USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 864 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 116 LYS NZ :NH3+ 137:sc= -4.44! (180deg=0) USER MOD Set 1.2: A 119 HIS : no HD1:sc= -14.4! C(o=-19!,f=-4.9!) USER MOD Set 2.1: A 20 HIS : no HE2:sc= -25.1! C(o=-63!,f=-56!) USER MOD Set 2.2: A 38 HIS : no HD1:sc= -37.5! C(o=-63!,f=-56!) USER MOD Set 3.1: A 35 ASN : amide:sc= -21.8! C(o=-24!,f=-28!) USER MOD Set 3.2: A 37 THR OG1 : rot -160:sc= -2.62! USER MOD Set 3.3: A 76 THR OG1 : rot -140:sc= 0.0251 USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 41:sc= -1.02! USER MOD Single : A 16 TYR OH : rot 156:sc= 0.406 USER MOD Single : A 21 SER OG : rot -88:sc= -7.17! USER MOD Single : A 22 THR OG1 : rot 36:sc= 1.04 USER MOD Single : A 24 SER OG : rot 178:sc= -2.12! USER MOD Single : A 26 MET CE :methyl 178:sc= -18.9! (180deg=-19.8!) USER MOD Single : A 27 LYS NZ :NH3+ -137:sc= 1.06 (180deg=-0.849) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -115:sc= -0.356 (180deg=-2.21!) USER MOD Single : A 41 LYS NZ :NH3+ 137:sc= -4.01! (180deg=-6.32!) USER MOD Single : A 44 ASN : amide:sc= -33.2! C(o=-33!,f=-34!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 144:sc= -0.467 (180deg=-2.43!) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -158:sc= -1.44! (180deg=-3.21!) USER MOD Single : A 60 LYS NZ :NH3+ -124:sc= -2.38! (180deg=-2.76!) USER MOD Single : A 62 THR OG1 : rot 154:sc= -6.68! USER MOD Single : A 63 HIS : no HE2:sc= -34.3! C(o=-34!,f=-22!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -26.1! C(o=-26!,f=-13!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -36.4! C(o=-36!,f=-30!) USER MOD Single : A 81 ASN : amide:sc= -4.11! K(o=-4.1!,f=-0.48) USER MOD Single : A 84 LYS NZ :NH3+ -144:sc= -6.65! (180deg=-9.32!) USER MOD Single : A 85 GLN : amide:sc= -0.555 K(o=-0.56,f=-0.017) USER MOD Single : A 89 LYS NZ :NH3+ -144:sc= -0.0999 (180deg=-0.725) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= -5.91! K(o=-5.9!,f=-0.44) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-1!) USER MOD Single : A 118 HIS : no HD1:sc= -4.3! K(o=-4.3!,f=0.63) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 26 N GLN A 4 -2.351 -1.981 8.600 1.00 1.00 N ATOM 27 CA GLN A 4 -2.173 -0.733 7.802 1.00 1.00 C ATOM 28 C GLN A 4 -2.592 -0.968 6.348 1.00 1.00 C ATOM 29 O GLN A 4 -3.069 -2.027 5.992 1.00 1.00 O ATOM 30 CB GLN A 4 -0.680 -0.422 7.883 1.00 1.00 C ATOM 31 CG GLN A 4 -0.483 1.027 8.332 1.00 1.00 C ATOM 32 CD GLN A 4 1.002 1.386 8.261 1.00 1.00 C ATOM 33 OE1 GLN A 4 1.838 0.526 8.062 1.00 1.00 O ATOM 34 NE2 GLN A 4 1.369 2.628 8.417 1.00 1.00 N ATOM 0 HA GLN A 4 -2.783 0.088 8.179 1.00 1.00 H new ATOM 0 HB2 GLN A 4 -0.194 -1.100 8.584 1.00 1.00 H new ATOM 0 HB3 GLN A 4 -0.212 -0.579 6.911 1.00 1.00 H new ATOM 0 HG2 GLN A 4 -1.061 1.698 7.696 1.00 1.00 H new ATOM 0 HG3 GLN A 4 -0.851 1.157 9.350 1.00 1.00 H new ATOM 0 HE21 GLN A 4 0.668 3.350 8.584 1.00 1.00 H new ATOM 0 HE22 GLN A 4 2.357 2.877 8.372 1.00 1.00 H new ATOM 43 N ILE A 5 -2.411 0.012 5.505 1.00 1.00 N ATOM 44 CA ILE A 5 -2.793 -0.155 4.074 1.00 1.00 C ATOM 45 C ILE A 5 -1.550 -0.072 3.184 1.00 1.00 C ATOM 46 O ILE A 5 -1.176 0.986 2.720 1.00 1.00 O ATOM 47 CB ILE A 5 -3.744 1.004 3.778 1.00 1.00 C ATOM 48 CG1 ILE A 5 -5.038 0.455 3.171 1.00 1.00 C ATOM 49 CG2 ILE A 5 -3.086 1.966 2.788 1.00 1.00 C ATOM 50 CD1 ILE A 5 -5.938 -0.077 4.287 1.00 1.00 C ATOM 0 H ILE A 5 -2.015 0.921 5.745 1.00 1.00 H new ATOM 0 HA ILE A 5 -3.259 -1.121 3.881 1.00 1.00 H new ATOM 0 HB ILE A 5 -3.970 1.535 4.703 1.00 1.00 H new ATOM 0 HG12 ILE A 5 -5.553 1.239 2.616 1.00 1.00 H new ATOM 0 HG13 ILE A 5 -4.811 -0.341 2.462 1.00 1.00 H new ATOM 0 HG21 ILE A 5 -3.765 2.792 2.578 1.00 1.00 H new ATOM 0 HG22 ILE A 5 -2.163 2.355 3.218 1.00 1.00 H new ATOM 0 HG23 ILE A 5 -2.860 1.437 1.862 1.00 1.00 H new ATOM 0 HD11 ILE A 5 -6.860 -0.468 3.856 1.00 1.00 H new ATOM 0 HD12 ILE A 5 -5.421 -0.873 4.823 1.00 1.00 H new ATOM 0 HD13 ILE A 5 -6.175 0.731 4.979 1.00 1.00 H new ATOM 62 N TYR A 6 -0.906 -1.182 2.945 1.00 1.00 N ATOM 63 CA TYR A 6 0.314 -1.167 2.087 1.00 1.00 C ATOM 64 C TYR A 6 -0.005 -0.554 0.721 1.00 1.00 C ATOM 65 O TYR A 6 -1.152 -0.375 0.362 1.00 1.00 O ATOM 66 CB TYR A 6 0.710 -2.636 1.936 1.00 1.00 C ATOM 67 CG TYR A 6 1.171 -3.173 3.270 1.00 1.00 C ATOM 68 CD1 TYR A 6 1.318 -2.307 4.360 1.00 1.00 C ATOM 69 CD2 TYR A 6 1.453 -4.536 3.417 1.00 1.00 C ATOM 70 CE1 TYR A 6 1.746 -2.804 5.596 1.00 1.00 C ATOM 71 CE2 TYR A 6 1.882 -5.034 4.653 1.00 1.00 C ATOM 72 CZ TYR A 6 2.028 -4.167 5.744 1.00 1.00 C ATOM 73 OH TYR A 6 2.451 -4.658 6.962 1.00 1.00 O ATOM 0 H TYR A 6 -1.171 -2.098 3.306 1.00 1.00 H new ATOM 0 HA TYR A 6 1.116 -0.571 2.522 1.00 1.00 H new ATOM 0 HB2 TYR A 6 -0.138 -3.217 1.572 1.00 1.00 H new ATOM 0 HB3 TYR A 6 1.506 -2.735 1.197 1.00 1.00 H new ATOM 0 HD1 TYR A 6 1.101 -1.255 4.247 1.00 1.00 H new ATOM 0 HD2 TYR A 6 