 O LEU A 82 -7.757 -3.233 -10.816 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.717 -1.212 -8.686 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.653 -0.373 -9.417 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.148 1.036 -9.753 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.418 -0.249 -8.523 1.00 0.00 C ATOM 0 H LEU A 82 -8.569 -2.362 -7.639 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.445 -0.313 -9.589 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.874 -0.783 -7.696 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.322 -2.217 -8.539 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.422 -0.882 -10.353 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.360 1.586 -10.267 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.024 0.970 -10.398 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.413 1.558 -8.833 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.658 0.344 -9.032 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.693 0.239 -7.588 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -4.021 -1.242 -8.311 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.262 -1.304 -11.864 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.449 -1.896 -13.207 1.00 0.00 C ATOM 1245 C TYR A 83 -9.380 -3.146 -13.290 1.00 0.00 C ATOM 1246 O TYR A 83 -9.212 -3.985 -14.179 1.00 0.00 O ATOM 1247 CB TYR A 83 -7.084 -2.137 -13.877 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.205 -0.912 -14.035 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -4.959 -0.854 -13.385 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -6.609 0.143 -14.877 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -4.110 0.250 -13.586 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -5.765 1.254 -15.073 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.510 1.310 -14.428 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.680 2.371 -14.622 1.00 0.00 O ATOM 0 H TYR A 83 -8.352 -0.288 -11.852 1.00 0.00 H new ATOM 0 HA TYR A 83 -9.008 -1.148 -13.770 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.540 -2.880 -13.294 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.255 -2.569 -14.863 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.654 -1.657 -12.731 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.567 0.100 -15.373 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -3.149 0.286 -13.094 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -6.078 2.063 -15.717 1.00 0.00 H new ATOM 0 HH TYR A 83 -4.105 3.012 -15.229 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.367 -3.302 -12.392 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.339 -4.413 -12.424 1.00 0.00 C ATOM 1266 C GLY A 84 -10.848 -5.757 -11.851 1.00 0.00 C ATOM 1267 O GLY A 84 -11.366 -6.810 -12.230 1.00 0.00 O ATOM 0 H GLY A 84 -10.516 -2.657 -11.616 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.228 -4.108 -11.871 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.645 -4.572 -13.458 1.00 0.00 H new ATOM 1271 N LYS A 85 -9.870 -5.735 -10.935 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.238 -6.869 -10.253 1.00 0.00 C ATOM 1273 C LYS A 85 -9.110 -6.509 -8.758 1.00 0.00 C ATOM 1274 O LYS A 85 -8.511 -5.477 -8.448 1.00 0.00 O ATOM 1275 CB LYS A 85 -7.866 -7.131 -10.900 1.00 0.00 C ATOM 1276 CG LYS A 85 -7.163 -8.360 -10.305 1.00 0.00 C ATOM 1277 CD LYS A 85 -5.785 -8.566 -10.948 1.00 0.00 C ATOM 1278 CE LYS A 85 -5.085 -9.776 -10.320 1.00 0.00 C ATOM 1279 NZ LYS A 85 -3.735 -9.994 -10.904 1.00 0.00 N ATOM 0 H LYS A 85 -9.469 -4.849 -10.628 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.830 -7.780 -10.344 