1.340 -5.204 2.576 1.00 1.00 H new ATOM 0 HE1 TYR A 6 1.859 -2.135 6.437 1.00 1.00 H new ATOM 0 HE2 TYR A 6 2.100 -6.086 4.766 1.00 1.00 H new ATOM 0 HH TYR A 6 2.601 -5.624 6.891 1.00 1.00 H new ATOM 83 N SER A 7 1.002 -0.229 -0.043 1.00 1.00 N ATOM 84 CA SER A 7 0.757 0.372 -1.385 1.00 1.00 C ATOM 85 C SER A 7 1.177 -0.604 -2.488 1.00 1.00 C ATOM 86 O SER A 7 2.140 -1.333 -2.351 1.00 1.00 O ATOM 87 CB SER A 7 1.630 1.626 -1.422 1.00 1.00 C ATOM 88 OG SER A 7 2.157 1.794 -2.732 1.00 1.00 O ATOM 0 H SER A 7 1.984 -0.354 0.204 1.00 1.00 H new ATOM 0 HA SER A 7 -0.296 0.601 -1.548 1.00 1.00 H new ATOM 0 HB2 SER A 7 1.043 2.500 -1.139 1.00 1.00 H new ATOM 0 HB3 SER A 7 2.442 1.539 -0.700 1.00 1.00 H new ATOM 0 HG SER A 7 2.716 2.598 -2.759 1.00 1.00 H new ATOM 94 N ALA A 8 0.461 -0.625 -3.579 1.00 1.00 N ATOM 95 CA ALA A 8 0.821 -1.555 -4.689 1.00 1.00 C ATOM 96 C ALA A 8 0.506 -0.913 -6.042 1.00 1.00 C ATOM 97 O ALA A 8 -0.357 -0.064 -6.151 1.00 1.00 O ATOM 98 CB ALA A 8 -0.049 -2.792 -4.467 1.00 1.00 C ATOM 0 H ALA A 8 -0.357 -0.040 -3.750 1.00 1.00 H new ATOM 0 HA ALA A 8 1.883 -1.799 -4.694 1.00 1.00 H new ATOM 0 HB1 ALA A 8 0.157 -3.526 -5.246 1.00 1.00 H new ATOM 0 HB2 ALA A 8 0.175 -3.224 -3.492 1.00 1.00 H new ATOM 0 HB3 ALA A 8 -1.101 -2.509 -4.505 1.00 1.00 H new ATOM 104 N ARG A 9 1.196 -1.314 -7.075 1.00 1.00 N ATOM 105 CA ARG A 9 0.933 -0.727 -8.420 1.00 1.00 C ATOM 106 C ARG A 9 1.223 -1.762 -9.512 1.00 1.00 C ATOM 107 O ARG A 9 2.312 -2.293 -9.603 1.00 1.00 O ATOM 108 CB ARG A 9 1.895 0.455 -8.533 1.00 1.00 C ATOM 109 CG ARG A 9 2.833 0.241 -9.723 1.00 1.00 C ATOM 110 CD ARG A 9 3.590 1.538 -10.019 1.00 1.00 C ATOM 111 NE ARG A 9 4.583 1.664 -8.917 1.00 1.00 N ATOM 112 CZ ARG A 9 5.857 1.743 -9.192 1.00 1.00 C ATOM 113 NH1 ARG A 9 6.259 1.713 -10.432 1.00 1.00 N ATOM 114 NH2 ARG A 9 6.727 1.855 -8.225 1.00 1.00 N ATOM 0 H ARG A 9 1.930 -2.022 -7.046 1.00 1.00 H new ATOM 0 HA ARG A 9 -0.105 -0.418 -8.541 1.00 1.00 H new ATOM 0 HB2 ARG A 9 1.335 1.382 -8.660 1.00 1.00 H new ATOM 0 HB3 ARG A 9 2.473 0.555 -7.615 1.00 1.00 H new ATOM 0 HG2 ARG A 9 3.538 -0.561 -9.504 1.00 1.00 H new ATOM 0 HG3 ARG A 9 2.262 -0.067 -10.599 1.00 1.00 H new ATOM 0 HD2 ARG A 9 4.082 1.495 -10.991 1.00 1.00 H new ATOM 0 HD3 ARG A 9 2.914 2.393 -10.041 1.00 1.00 H new ATOM 0 HE ARG A 9 4.268 1.689 -7.947 1.00 1.00 H new ATOM 0 HH11 ARG A 9 5.578 1.628 -11.187 1.00 1.00 H new ATOM 0 HH12 ARG A 9 7.254 1.775 -10.647 1.00 1.00 H new ATOM 0 HH21 ARG A 9 6.411 1.881 -7.255 1.00 1.00 H new ATOM 0 HH22 ARG A 9 7.722 1.917 -8.439 1.00 1.00 H new ATOM 127 N TYR A 10 0.257 -2.053 -10.338 1.00 1.00 N ATOM 128 CA TYR A 10 0.478 -3.053 -11.422 1.00 1.00 C ATOM 129 C TYR A 10 -0.287 -2.644 -12.682 1.00 1.00 C ATOM 130 O TYR A 10 -1.135 -1.775 -12.651 1.00 1.00 O ATOM 131 CB TYR A 10 -0.071 -4.367 -10.865 1.00 1.00 C ATOM 132 CG TYR A 10 0.627 -4.693 -9.568 1.00 1.00 C ATOM 133 CD1 TYR A 10 2.024 -4.780 -9.527 1.00 1.00 C ATOM 134 CD2 TYR A 10 -0.121 -4.908 -8.404 1.00 1.00 C ATOM 135 CE1 TYR A 10 2.673 -5.082 -8.325 1.00 1.00 C ATOM 136 CE2 TYR A 10 0.527 -5.210 -7.201 1.00 1.00 C ATOM 137 CZ TYR A 10 1.924 -5.297 -7.161 1.00 1.00 C ATOM 138 OH TYR A 10 2.564 -5.594 -5.975 1.00 1.00 O ATOM 0 H TYR A 10 -0.676 -1.642 -10.310 1.00 1.00 H new ATOM 0 HA TYR A 10 1.529 -3.135 -11.701 1.00 1.00 H new ATOM 0 HB2 TYR A 10 -1.146 -4.285 -10.702 1.00 1.00 H new ATOM 0 HB3 TYR A 10 0.081 -5.171 -11.585 1.00 1.00 H new ATOM 0 HD1 TYR A 10 2.601 -4.614 -10.425 1.00 1.00 H new ATOM 0 HD2 TYR A 10 -1.198 -4.841 -8.435 1.00 1.00 H new ATOM 0 HE1 TYR A 10 3.750 -5.149 -8.295 1.00 1.00 H new ATOM 0 HE2 TYR A 10 -0.050 -5.376 -6.303 1.00 1.00 H new ATOM 0 HH TYR A 10 1.899 -5.712 -5.265 1.00 1.00 H new ATOM 148 N SER A 11 0.005 -3.266 -13.791 1.00 1.00 N ATOM 149 CA SER A 11 -0.706 -2.913 -15.052 1.00 1.00 C ATOM 150 C SER A 11 -0.621 -1.404 -15.302 1.00 1.00 C ATOM 151 O SER A 11 -1.506 -0.812 -15.886 1.00 1.00 O ATOM 152 CB SER A 11 -2.156 -3.338 -14.818 1.00 1.00 C ATOM 153 OG SER A 11 -3.023 -2.277 -15.194 1.00 1.00 O ATOM 0 H SER A 11 0.705 -4.003 -13.878 1.00 1.00 H new ATOM 0 HA SER A 11 -0.273 -3.403 -15.924 1.00 1.00 H new ATOM 0 HB2 SER A 11 -2.383 -4.232 -15.399 1.00 1.00 H new ATOM 0 HB3 SER A 11 -2.308 -3.592 -13.769 1.00 1.00 H new ATOM 0 HG SER A 11 -2.698 -1.867 -16.023 1.00 1.00 H new ATOM 159 N GLY A 12 0.439 -0.780 -14.864 1.00 1.00 N ATOM 160 CA GLY A 12 0.580 0.688 -15.078 1.00 1.00 C ATOM 161 C GLY A 12 -0.246 1.441 -14.034 1.00 1.00 C ATOM 162 O GLY A 12 -0.095 2.633 -13.851 1.00 1.00 O ATOM 0 H GLY A 12 1.212 -1.223 -14.368 1.00 1.00 H new ATOM 0 HA2 GLY A 12 1.628 0.977 -15.004 1.00 1.00 H new ATOM 0 HA3 GLY A 12 0.246 0.953 -16.081 1.00 1.00 H new ATOM 166 N VAL A 13 -1.125 0.758 -13.355 1.00 1.00 N ATOM 167 CA VAL A 13 -1.971 1.434 -12.330 1.00 1.00 C ATOM 168 C VAL A 13 -1.268 1.430 -10.969 1.00 1.00 C ATOM 169 O