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.995 -7.273 -11.973 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.232 -6.254 -10.769 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.051 -8.234 -9.228 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.778 -9.247 -10.460 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.895 -8.717 -12.022 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.175 -7.673 -10.813 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -4.996 -9.627 -9.244 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.695 -10.667 -10.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -3.278 -10.800 -10.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -3.825 -10.194 -11.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -3.156 -9.140 -10.769 1.00 0.00 H new ATOM 1293 N PRO A 86 -9.709 -7.278 -7.831 1.00 0.00 N ATOM 1294 CA PRO A 86 -9.789 -6.904 -6.421 1.00 0.00 C ATOM 1295 C PRO A 86 -8.424 -6.979 -5.717 1.00 0.00 C ATOM 1296 O PRO A 86 -7.772 -8.026 -5.712 1.00 0.00 O ATOM 1297 CB PRO A 86 -10.846 -7.827 -5.801 1.00 0.00 C ATOM 1298 CG PRO A 86 -10.872 -9.038 -6.731 1.00 0.00 C ATOM 1299 CD PRO A 86 -10.533 -8.442 -8.096 1.00 0.00 C ATOM 0 HA PRO A 86 -10.081 -5.861 -6.302 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -10.580 -8.111 -4.783 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -11.820 -7.341 -5.751 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -10.145 -9.792 -6.430 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -11.849 -9.521 -6.735 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -10.001 -9.164 -8.716 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.438 -8.164 -8.636 1.00 0.00 H new ATOM 1307 N ILE A 87 -8.016 -5.867 -5.096 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.788 -5.745 -4.299 1.00 0.00 C ATOM 1309 C ILE A 87 -7.055 -5.957 -2.802 1.00 0.00 C ATOM 1310 O ILE A 87 -8.095 -5.562 -2.269 1.00 0.00 O ATOM 1311 CB ILE A 87 -6.026 -4.424 -4.575 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.869 -3.148 -4.359 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.457 -4.449 -6.003 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -6.029 -1.878 -4.164 1.00 0.00 C ATOM 0 H ILE A 87 -8.548 -4.998 -5.135 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.128 -6.549 -4.623 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.223 -4.373 -3.840 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.528 -3.009 -5.216 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.507 -3.288 -3.486 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.921 -3.520 -6.197 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.773 -5.291 -6.107 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.273 -4.554 -6.718 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.690 -1.024 -4.018 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.389 -1.996 -3.289 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.410 -1.712 -5.046 1.00 0.00 H new ATOM 1326 N ARG A 88 -6.091 -6.575 -2.115 1.00 0.00 N ATOM 1327 CA ARG A 88 -6.086 -6.832 -0.666 1.00 0.00 C ATOM 1328 C ARG A 88 -5.005 -5.974 -0.007 1.00 0.00 C ATOM 1329 O ARG A 88 -3.860 -5.993 -0.459 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.867 -8.341 -0.440 1.00 0.00 C ATOM 1331 CG ARG A 88 -6.006 -8.792 1.023 1.00 0.00 C ATOM 1332 CD ARG A 88 -7.464 -8.824 1.506 1.00 0.00 C ATOM 1333 NE ARG A 88 -7.537 -9.233 2.922 1.00 0.00 N ATOM 1334 CZ ARG A 88 -7.355 -8.460 3.980 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -7.243 -7.168 3.891 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -7.269 -8.985 5.169 1.00 0.00 