VAL A 13 -0.497 0.542 -10.659 1.00 1.00 O ATOM 170 CB VAL A 13 -3.256 0.610 -12.274 1.00 1.00 C ATOM 171 CG1 VAL A 13 -4.377 1.447 -11.657 1.00 1.00 C ATOM 172 CG2 VAL A 13 -3.653 0.193 -13.692 1.00 1.00 C ATOM 0 H VAL A 13 -1.295 -0.242 -13.465 1.00 1.00 H new ATOM 0 HA VAL A 13 -2.165 2.477 -12.579 1.00 1.00 H new ATOM 0 HB VAL A 13 -3.091 -0.278 -11.664 1.00 1.00 H new ATOM 0 HG11 VAL A 13 -5.293 0.857 -11.618 1.00 1.00 H new ATOM 0 HG12 VAL A 13 -4.095 1.746 -10.647 1.00 1.00 H new ATOM 0 HG13 VAL A 13 -4.544 2.336 -12.265 1.00 1.00 H new ATOM 0 HG21 VAL A 13 -4.570 -0.395 -13.655 1.00 1.00 H new ATOM 0 HG22 VAL A 13 -3.817 1.082 -14.300 1.00 1.00 H new ATOM 0 HG23 VAL A 13 -2.855 -0.406 -14.132 1.00 1.00 H new ATOM 182 N ASP A 14 -1.539 2.409 -10.150 1.00 1.00 N ATOM 183 CA ASP A 14 -0.901 2.461 -8.804 1.00 1.00 C ATOM 184 C ASP A 14 -1.946 2.177 -7.722 1.00 1.00 C ATOM 185 O ASP A 14 -2.960 2.842 -7.640 1.00 1.00 O ATOM 186 CB ASP A 14 -0.362 3.886 -8.673 1.00 1.00 C ATOM 187 CG ASP A 14 0.385 4.030 -7.346 1.00 1.00 C ATOM 188 OD1 ASP A 14 0.412 3.067 -6.597 1.00 1.00 O ATOM 189 OD2 ASP A 14 0.918 5.100 -7.101 1.00 1.00 O ATOM 0 H ASP A 14 -2.177 3.178 -10.356 1.00 1.00 H new ATOM 0 HA ASP A 14 -0.111 1.719 -8.689 1.00 1.00 H new ATOM 0 HB2 ASP A 14 0.306 4.111 -9.505 1.00 1.00 H new ATOM 0 HB3 ASP A 14 -1.182 4.602 -8.720 1.00 1.00 H new ATOM 194 N VAL A 15 -1.714 1.197 -6.893 1.00 1.00 N ATOM 195 CA VAL A 15 -2.706 0.882 -5.825 1.00 1.00 C ATOM 196 C VAL A 15 -1.997 0.406 -4.554 1.00 1.00 C ATOM 197 O VAL A 15 -0.790 0.280 -4.512 1.00 1.00 O ATOM 198 CB VAL A 15 -3.570 -0.237 -6.406 1.00 1.00 C ATOM 199 CG1 VAL A 15 -4.227 0.245 -7.700 1.00 1.00 C ATOM 200 CG2 VAL A 15 -2.694 -1.456 -6.704 1.00 1.00 C ATOM 0 H VAL A 15 -0.885 0.603 -6.908 1.00 1.00 H new ATOM 0 HA VAL A 15 -3.297 1.755 -5.546 1.00 1.00 H new ATOM 0 HB VAL A 15 -4.341 -0.510 -5.686 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -4.843 -0.553 -8.114 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -4.851 1.113 -7.490 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -3.456 0.519 -8.420 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -3.310 -2.254 -7.118 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -1.922 -1.182 -7.424 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -2.225 -1.801 -5.783 1.00 1.00 H new ATOM 210 N TYR A 16 -2.745 0.139 -3.518 1.00 1.00 N ATOM 211 CA TYR A 16 -2.128 -0.333 -2.246 1.00 1.00 C ATOM 212 C TYR A 16 -2.694 -1.704 -1.872 1.00 1.00 C ATOM 213 O TYR A 16 -3.817 -2.028 -2.196 1.00 1.00 O ATOM 214 CB TYR A 16 -2.519 0.713 -1.203 1.00 1.00 C ATOM 215 CG TYR A 16 -2.777 2.034 -1.887 1.00 1.00 C ATOM 216 CD1 TYR A 16 -1.912 2.482 -2.892 1.00 1.00 C ATOM 217 CD2 TYR A 16 -3.881 2.811 -1.516 1.00 1.00 C ATOM 218 CE1 TYR A 16 -2.151 3.707 -3.527 1.00 1.00 C ATOM 219 CE2 TYR A 16 -4.120 4.036 -2.151 1.00 1.00 C ATOM 220 CZ TYR A 16 -3.255 4.484 -3.156 1.00 1.00 C ATOM 221 OH TYR A 16 -3.490 5.691 -3.781 1.00 1.00 O ATOM 0 H TYR A 16 -3.761 0.228 -3.498 1.00 1.00 H new ATOM 0 HA TYR A 16 -1.046 -0.442 -2.323 1.00 1.00 H new ATOM 0 HB2 TYR A 16 -3.410 0.390 -0.665 1.00 1.00 H new ATOM 0 HB3 TYR A 16 -1.723 0.822 -0.466 1.00 1.00 H new ATOM 0 HD1 TYR A 16 -1.060 1.883 -3.178 1.00 1.00 H new ATOM 0 HD2 TYR A 16 -4.548 2.466 -0.740 1.00 1.00 H new ATOM 0 HE1 TYR A 16 -1.484 4.052 -4.303 1.00 1.00 H new ATOM 0 HE2 TYR A 16 -4.972 4.635 -1.865 1.00 1.00 H new ATOM 0 HH TYR A 16 -4.440 5.920 -3.703 1.00 1.00 H new ATOM 231 N GLU A 17 -1.928 -2.516 -1.196 1.00 1.00 N ATOM 232 CA GLU A 17 -2.434 -3.865 -0.814 1.00 1.00 C ATOM 233 C GLU A 17 -2.442 -4.020 0.708 1.00 1.00 C ATOM 234 O GLU A 17 -1.407 -4.053 1.345 1.00 1.00 O ATOM 235 CB GLU A 17 -1.453 -4.850 -1.448 1.00 1.00 C ATOM 236 CG GLU A 17 -0.133 -4.137 -1.746 1.00 1.00 C ATOM 237 CD GLU A 17 0.788 -5.073 -2.531 1.00 1.00 C ATOM 238 OE1 GLU A 17 0.281 -5.817 -3.355 1.00 1.00 O ATOM 239 OE2 GLU A 17 1.985 -5.030 -2.296 1.00 1.00 O ATOM 0 H GLU A 17 -0.977 -2.305 -0.893 1.00 1.00 H new ATOM 0 HA GLU A 17 -3.456 -4.032 -1.153 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -1.281 -5.691 -0.776 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -1.874 -5.258 -2.367 1.00 1.00 H new ATOM 0 HG2 GLU A 17 -0.320 -3.229 -2.319 1.00 1.00 H new ATOM 0 HG3 GLU A 17 0.347 -3.834 -0.815 1.00 1.00 H new ATOM 246 N PHE A 18 -3.603 -4.119 1.294 1.00 1.00 N ATOM 247 CA PHE A 18 -3.685 -4.275 2.773 1.00 1.00 C ATOM 248 C PHE A 18 -4.585 -5.463 3.126 1.00 1.00 C ATOM 249 O PHE A 18 -5.529 -5.768 2.425 1.00 1.00 O ATOM 250 CB PHE A 18 -4.299 -2.969 3.277 1.00 1.00 C ATOM 251 CG PHE A 18 -4.615 -3.098 4.748 1.00 1.00 C ATOM 252 CD1 PHE A 18 -3.793 -3.872 5.576 1.00 1.00 C ATOM 253 CD2 PHE A 18 -5.730 -2.443 5.284 1.00 1.00 C ATOM 254 CE1 PHE A 18 -4.087 -3.992 6.939 1.00 1.00 C ATOM 255 CE2 PHE A 18 -6.024 -2.563 6.647 1.00 1.00 C ATOM 256 CZ PHE A 18 -5.202 -3.337 7.475 1.00 1.00 C ATOM 0 H PHE A 18 -4.501 -4.098 0.811 1.00 1.00 H new ATOM 0 HA PHE A 18 -2.711 -4.466 3.224 1.00 1.00 H new ATOM 0 HB2 PHE A 18 -3.608 -2.142 3.113 1.00 1.00 H new ATOM 0 HB3 PHE A 18 -5.206 -2.741 2.718 1.00 1.00 H new ATOM 0 HD1 PHE A 18 -2.932 -4.376 5.163 1.00 1.00 H new ATOM 0 HD2 PHE A 18 -6.363 -1.845 4.646 1.00 1.00 H new ATOM 0 HE1 PHE A 18 -3.454 -4.590 7.577 1.00 1.00 H new ATOM 0 HE2 PHE A 18 -6.885 -2.059 7.060 1.00 1.00 H new ATOM 0 HZ PHE A 18 -5.428 -3.429 8.527 1.00 1.00 H new ATOM 266 N ILE A 19 -4.298 -6.136 4.205 1.00 1.00 N ATOM 267 CA ILE A 19 -5.138 -7.303 4.598 1.00 1.00 C ATOM 268 C ILE A 19 -6.427 -6.827 5.271 1.00 1.00 C ATOM 269 O ILE A 19 -6.409 -5.987 6.148 1.00 1.00 O ATOM 270 CB ILE A 19 -4.281 -8.096 5.584 1.00 1.00 C ATOM 271 CG1 ILE A 19 -3.090 -8.711 4.844 1.00 1.00 C ATOM 272 CG2 ILE A 19 -5.120 -9.211 6.210 1.00 1.00 C ATOM 273 CD1 ILE A 19 -3.562 -9.911 4.023 1.00 1.00 C ATOM 0 H ILE A 19 -3.520 -5.930 4.831 1.00 1.00 H new ATOM 0 HA ILE A 19 -5.433 -7.905 3.738 1.00 1.00 H new ATOM 0 HB ILE A 19 -3.920 -7.430 6.367 1.00 1.00 H new ATOM 0 HG12 ILE A 19 -2.631 -7.968 4.191 1.00 1.00 H new ATOM 0 HG13 ILE A 19 -2.327 -9.023 5.557 1.00 1.00 H new ATOM 0 HG21 ILE A 19 -4.508 -9.776 6.913 1.00 1.00 H new ATOM 0 HG22 ILE A 19 -5.969 -8.775 6.737 1.00 1.00 H new ATOM 0 HG23 ILE A 19 -5.482 -9.877 5.427 1.00 1.00 H new ATOM 0 HD11 ILE A 19 -2.714 -10.348 3.497 1.00 1.00 H new ATOM 0 HD12 ILE A 19 -4.000 -10.656 4.687 1.00 1.00 H new ATOM 0 HD13 ILE A 19 -4.309 -9.585 3.299 1.00 1.00 H new ATOM 285 N HIS A 20 -7.545 -7.365 4.867 1.00 1.00 N ATOM 286 CA HIS A 20 -8.838 -6.951 5.482 1.00 1.00 C ATOM 287 C HIS A 20 -9.818 -8.125 5.460 1.00 1.00 C ATOM 288 O HIS A 20 -9.452 -9.254 5.722 1.00 1.00 O ATOM 289 CB HIS A 20 -9.347 -5.807 4.605 1.00 1.00 C ATOM 290 CG HIS A 20 -9.178 -4.503 5.336 1.00 1.00 C ATOM 291 ND1 HIS A 20 -8.581 -4.427 6.584 1.00 1.00 N ATOM 292 CD2 HIS A 20 -9.523 -3.216 5.006 1.00 1.00 C ATOM 293 CE1 HIS A 20 -8.584 -3.135 6.957 1.00 1.00 C ATOM 294 NE2 HIS A 20 -9.147 -2.353 6.032 1.00 1.00 N ATOM 0 H HIS A 20 -7.619 -8.074 4.137 1.00 1.00 H new ATOM 0 HA HIS A 20 -8.728 -6.642 6.522 1.00 1.00 H new ATOM 0 HB2 HIS A 20 -8.797 -5.783 3.664 1.00 1.00 H new ATOM 0 HB3 HIS A 20 -10.397 -5.964 4.357 1.00 1.00 H new ATOM 0 HD1 HIS A 20 -8.207 -5.209 7.122 1.00 1.00 H new ATOM 0 HD2 HIS A 20 -10.012 -2.918 4.090 1.00 1.00 H new ATOM 0 HE1 HIS A 20 -8.180 -2.774 7.891 1.00 1.00 H new ATOM 302 N SER A 21 -11.057 -7.877 5.137 1.00 1.00 N ATOM 303 CA SER A 21 -12.045 -8.991 5.089 1.00 1.00 C ATOM 304 C SER A 21 -11.632 -9.995 4.012 1.00 1.00 C ATOM 305 O SER A 21 -11.702 -11.193 4.203 1.00 1.00 O ATOM 306 CB SER A 21 -13.374 -8.331 4.727 1.00 1.00 C ATOM 307 OG SER A 21 -13.197 -7.519 3.574 1.00 1.00 O ATOM 0 H SER A 21 -11.427 -6.955 4.905 1.00 1.00 H new ATOM 0 HA SER A 21 -12.110 -9.534 6.032 1.00 1.00 H new ATOM 0 HB2 SER A 21 -14.131 -9.092 4.537 1.00 1.00 H new ATOM 0 HB3 SER A 21 -13.732 -7.726 5.560 1.00 1.00 H new ATOM 0 HG SER A 21 -12.916 -6.621 3.847 1.00 1.00 H new ATOM 313 N THR A 22 -11.183 -9.512 2.886 1.00 1.00 N ATOM 314 CA THR A 22 -10.744 -10.430 1.800 1.00 1.00 C ATOM 315 C THR A 22 -9.229 -10.621 1.881 1.00 1.00 C ATOM 316 O THR A 22 -8.610 -11.163 0.986 1.00 1.00 O ATOM 317 CB THR A 22 -11.130 -9.725 0.499 1.00 1.00 C ATOM 318 OG1 THR A 22 -10.065 -9.839 -0.434 1.00 1.00 O ATOM 319 CG2 THR A 22 -11.408 -8.247 0.779 1.00 1.00 C ATOM 0 H THR A 22 -11.101 -8.518 2.672 1.00 1.00 H new ATOM 0 HA THR A 22 -11.203 -11.416 1.870 1.00 1.00 H new ATOM 0 HB THR A 22 -12.026 -10.189 0.087 1.00 1.00 H new ATOM 0 HG1 THR A 22 -9.631 -10.711 -0.330 1.00 1.00 H new ATOM 0 HG21 THR A 22 -11.683 -7.746 -0.149 1.00 1.00 H new ATOM 0 HG22 THR A 22 -12.226 -8.160 1.494 1.00 1.00 H new ATOM 0 HG23 THR A 22 -10.514 -7.780 1.192 1.00 1.00 H new ATOM 327 N GLY A 23 -8.630 -10.164 2.945 1.00 1.00 N ATOM 328 CA GLY A 23 -7.155 -10.298 3.087 1.00 1.00 C ATOM 329 C GLY A 23 -6.488 -9.032 2.549 1.00 1.00 C ATOM 330 O GLY A 23 -6.719 -7.944 3.038 1.00 1.00 O ATOM 0 H GLY A 23 -9.100 -9.703 3.724 1.00 1.00 H new ATOM 0 HA2 GLY A 23 -6.889 -10.448 4.133 1.00 1.00 H new ATOM 0 HA3 GLY A 23 -6.802 -11.172 2.540 1.00 1.00 H new ATOM 334 N SER A 24 -5.667 -9.162 1.545 1.00 1.00 N ATOM 335 CA SER A 24 -4.988 -7.963 0.974 1.00 1.00 C ATOM 336 C SER A 24 -5.959 -7.170 0.097 1.00 1.00 C ATOM 337 O SER A 24 -6.670 -7.724 -0.718 1.00 1.00 O ATOM 338 CB SER A 24 -3.841 -8.522 0.135 1.00 1.00 C ATOM 339 OG SER A 24 -3.153 -7.448 -0.493 1.00 1.00 O ATOM 0 H SER A 24 -5.436 -10.047 1.094 1.00 1.00 H new ATOM 0 HA SER A 24 -4.634 -7.282 1.748 1.00 1.00 H new ATOM 0 HB2 SER A 24 -3.156 -9.089 0.766 1.00 1.00 H new ATOM 0 HB3 SER A 24 -4.227 -9.211 -0.616 1.00 1.00 H new ATOM 0 HG SER A 24 -2.398 -7.800 -1.009 1.00 1.00 H new ATOM 345 N ILE A 25 -5.992 -5.876 0.256 1.00 1.00 N ATOM 346 CA ILE A 25 -6.913 -5.045 -0.570 1.00 1.00 C ATOM 347 C ILE A 25 -6.109 -4.091 -1.455 1.00 1.00 C ATOM 348 O ILE A 25 -5.267 -3.353 -0.982 1.00 1.00 O ATOM 349 CB ILE A 25 -7.752 -4.262 0.439 1.00 1.00 C ATOM 350 CG1 ILE A 25 -8.060 -5.152 1.646 1.00 1.00 C ATOM 351 CG2 ILE A 25 -9.062 -3.821 -0.216 1.00 1.00 C ATOM 352 CD1 ILE A 25 -7.782 -4.379 2.936 1.00 1.00 C ATOM 0 H ILE A 25 -5.420 -5.357 0.923 1.00 1.00 H new ATOM 0 HA ILE A 25 -7.533 -5.648 -1.233 1.00 1.00 H new ATOM 0 HB ILE A 25 -7.197 -3.383 0.767 1.00 1.00 H new ATOM 0 HG12 ILE A 25 -9.102 -5.472 1.619 1.00 1.00 H new ATOM 0 HG13 ILE A 25 -7.449 -6.054 1.611 1.00 1.00 H new ATOM 0 HG21 ILE A 25 -9.659 -3.263 0.505 1.00 1.00 H new ATOM 0 HG22 ILE A 25 -8.844 -3.187 -1.075 1.00 1.00 H new ATOM 0 HG23 ILE A 25 -9.618 -4.699 -0.545 1.00 1.00 H new ATOM 0 HD11 ILE A 25 -8.002 -5.013 3.795 1.00 1.00 H new ATOM 0 HD12 ILE A 25 -6.734 -4.081 2.963 1.00 1.00 H new ATOM 0 HD13 ILE A 25 -8.412 -3.490 2.971 1.00 1.00 H new ATOM 364 N MET A 26 -6.362 -4.097 -2.736 1.00 1.00 N ATOM 365 CA MET A 26 -5.606 -3.187 -3.643 1.00 1.00 C ATOM 366 C MET A 26 -6.554 -2.171 -4.289 1.00 1.00 C ATOM 367 O MET A 26 -7.538 -2.529 -4.904 1.00 1.00 O ATOM 368 CB MET A 26 -4.998 -4.102 -4.706 1.00 1.00 C ATOM 369 CG MET A 26 -3.588 -4.516 -4.278 1.00 1.00 C ATOM 370 SD MET A 26 -3.029 -5.899 -5.303 1.00 1.00 S ATOM 371 CE MET A 26 -2.056 -4.929 -6.482 1.00 1.00 C ATOM 0 H MET A 26 -7.056 -4.690 -3.192 1.00 1.00 H new ATOM 0 HA MET A 26 -4.845 -2.616 -3.111 1.00 1.00 H new ATOM 0 HB2 MET A 26 -5.622 -4.985 -4.841 1.00 1.00 H new ATOM 0 HB3 MET A 26 -4.962 -3.587 -5.666 1.00 1.00 H new ATOM 0 HG2 MET A 26 -2.903 -3.674 -4.380 1.00 1.00 H new ATOM 0 HG3 MET A 26 -3.585 -4.804 -3.227 1.00 1.00 H new ATOM 0 HE1 MET A 26 -1.582 -5.598 -7.200 1.00 1.00 H new ATOM 0 HE2 MET A 26 -2.710 -4.235 -7.010 1.00 1.00 H new ATOM 0 HE3 MET A 26 -1.289 -4.369 -5.947 1.00 1.00 H new ATOM 381 N LYS A 27 -6.262 -0.907 -4.150 1.00 1.00 N ATOM 382 CA LYS A 27 -7.144 0.135 -4.751 1.00 1.00 C ATOM 383 C LYS A 27 -6.448 0.803 -5.938 1.00 1.00 C ATOM 384 O LYS A 27 -5.257 0.663 -6.132 1.00 1.00 O ATOM 385 CB LYS A 27 -7.379 1.147 -3.628 1.00 1.00 C ATOM 386 CG LYS A 27 -7.976 0.434 -2.414 1.00 1.00 C ATOM 387 CD LYS A 27 -8.154 1.434 -1.270 1.00 1.00 C ATOM 388 CE LYS A 27 -6.793 1.735 -0.637 1.00 1.00 C ATOM 389 NZ LYS A 27 -6.734 3.219 -0.542 1.00 1.00 N ATOM 0 H LYS A 27 -5.450 -0.550 -3.646 1.00 1.00 H new ATOM 0 HA LYS A 27 -8.077 -0.283 -5.128 1.00 1.00 H new ATOM 0 HB2 LYS A 27 -6.440 1.628 -3.355 1.00 1.00 H new ATOM 0 HB3 LYS A 27 -8.052 1.934 -3.968 1.00 1.00 H new ATOM 0 HG2 LYS A 27 -8.937 -0.010 -2.676 1.00 1.00 H new ATOM 0 HG3 LYS A 27 -7.323 -0.381 -2.100 1.00 1.00 H new ATOM 0 HD2 LYS A 27 -8.604 2.354 -1.644 1.00 1.00 H new ATOM 0 HD3 LYS A 27 -8.833 1.028 -0.521 1.00 1.00 H new ATOM 0 HE2 LYS A 27 -6.704 1.272 0.346 1.00 1.00 H new ATOM 0 HE3 LYS A 27 -5.979 1.346 -1.248 1.00 1.00 H new ATOM 0 HZ1 LYS A 27 -5.792 3.548 -0.833 1.00 1.00 H new ATOM 0 HZ2 LYS A 27 -7.454 3.636 -1.166 1.00 1.00 H new ATOM 0 HZ3 LYS A 27 -6.915 3.511 0.440 1.00 1.00 H new ATOM 402 N ARG A 28 -7.183 1.534 -6.733 1.00 1.00 N ATOM 403 CA ARG A 28 -6.564 2.214 -7.905 1.00 1.00 C ATOM 404 C ARG A 28 -6.049 3.598 -7.496 1.00 1.00 C ATOM 405 O ARG A 28 -6.740 4.364 -6.855 1.00 1.00 O ATOM 406 CB ARG A 28 -7.692 2.339 -8.931 1.00 1.00 C ATOM 407 CG ARG A 28 -7.100 2.367 -10.341 1.00 1.00 C ATOM 408 CD ARG A 28 -7.856 3.390 -11.192 1.00 1.00 C ATOM 409 NE ARG A 28 -8.474 2.594 -12.289 1.00 1.00 N ATOM 410 CZ ARG A 28 -7.806 1.620 -12.844 1.00 1.00 C ATOM 411 NH1 ARG A 28 -6.596 1.345 -12.441 1.00 1.00 N ATOM 412 NH2 ARG A 28 -8.349 0.920 -13.803 1.00 1.00 N ATOM 0 H ARG A 28 -8.185 1.689 -6.621 1.00 1.00 H new ATOM 0 HA ARG A 28 -5.712 1.663 -8.304 1.00 1.00 H new ATOM 0 HB2 ARG A 28 -8.382 1.501 -8.832 1.00 1.00 H new ATOM 0 HB3 ARG A 28 -8.265 3.248 -8.748 1.00 1.00 H new ATOM 0 HG2 ARG A 28 -6.042 2.625 -10.298 1.00 1.00 H new ATOM 0 HG3 ARG A 28 -7.168 1.379 -10.795 1.00 1.00 H new ATOM 0 HD2 ARG A 28 -8.614 3.909 -10.605 1.00 1.00 H new ATOM 0 HD3 ARG A 28 -7.182 4.151 -11.587 1.00 1.00 H new ATOM 0 HE ARG A 28 -9.419 2.810 -12.606 1.00 1.00 H new ATOM 0 HH11 ARG A 28 -6.172 1.891 -11.692 1.00 1.00 H new ATOM 0 HH12 ARG A 28 -6.075 0.584 -12.875 1.00 1.00 H new ATOM 0 HH21 ARG A 28 -9.295 1.135 -14.118 1.00 1.00 H new ATOM 0 HH22 ARG A 28 -7.827 0.159 -14.237 1.00 1.00 H new ATOM 425 N LYS A 29 -4.837 3.918 -7.857 1.00 1.00 N ATOM 426 CA LYS A 29 -4.271 5.248 -7.483 1.00 1.00 C ATOM 427 C LYS A 29 -5.015 6.371 -8.210 1.00 1.00 C ATOM 428 O LYS A 29 -5.214 7.444 -7.675 1.00 1.00 O ATOM 429 CB LYS A 29 -2.815 5.195 -7.935 1.00 1.00 C ATOM 430 CG LYS A 29 -2.216 6.603 -7.894 1.00 1.00 C ATOM 431 CD LYS A 29 -0.785 6.565 -8.433 1.00 1.00 C ATOM 432 CE LYS A 29 -0.209 