N ATOM 0 H ARG A 88 -5.251 -6.928 -2.573 1.00 0.00 H new ATOM 0 HA ARG A 88 -7.037 -6.558 -0.208 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -6.583 -8.894 -1.047 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.872 -8.609 -0.797 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -5.570 -9.785 1.134 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -5.433 -8.119 1.661 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -7.914 -7.839 1.383 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -8.040 -9.517 0.892 1.00 0.00 H new ATOM 0 HE ARG A 88 -7.750 -10.214 3.104 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -7.295 -6.713 2.979 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -7.103 -6.609 4.733 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -7.342 -9.996 5.287 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -7.129 -8.386 5.982 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.358 -5.218 1.033 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.490 -4.194 1.646 1.00 0.00 C ATOM 1352 C VAL A 89 -4.376 -4.394 3.162 1.00 0.00 C ATOM 1353 O VAL A 89 -5.362 -4.719 3.826 1.00 0.00 O ATOM 1354 CB VAL A 89 -4.961 -2.772 1.266 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -3.981 -1.685 1.720 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -5.090 -2.616 -0.253 1.00 0.00 C ATOM 0 H VAL A 89 -6.269 -5.296 1.486 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.484 -4.312 1.244 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.921 -2.650 1.767 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.362 -0.707 1.427 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.873 -1.723 2.804 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -3.011 -1.852 1.252 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.423 -1.605 -0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.122 -2.797 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.817 -3.335 -0.632 1.00 0.00 H new ATOM 1366 N ASN A 90 -3.170 -4.221 3.714 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.853 -4.382 5.145 1.00 0.00 C ATOM 1368 C ASN A 90 -1.576 -3.593 5.526 1.00 0.00 C ATOM 1369 O ASN A 90 -0.914 -3.032 4.652 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.689 -5.890 5.424 1.00 0.00 C ATOM 1371 CG ASN A 90 -2.808 -6.294 6.887 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -3.029 -5.488 7.780 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -2.683 -7.567 7.170 1.00 0.00 N ATOM 0 H ASN A 90 -2.356 -3.955 3.160 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.659 -3.978 5.757 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.441 -6.433 4.851 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -1.714 -6.208 5.054 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -2.770 -7.886 8.135 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -2.499 -8.239 6.425 1.00 0.00 H new ATOM 1380 N LYS A 91 -1.190 -3.563 6.808 1.00 0.00 N ATOM 1381 CA LYS A 91 0.111 -3.031 7.263 1.00 0.00 C ATOM 1382 C LYS A 91 1.252 -3.868 6.663 1.00 0.00 C ATOM 1383 O LYS A 91 1.152 -5.094 6.611 1.00 0.00 O ATOM 1384 CB LYS A 91 0.208 -3.050 8.807 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.917 -2.345 9.591 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.933 -0.811 9.452 1.00 0.00 C ATOM 1387 CE LYS A 91 -0.306 -0.034 10.616 1.00 0.00 C ATOM 1388 NZ LYS A 91 -1.221 0.040 11.781 1.00 0.00 N ATOM 0 H LYS A 91 -1.774 -3.909 7.569 1.00 0.00 H new ATOM 0 HA LYS A 91 0.196 -1.998 6.925 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.245 -4.090 9.131 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.156 -2.594 9.092 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.877 -2.737 9.255 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.821 -2.600 10.646 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.409 -0.542 8.535 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.967 -0.485 9.336 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.626 -0.515 10.915 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.053 0.974 10.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -1.067 0.935 12.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -2.206 -0.007 11.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -1.032 -0.757 12.422 1.00 0.00 H new ATOM 1402 N ALA A 92 2.359 -3.233 6.275 1.00 0.00 N ATOM 1403 CA ALA A 92 3.588 -3.941 5.889 1.00 0.00 C ATOM 1404 C ALA A 92 4.335 -4.533 7.111 1.00 0.00 C ATOM 1405 O ALA A 92 5.258 -5.335 6.949 1.00 0.00 O ATOM 1406 CB ALA A 92 4.469 -2.999 5.064 1.00 0.00 C ATOM 0 H ALA A 92 2.433 -2.217 6.218 1.00 0.00 H new ATOM 0 HA ALA A 92 3.322 -4.800 5.273 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.383 -3.517 4.774 1.00 0.00 H new ATOM 0 HB2 ALA A 92 3.930 -2.686 4.170 1.00 0.00 H new ATOM 0 HB3 ALA A 92 4.722 -2.122 5.660 1.00 0.00 H new ATOM 1412 N SER A 93 3.938 -4.150 8.333 1.00 0.00 N ATOM 1413 CA SER A 93 4.354 -4.769 9.597 1.00 0.00 C ATOM 1414 C SER A 93 3.409 -5.921 9.976 1.00 0.00 C ATOM 1415 O SER A 93 3.767 -7.091 9.842 1.00 0.00 O ATOM 1416 CB SER A 93 4.453 -3.712 10.708 1.00 0.00 C ATOM 1417 OG SER A 93 3.225 -3.020 10.876 1.00 0.00 O ATOM 0 H SER A 93 3.294 -3.371 8.472 1.00 0.00 H new ATOM 0 HA SER A 93 5.348 -5.198 9.468 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.733 -4.193 11.646 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.243 -3.001 10.466 1.00 0.00 H new ATOM 0 HG SER A 93 3.172 -2.664 11.788 1.00 0.00 H new ATOM 1423 N ALA A 94 2.192 -5.586 10.425 1.00 0.00 N ATOM 1424 CA ALA A 94 1.181 -6.497 10.976 1.00 0.00 C ATOM 1425 C ALA A 94 1.713 -7.395 12.123 1.00 0.00 C ATOM 1426 O ALA A 94 1.254 -8.522 12.320 1.00 0.00 O ATOM 1427 CB ALA A 94 0.479 -7.237 9.825 1.00 0.00 C ATOM 0 H ALA A 94 1.869 -4.619 10.413 1.00 0.00 H new ATOM 0 HA ALA A 94 0.416 -5.912 11.487 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.272 -7.914 10.232 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -0.003 -6.513 9.168 1.00 0.00 H new ATOM 0 HB3 ALA A 94 1.214 -7.809 9.258 1.00 0.00 H new ATOM 1433 N HIS A 95 2.696 -6.890 12.881 1.00 0.00 N ATOM 1434 CA HIS A 95 3.368 -7.585 13.991 1.00 0.00 C ATOM 1435 C HIS A 95 2.514 -7.582 15.264 1.00 0.00 C ATOM 1436 O HIS A 95 1.878 -6.576 15.573 1.00 0.00 O ATOM 1437 CB HIS A 95 4.706 -6.890 14.297 1.00 0.00 C ATOM 1438 CG HIS A 95 5.669 -6.721 13.144 1.00 0.00 C ATOM 1439 ND1 HIS A 95 6.551 -5.644 12.994 1.00 0.00 N ATOM 1440 CD2 HIS A 95 5.846 -7.583 12.103 1.00 0.00 C ATOM 1441 CE1 HIS A 95 7.242 -5.890 11.867 1.00 0.00 C ATOM 1442 NE2 HIS A 95 6.833 -7.043 11.310 1.00 0.00 N ATOM 0 H HIS A 95 3.060 -5.949 12.733 1.00 0.00 H new ATOM 0 HA HIS A 95 3.529 -8.618 13.684 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.490 -5.903 14.706 1.00 0.00 H new ATOM 0 HB3 HIS A 95 5.211 -7.456 15.080 1.00 0.00 H new ATOM 0 HD2 HIS A 95 5.316 -8.508 11.934 1.00 0.00 H new ATOM 0 HE1 HIS A 95 8.016 -5.252 11.466 1.00 0.00 H new ATOM 0 HE2 HIS A 95 7.193 -7.449 10.446 1.00 0.00 H new ATOM 1450 N ASN A 96 2.539 -8.653 16.058 1.00 0.00 N ATOM 1451 CA ASN A 96 1.920 -8.681 17.389 1.00 0.00 C ATOM 1452 C ASN A 96 2.898 -8.117 18.443 1.00 0.00 C ATOM 1453 O ASN A 96 3.624 -8.875 19.093 1.00 0.00 O ATOM 1454 CB ASN A 96 1.434 -10.114 17.681 1.00 0.00 C ATOM 1455 CG ASN A 96 