7.983 -8.455 1.00 1.00 C ATOM 433 NZ LYS A 29 1.178 7.825 -8.973 1.00 1.00 N ATOM 0 H LYS A 29 -4.213 3.317 -8.395 1.00 1.00 H new ATOM 0 HA LYS A 29 -4.364 5.448 -6.416 1.00 1.00 H new ATOM 0 HB2 LYS A 29 -2.246 4.527 -7.288 1.00 1.00 H new ATOM 0 HB3 LYS A 29 -2.751 4.790 -8.945 1.00 1.00 H new ATOM 0 HG2 LYS A 29 -2.822 7.285 -8.490 1.00 1.00 H new ATOM 0 HG3 LYS A 29 -2.221 6.982 -6.872 1.00 1.00 H new ATOM 0 HD2 LYS A 29 -0.167 5.920 -7.808 1.00 1.00 H new ATOM 0 HD3 LYS A 29 -0.775 6.141 -9.437 1.00 1.00 H new ATOM 0 HE2 LYS A 29 -0.798 8.639 -9.096 1.00 1.00 H new ATOM 0 HE3 LYS A 29 -0.211 8.426 -7.459 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 1.640 8.756 -9.018 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 1.717 7.201 -8.339 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 1.148 7.408 -9.925 1.00 1.00 H new ATOM 446 N LYS A 30 -5.424 6.136 -9.426 1.00 1.00 N ATOM 447 CA LYS A 30 -6.150 7.195 -10.182 1.00 1.00 C ATOM 448 C LYS A 30 -7.298 7.754 -9.338 1.00 1.00 C ATOM 449 O LYS A 30 -7.356 8.934 -9.053 1.00 1.00 O ATOM 450 CB LYS A 30 -6.695 6.493 -11.426 1.00 1.00 C ATOM 451 CG LYS A 30 -5.633 5.546 -11.988 1.00 1.00 C ATOM 452 CD LYS A 30 -6.148 4.912 -13.281 1.00 1.00 C ATOM 453 CE LYS A 30 -5.594 3.491 -13.410 1.00 1.00 C ATOM 454 NZ LYS A 30 -4.543 3.582 -14.460 1.00 1.00 N ATOM 0 H LYS A 30 -5.287 5.259 -9.928 1.00 1.00 H new ATOM 0 HA LYS A 30 -5.504 8.035 -10.438 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -7.598 5.936 -11.175 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -6.974 7.230 -12.179 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -4.709 6.092 -12.181 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -5.399 4.771 -11.258 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -7.238 4.890 -13.278 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -5.843 5.512 -14.139 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -5.178 3.142 -12.465 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -6.376 2.787 -13.694 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -4.828 3.018 -15.286 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -4.421 4.575 -14.744 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -3.645 3.216 -14.085 1.00 1.00 H new ATOM 467 N ASP A 31 -8.212 6.914 -8.936 1.00 1.00 N ATOM 468 CA ASP A 31 -9.358 7.397 -8.112 1.00 1.00 C ATOM 469 C ASP A 31 -9.327 6.749 -6.724 1.00 1.00 C ATOM 470 O ASP A 31 -10.286 6.810 -5.980 1.00 1.00 O ATOM 471 CB ASP A 31 -10.609 6.965 -8.877 1.00 1.00 C ATOM 472 CG ASP A 31 -11.379 8.205 -9.336 1.00 1.00 C ATOM 473 OD1 ASP A 31 -10.823 8.973 -10.103 1.00 1.00 O ATOM 474 OD2 ASP A 31 -12.511 8.366 -8.912 1.00 1.00 O ATOM 0 H ASP A 31 -8.216 5.915 -9.142 1.00 1.00 H new ATOM 0 HA ASP A 31 -9.327 8.476 -7.958 1.00 1.00 H new ATOM 0 HB2 ASP A 31 -10.330 6.357 -9.738 1.00 1.00 H new ATOM 0 HB3 ASP A 31 -11.242 6.346 -8.241 1.00 1.00 H new ATOM 479 N ASP A 32 -8.234 6.132 -6.369 1.00 1.00 N ATOM 480 CA ASP A 32 -8.148 5.483 -5.029 1.00 1.00 C ATOM 481 C ASP A 32 -9.413 4.666 -4.751 1.00 1.00 C ATOM 482 O ASP A 32 -10.138 4.927 -3.812 1.00 1.00 O ATOM 483 CB ASP A 32 -8.032 6.642 -4.037 1.00 1.00 C ATOM 484 CG ASP A 32 -7.165 6.215 -2.852 1.00 1.00 C ATOM 485 OD1 ASP A 32 -6.304 5.373 -3.046 1.00 1.00 O ATOM 486 OD2 ASP A 32 -7.376 6.737 -1.770 1.00 1.00 O ATOM 0 H ASP A 32 -7.398 6.049 -6.947 1.00 1.00 H new ATOM 0 HA ASP A 32 -7.305 4.795 -4.957 1.00 1.00 H new ATOM 0 HB2 ASP A 32 -7.594 7.511 -4.527 1.00 1.00 H new ATOM 0 HB3 ASP A 32 -9.022 6.937 -3.689 1.00 1.00 H new ATOM 491 N TRP A 33 -9.683 3.676 -5.559 1.00 1.00 N ATOM 492 CA TRP A 33 -10.900 2.843 -5.338 1.00 1.00 C ATOM 493 C TRP A 33 -10.569 1.658 -4.426 1.00 1.00 C ATOM 494 O TRP A 33 -9.426 1.272 -4.282 1.00 1.00 O ATOM 495 CB TRP A 33 -11.311 2.351 -6.725 1.00 1.00 C ATOM 496 CG TRP A 33 -11.094 3.436 -7.730 1.00 1.00 C ATOM 497 CD1 TRP A 33 -9.890 3.952 -8.068 1.00 1.00 C ATOM 498 CD2 TRP A 33 -12.082 4.143 -8.534 1.00 1.00 C ATOM 499 NE1 TRP A 33 -10.077 4.930 -9.029 1.00 1.00 N ATOM 500 CE2 TRP A 33 -11.411 5.085 -9.348 1.00 1.00 C ATOM 501 CE3 TRP A 33 -13.483 4.059 -8.633 1.00 1.00 C ATOM 502 CZ2 TRP A 33 -12.104 5.915 -10.230 1.00 1.00 C ATOM 503 CZ3 TRP A 33 -14.184 4.893 -9.521 1.00 1.00 C ATOM 504 CH2 TRP A 33 -13.495 5.819 -10.318 1.00 1.00 C ATOM 0 H TRP A 33 -9.114 3.408 -6.362 1.00 1.00 H new ATOM 0 HA TRP A 33 -11.699 3.406 -4.856 1.00 1.00 H new ATOM 0 HB2 TRP A 33 -10.729 1.470 -6.996 1.00 1.00 H new ATOM 0 HB3 TRP A 33 -12.359 2.052 -6.719 1.00 1.00 H new ATOM 0 HD1 TRP A 33 -8.939 3.650 -7.655 1.00 1.00 H new ATOM 0 HE1 TRP A 33 -9.321 5.470 -9.450 1.00 1.00 H new ATOM 0 HE3 TRP A 33 -14.023 3.350 -8.023 1.00 1.00 H new ATOM 0 HZ2 TRP A 33 -11.569 6.627 -10.841 1.00 1.00 H new ATOM 0 HZ3 TRP A 33 -15.259 4.820 -9.590 1.00 1.00 H new ATOM 0 HH2 TRP A 33 -14.039 6.457 -10.999 1.00 1.00 H new ATOM 