0.650 -10.226 18.983 1.00 0.00 C ATOM 1456 OD1 ASN A 96 0.239 -9.247 19.591 1.00 0.00 O ATOM 1457 ND2 ASN A 96 0.392 -11.430 19.440 1.00 0.00 N ATOM 0 H ASN A 96 2.990 -9.530 15.798 1.00 0.00 H new ATOM 0 HA ASN A 96 1.044 -8.034 17.430 1.00 0.00 H new ATOM 0 HB2 ASN A 96 0.808 -10.454 16.856 1.00 0.00 H new ATOM 0 HB3 ASN A 96 2.295 -10.782 17.724 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -0.148 -11.545 20.297 1.00 0.00 H new ATOM 0 HD22 ASN A 96 0.732 -12.250 18.937 1.00 0.00 H new ATOM 1464 N LYS A 97 2.964 -6.779 18.558 1.00 0.00 N ATOM 1465 CA LYS A 97 3.993 -6.061 19.346 1.00 0.00 C ATOM 1466 C LYS A 97 3.495 -4.965 20.302 1.00 0.00 C ATOM 1467 O LYS A 97 4.290 -4.472 21.104 1.00 0.00 O ATOM 1468 CB LYS A 97 5.097 -5.549 18.401 1.00 0.00 C ATOM 1469 CG LYS A 97 4.642 -4.459 17.415 1.00 0.00 C ATOM 1470 CD LYS A 97 5.812 -4.073 16.499 1.00 0.00 C ATOM 1471 CE LYS A 97 5.364 -3.100 15.403 1.00 0.00 C ATOM 1472 NZ LYS A 97 6.410 -2.951 14.365 1.00 0.00 N ATOM 0 H LYS A 97 2.298 -6.154 18.103 1.00 0.00 H new ATOM 0 HA LYS A 97 4.392 -6.802 20.038 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.918 -5.157 19.001 1.00 0.00 H new ATOM 0 HB3 LYS A 97 5.491 -6.392 17.834 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.804 -4.820 16.819 1.00 0.00 H new ATOM 0 HG3 LYS A 97 4.291 -3.584 17.961 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.605 -3.617 17.091 1.00 0.00 H new ATOM 0 HD3 LYS A 97 6.231 -4.970 16.043 1.00 0.00 H new ATOM 0 HE2 LYS A 97 4.442 -3.461 14.946 1.00 0.00 H new ATOM 0 HE3 LYS A 97 5.143 -2.128 15.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 6.159 -2.167 13.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 7.324 -2.749 14.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 6.483 -3.832 13.817 1.00 0.00 H new ATOM 1486 N ASN A 98 2.211 -4.596 20.270 1.00 0.00 N ATOM 1487 CA ASN A 98 1.626 -3.695 21.273 1.00 0.00 C ATOM 1488 C ASN A 98 1.494 -4.395 22.647 1.00 0.00 C ATOM 1489 O ASN A 98 1.293 -5.613 22.711 1.00 0.00 O ATOM 1490 CB ASN A 98 0.281 -3.156 20.748 1.00 0.00 C ATOM 1491 CG ASN A 98 -0.232 -1.944 21.513 1.00 0.00 C ATOM 1492 OD1 ASN A 98 0.468 -1.308 22.289 1.00 0.00 O ATOM 1493 ND2 ASN A 98 -1.477 -1.574 21.309 1.00 0.00 N ATOM 0 H ASN A 98 1.552 -4.908 19.557 1.00 0.00 H new ATOM 0 HA ASN A 98 2.290 -2.846 21.434 1.00 0.00 H new ATOM 0 HB2 ASN A 98 0.391 -2.891 19.696 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -0.464 -3.950 20.800 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -1.854 -0.761 21.796 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -2.066 -2.100 20.663 1.00 0.00 H new ATOM 1500 N LEU A 99 1.603 -3.638 23.745 1.00 0.00 N ATOM 1501 CA LEU A 99 1.546 -4.143 25.127 1.00 0.00 C ATOM 1502 C LEU A 99 0.896 -3.154 26.118 1.00 0.00 C ATOM 1503 O LEU A 99 0.708 -1.973 25.816 1.00 0.00 O ATOM 1504 CB LEU A 99 2.933 -4.662 25.566 1.00 0.00 C ATOM 1505 CG LEU A 99 4.142 -3.724 25.393 1.00 0.00 C ATOM 1506 CD1 LEU A 99 4.008 -2.437 26.199 1.00 0.00 C ATOM 1507 CD2 LEU A 99 5.397 -4.456 25.866 1.00 0.00 C ATOM 0 H LEU A 99 1.737 -2.628 23.698 1.00 0.00 H new ATOM 0 HA LEU A 99 0.867 -4.996 25.143 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.870 -4.935 26.619 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.138 -5.578 25.011 1.00 0.00 H new ATOM 0 HG LEU A 99 4.199 -3.453 24.339 1.00 0.00 H new ATOM 0 HD11 LEU A 99 4.888 -1.814 26.039 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.118 -1.897 25.877 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.922 -2.678 27.258 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.263 -3.805 25.750 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.286 -4.728 26.916 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.539 -5.358 25.270 1.00 0.00 H new ATOM 1519 N SER A 100 0.530 -3.650 27.304 1.00 0.00 N ATOM 1520 CA SER A 100 -0.122 -2.879 28.377 1.00 0.00 C ATOM 1521 C SER A 100 0.868 -2.144 29.293 1.00 0.00 C ATOM 1522 O SER A 100 0.602 -1.012 29.704 1.00 0.00 O ATOM 1523 CB SER A 100 -1.017 -3.816 29.199 1.00 0.00 C ATOM 1524 OG SER A 100 -0.286 -4.955 29.632 1.00 0.00 O ATOM 0 H SER A 100 0.682 -4.627 27.555 1.00 0.00 H new ATOM 0 HA SER A 100 -0.719 -2.102 27.899 1.00 0.00 H new ATOM 0 HB2 SER A 100 -1.415 -3.283 30.063 1.00 0.00 H new ATOM 0 HB3 SER A 100 -1.870 -4.132 28.599 1.00 0.00 H new ATOM 0 HG SER A 100 -0.872 -5.540 30.156 1.00 0.00 H new ATOM 1530 N GLY A 101 2.018 -2.760 29.595 1.00 0.00 N ATOM 1531 CA GLY A 101 3.118 -2.179 30.380 1.00 0.00 C ATOM 1532 C GLY A 101 2.740 -1.634 31.775 1.00 0.00 C ATOM 1533 O GLY A 101 3.075 -0.479 32.063 1.00 0.00 O ATOM 0 H GLY A 101 2.217 -3.712 29.288 1.00 0.00 H new ATOM 0 HA2 GLY A 101 3.889 -2.939 30.505 1.00 0.00 H new ATOM 0 HA3 GLY A 101 3.561 -1.368 29.803 1.00 0.00 H new ATOM 1537 N PRO A 102 2.035 -2.396 32.641 1.00 0.00 N ATOM 1538 CA PRO A 102 1.590 -1.925 33.957 1.00 0.00 C ATOM 1539 C PRO A 102 2.754 -1.692 34.939 1.00 0.00 C ATOM 1540 O PRO A 102 3.792 -2.356 34.876 1.00 0.00 O ATOM 1541 CB PRO A 102 0.635 -3.010 34.471 1.00 0.00 C ATOM 1542 CG PRO A 102 1.184 -4.282 33.828 1.00 0.00 C ATOM 1543 CD PRO A 102 1.644 -3.788 32.458 1.00 0.00 C ATOM 0 HA PRO A 102 1.106 -0.952 33.873 1.00 0.00 H new ATOM 0 HB2 PRO A 102 0.643 -3.072 35.559 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -0.395 -2.817 34.170 1.00 0.00 H new ATOM 0 HG2 PRO A 102 2.007 -4.705 34.404 1.00 0.00 H new ATOM 0 HG3 PRO A 102 0.421 -5.056 33.745 1.00 0.00 H new ATOM 0 HD2 PRO A 102 2.480 -4.383 32.090 1.00 0.00 H new ATOM 0 HD3 PRO A 102 0.843 -3.875 31.723 1.00 0.00 H new ATOM 1551 N SER A 103 2.556 -0.773 35.890 1.00 0.00 N ATOM 1552 CA SER A 103 3.538 -0.434 36.940 1.00 0.00 C ATOM 1553 C SER A 103 3.552 -1.420 38.123 1.00 0.00 C ATOM 1554 O SER A 103 4.513 -1.443 38.897 1.00 0.00 O ATOM 1555 CB SER A 103 3.265 0.980 37.473 1.00 0.00 C ATOM 1556 OG SER A 103 3.224 1.936 36.422 1.00 0.00 O ATOM 0 H SER A 103 1.695 -0.231 35.958 1.00 0.00 H new ATOM 0 HA SER A 103 4.517 -0.494 36.465 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.318 0.990 38.012 1.00 0.00 H new ATOM 0 HB3 SER A 103 4.041 1.256 38.187 1.00 0.00 H new ATOM 0 HG SER A 103 3.047 2.825 36.795 1.00 0.00 H new ATOM 1562 N SER A 104 2.499 -2.228 38.281 1.00 0.00 N ATOM 1563 CA SER A 104 2.323 -3.181 39.390 1.00 0.00 C ATOM 1564 C SER A 104 3.256 -4.398 39.300 1.00 0.00 C ATOM 1565 O SER A 104 3.599 -4.856 38.204 1.00 0.00 O ATOM 1566 CB SER A 104 0.867 -3.663 39.452 1.00 0.00 C ATOM 1567 OG SER A 104 -0.021 -2.558 39.555 1.00 0.00 O ATOM 0 H SER A 104 1.720 -2.240 37.623 1.00 0.00 H new ATOM 0 HA SER A 104 2.584 -2.640 40.299 1.00 0.00 H new ATOM 0 HB2 SER A 104 0.632 -4.244 38.560 1.00 0.00 H new ATOM 0 HB3 SER A 104 0.733 -4.325 40.308 1.00 0.00 H new ATOM 0 HG SER A 104 -0.945 -2.883 39.592 1.00 0.00 H new ATOM 1573 N GLY A 105 3.640 -4.947 40.462 1.00 0.00 N ATOM 1574 CA GLY A 105 4.446 -6.175 40.598 1.00 0.00 C ATOM 1575 C GLY A 105 3.684 -7.449 40.220 1.00 0.00 C ATOM 1576 O GLY A 105 4.247 -8.277 39.471 1.00 0.00 O ATOM 1577 OXT GLY A 105 2.539 -7.625 40.698 1.00 0.00 O ATOM 0 H GLY A 105 3.392 -4.538 41.363 1.00 0.00 H new ATOM 0 HA2 GLY A 105 5.332 -6.090 39.969 1.00 0.00 H new ATOM 0 HA3 GLY A 105 4.793 -6.260 41.628 1.00 0.00 H new TER 1581 GLY A 105