515 N VAL A 34 -11.563 1.076 -3.813 1.00 1.00 N ATOM 516 CA VAL A 34 -11.309 -0.084 -2.913 1.00 1.00 C ATOM 517 C VAL A 34 -12.148 -1.285 -3.358 1.00 1.00 C ATOM 518 O VAL A 34 -13.245 -1.134 -3.857 1.00 1.00 O ATOM 519 CB VAL A 34 -11.742 0.388 -1.525 1.00 1.00 C ATOM 520 CG1 VAL A 34 -11.031 -0.443 -0.457 1.00 1.00 C ATOM 521 CG2 VAL A 34 -11.373 1.863 -1.352 1.00 1.00 C ATOM 0 H VAL A 34 -12.541 1.354 -3.897 1.00 1.00 H new ATOM 0 HA VAL A 34 -10.266 -0.399 -2.927 1.00 1.00 H new ATOM 0 HB VAL A 34 -12.820 0.267 -1.420 1.00 1.00 H new ATOM 0 HG11 VAL A 34 -11.340 -0.106 0.532 1.00 1.00 H new ATOM 0 HG12 VAL A 34 -11.292 -1.494 -0.580 1.00 1.00 H new ATOM 0 HG13 VAL A 34 -9.953 -0.323 -0.561 1.00 1.00 H new ATOM 0 HG21 VAL A 34 -11.681 2.202 -0.363 1.00 1.00 H new ATOM 0 HG22 VAL A 34 -10.295 1.983 -1.457 1.00 1.00 H new ATOM 0 HG23 VAL A 34 -11.880 2.457 -2.113 1.00 1.00 H new ATOM 531 N ASN A 35 -11.643 -2.474 -3.180 1.00 1.00 N ATOM 532 CA ASN A 35 -12.415 -3.680 -3.596 1.00 1.00 C ATOM 533 C ASN A 35 -13.740 -3.748 -2.832 1.00 1.00 C ATOM 534 O ASN A 35 -13.787 -4.143 -1.684 1.00 1.00 O ATOM 535 CB ASN A 35 -11.520 -4.865 -3.229 1.00 1.00 C ATOM 536 CG ASN A 35 -12.385 -6.104 -2.986 1.00 1.00 C ATOM 537 OD1 ASN A 35 -12.484 -6.580 -1.873 1.00 1.00 O ATOM 538 ND2 ASN A 35 -13.019 -6.648 -3.988 1.00 1.00 N ATOM 0 H ASN A 35 -10.731 -2.663 -2.765 1.00 1.00 H new ATOM 0 HA ASN A 35 -12.663 -3.669 -4.657 1.00 1.00 H new ATOM 0 HB2 ASN A 35 -10.807 -5.058 -4.031 1.00 1.00 H new ATOM 0 HB3 ASN A 35 -10.940 -4.633 -2.336 1.00 1.00 H new ATOM 0 HD21 ASN A 35 -13.598 -7.474 -3.837 1.00 1.00 H new ATOM 0 HD22 ASN A 35 -12.935 -6.248 -4.922 1.00 1.00 H new ATOM 545 N ALA A 36 -14.817 -3.367 -3.462 1.00 1.00 N ATOM 546 CA ALA A 36 -16.140 -3.411 -2.773 1.00 1.00 C ATOM 547 C ALA A 36 -16.238 -4.658 -1.891 1.00 1.00 C ATOM 548 O ALA A 36 -16.974 -4.687 -0.925 1.00 1.00 O ATOM 549 CB ALA A 36 -17.172 -3.468 -3.898 1.00 1.00 C ATOM 0 H ALA A 36 -14.839 -3.027 -4.423 1.00 1.00 H new ATOM 0 HA ALA A 36 -16.294 -2.550 -2.122 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -18.174 -3.503 -3.471 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -17.075 -2.582 -4.526 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -17.004 -4.360 -4.501 1.00 1.00 H new ATOM 555 N THR A 37 -15.497 -5.687 -2.205 1.00 1.00 N ATOM 556 CA THR A 37 -15.554 -6.918 -1.365 1.00 1.00 C ATOM 557 C THR A 37 -15.060 -6.593 0.044 1.00 1.00 C ATOM 558 O THR A 37 -15.737 -6.840 1.024 1.00 1.00 O ATOM 559 CB THR A 37 -14.625 -7.922 -2.046 1.00 1.00 C ATOM 560 OG1 THR A 37 -14.875 -7.924 -3.445 1.00 1.00 O ATOM 561 CG2 THR A 37 -14.883 -9.317 -1.476 1.00 1.00 C ATOM 0 H THR A 37 -14.860 -5.729 -3.000 1.00 1.00 H new ATOM 0 HA THR A 37 -16.565 -7.315 -1.274 1.00 1.00 H new ATOM 0 HB THR A 37 -13.587 -7.642 -1.865 1.00 1.00 H new ATOM 0 HG1 THR A 37 -14.534 -8.755 -3.837 1.00 1.00 H new ATOM 0 HG21 THR A 37 -14.222 -10.036 -1.960 1.00 1.00 H new ATOM 0 HG22 THR A 37 -14.691 -9.313 -0.403 1.00 1.00 H new ATOM 0 HG23 THR A 37 -15.920 -9.598 -1.658 1.00 1.00 H new ATOM 569 N HIS A 38 -13.893 -6.019 0.153 1.00 1.00 N ATOM 570 CA HIS A 38 -13.373 -5.656 1.499 1.00 1.00 C ATOM 571 C HIS A 38 -14.373 -4.714 2.169 1.00 1.00 C ATOM 572 O HIS A 38 -14.495 -4.668 3.378 1.00 1.00 O ATOM 573 CB HIS A 38 -12.044 -4.944 1.240 1.00 1.00 C ATOM 574 CG HIS A 38 -12.105 -3.548 1.795 1.00 1.00 C ATOM 575 ND1 HIS A 38 -11.043 -2.979 2.480 1.00 1.00 N ATOM 576 CD2 HIS A 38 -13.091 -2.594 1.774 1.00 1.00 C ATOM 577 CE1 HIS A 38 -11.412 -1.736 2.841 1.00 1.00 C ATOM 578 NE2 HIS A 38 -12.652 -1.450 2.435 1.00 1.00 N ATOM 0 H HIS A 38 -13.280 -5.787 -0.629 1.00 1.00 H new ATOM 0 HA HIS A 38 -13.234 -6.517 2.152 1.00 1.00 H new ATOM 0 HB2 HIS A 38 -11.227 -5.496 1.705 1.00 1.00 H new ATOM 0 HB3 HIS A 38 -11.839 -4.912 0.170 1.00 1.00 H new ATOM 0 HD2 HIS A 38 -14.061 -2.713 1.314 1.00 1.00 H new ATOM 0 HE1 HIS A 38 -10.782 -1.053 3.392 1.00 1.00 H new ATOM 0 HE2 HIS A 38 -13.166 -0.581 2.578 1.00 1.00 H new ATOM 586 N ILE A 39 -15.100 -3.976 1.376 1.00 1.00 N ATOM 587 CA ILE A 39 -16.116 -3.040 1.930 1.00 1.00 C ATOM 588 C ILE A 39 -17.460 -3.761 2.055 1.00 1.00 C ATOM 589 O ILE A 39 -18.129 -3.685 3.066 1.00 1.00 O ATOM 590 CB ILE A 39 -16.206 -1.913 0.902 1.00 1.00 C ATOM 591 CG1 ILE A 39 -17.184 -0.847 1.396 1.00 1.00 C ATOM 592 CG2 ILE A 39 -16.701 -2.479 -0.429 1.00 1.00 C ATOM 593 CD1 ILE A 39 -18.332 -0.714 0.396 1.00 1.00 C ATOM 0 H ILE A 39 -15.032 -3.982 0.358 1.00 1.00 H new ATOM 0 HA ILE A 39 -15.854 -2.667 2.920 1.00 1.00 H new ATOM 0 HB ILE A 39 -15.221 -1.466 0.766 1.00 1.00 H new ATOM 0 HG12 ILE A 39 -17.571 -1.119 2.378 1.00 1.00 H new ATOM 0 HG13 ILE A 39 -16.672 0.109 1.509 1.00 1.00 H new ATOM 0 HG21 ILE A 39 -16.766 -1.677 -1.164 1.00 1.00 H new ATOM 0 HG22 ILE A 39 -16.005 -3.239 -0.783 1.00 1.00 H new ATOM 0 HG23 ILE A 39 -17.686 -2.925 -0.291 1.00 1.00 H new ATOM 0 HD11 ILE A 39 -19.032 0.045 0.745 1.00 1.00 H new ATOM 0 HD12 ILE A 39 -17.935 -0.423 -0.577 1.00 1.00 H new ATOM 0 HD13 ILE A 39 -18.849 -1.670 0.306 1.00 1.00 H new ATOM 605 N LEU A 40 -17.852 -4.467 1.028 1.00 1.00 N ATOM 606 CA LEU A 40 -19.146 -5.207 1.076 1.00 1.00 C ATOM 607 C LEU A 40 -18.923 -6.625 1.607 1.00 1.00 C ATOM 608 O LEU A 40 -19.594 -7.071 2.516 1.00 1.00 O ATOM 609 CB LEU A 40 -19.635 -5.244 -0.373 1.00 1.00 C ATOM 610 CG LEU A 40 -20.460 -3.989 -0.665 1.00 1.00 C ATOM 611 CD1 LEU A 40 -21.936 -4.367 -0.796 1.00 1.00 C ATOM 612 CD2 LEU A 40 -20.289 -2.992 0.482 1.00 1.00 C ATOM 0 H LEU A 40 -17.331 -4.563 0.157 1.00 1.00 H new ATOM 0 HA LEU A 40 -19.871 -4.732 1.737 1.00 1.00 H new ATOM 0 HB2 LEU A 40 -18.785 -5.300 -1.053 1.00 1.00 H new ATOM 0 HB3 LEU A 40 -20.238 -6.136 -0.542 1.00 1.00 H new ATOM 0 HG LEU A 40 -20.118 -3.537 -1.596 1.00 1.00 H new ATOM 0 HD11 LEU A 40 -22.524 -3.473 -1.004 1.00 1.00 H new ATOM 0 HD12 LEU A 40 -22.058 -5.079 -1.612 1.00 1.00 H new ATOM 0 HD13 LEU A 40 -22.280 -4.819 0.134 1.00 1.00 H new ATOM 0 HD21 LEU A 40 -20.876 -2.097 0.276 1.00 1.00 H new ATOM 0 HD22 LEU A 40 -20.632 -3.445 1.412 1.00 1.00 H new ATOM 0 HD23 LEU A 40 -19.237 -2.723 0.576 1.00 1.00 H new ATOM 624 N LYS A 41 -17.978 -7.336 1.053 1.00 1.00 N ATOM 625 CA LYS A 41 -17.708 -8.723 1.532 1.00 1.00 C ATOM 626 C LYS A 41 -17.183 -8.683 2.968 1.00 1.00 C ATOM 627 O LYS A 41 -17.320 -9.628 3.720 1.00 1.00 O ATOM 628 CB LYS A 41 -16.642 -9.273 0.584 1.00 1.00 C ATOM 629 CG LYS A 41 -15.298 -9.342 1.313 1.00 1.00 C ATOM 630 CD LYS A 41 -15.227 -10.632 2.131 1.00 1.00 C ATOM 631 CE LYS A 41 -14.124 -11.533 1.571 1.00 1.00 C ATOM 632 NZ LYS A 41 -14.797 -12.829 1.280 1.00 1.00 N ATOM 0 H LYS A 41 -17.381 -7.017 0.290 1.00 1.00 H new ATOM 0 HA LYS A 41 -18.604 -9.344 1.534 1.00 1.00 H new ATOM 0 HB2 LYS A 41 -16.929 -10.264 0.233 1.00 1.00 H new ATOM 0 HB3 LYS A 41 -16.558 -8.635 -0.296 1.00 1.00 H new ATOM 0 HG2 LYS A 41 -14.480 -9.310 0.593 1.00 1.00 H new ATOM 0 HG3 LYS A 41 -15.182 -8.477 1.967 1.00 1.00 H new ATOM 0 HD2 LYS A 41 -15.026 -10.401 3.177 1.00 1.00 H new ATOM 0 HD3 LYS A 41 -16.186 -11.149 2.097 1.00 1.00 H new ATOM 0 HE2 LYS A 41 -13.684 -11.105 0.670 1.00 1.00 H new ATOM 0 HE3 LYS A 41 -13.315 -11.661 2.291 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 -14.473 -13.189 0.360 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 -14.562 -13.517 2.024 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 -15.827 -12.687 1.253 1.00 1.00 H new ATOM 645 N ALA A 42 -16.591 -7.588 3.355 1.00 1.00 N ATOM 646 CA ALA A 42 -16.065 -7.477 4.744 1.00 1.00 C ATOM 647 C ALA A 42 -17.222 -7.609 5.737 1.00 1.00 C ATOM 648 O ALA A 42 -17.030 -7.922 6.896 1.00 1.00 O ATOM 649 CB ALA A 42 -15.441 -6.085 4.826 1.00 1.00 C ATOM 0 H ALA A 42 -16.449 -6.765 2.770 1.00 1.00 H new ATOM 0 HA ALA A 42 -15.339 -8.254 4.982 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -15.030 -5.929 5.824 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -14.644 -6.000 4.088 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -16.203 -5.332 4.625 1.00 1.00 H new ATOM 655 N ALA A 43 -18.423 -7.370 5.285 1.00 1.00 N ATOM 656 CA ALA A 43 -19.598 -7.476 6.194 1.00 1.00 C ATOM 657 C ALA A 43 -20.658 -8.408 5.595 1.00 1.00 C ATOM 658 O ALA A 43 -21.676 -8.670 6.201 1.00 1.00 O ATOM 659 CB ALA A 43 -20.141 -6.051 6.305 1.00 1.00 C ATOM 0 H ALA A 43 -18.641 -7.106 4.324 1.00 1.00 H new ATOM 0 HA ALA A 43 -19.328 -7.890 7.166 1.00 1.00 H new ATOM 0 HB1 ALA A 43 -21.012 -6.043 6.961 1.00 1.00 H new ATOM 0 HB2 ALA A 43 -19.371 -5.399 6.717 1.00 1.00 H new ATOM 0 HB3 ALA A 43 -20.428 -5.693 5.316 1.00 1.00 H new ATOM 665 N ASN A 44 -20.431 -8.908 4.409 1.00 1.00 N ATOM 666 CA ASN A 44 -21.437 -9.818 3.787 1.00 1.00 C ATOM 667 C ASN A 44 -20.765 -11.099 3.285 1.00 1.00 C ATOM 668 O ASN A 44 -21.367 -11.894 2.592 1.00 1.00 O ATOM 669 CB ASN A 44 -22.019 -9.024 2.617 1.00 1.00 C ATOM 670 CG ASN A 44 -21.389 -7.631 2.580 1.00 1.00 C ATOM 671 OD1 ASN A 44 -21.043 -7.080 3.606 1.00 1.00 O ATOM 672 ND2 ASN A 44 -21.225 -7.033 1.432 1.00 1.00 N ATOM 0 H ASN A 44 -19.599 -8.727 3.848 1.00 1.00 H new ATOM 0 HA ASN A 44 -22.205 -10.125 4.497 1.00 1.00 H new ATOM 0 HB2 ASN A 44 -21.828 -9.546 1.679 1.00 1.00 H new ATOM 0 HB3 ASN A 44 -23.101 -8.942 2.722 1.00 1.00 H new ATOM 0 HD21 ASN A 44 -20.807 -6.103 1.396 1.00 1.00 H new ATOM 0 HD22 ASN A 44 -21.515 -7.495 0.570 1.00 1.00 H new ATOM 679 N PHE A 45 -19.523 -11.306 3.626 1.00 1.00 N ATOM 680 CA PHE A 45 -18.821 -12.537 3.163 1.00 1.00 C ATOM 681 C PHE A 45 -18.946 -12.674 1.643 1.00 1.00 C ATOM 682 O PHE A 45 -19.902 -12.222 1.047 1.00 1.00 O ATOM 683 CB PHE A 45 -19.540 -13.690 3.865 1.00 1.00 C ATOM 684 CG PHE A 45 -18.622 -14.303 4.895 1.00 1.00 C ATOM 685 CD1 PHE A 45 -17.340 -14.729 4.527 1.00 1.00 C ATOM 686 CD2 PHE A 45 -19.054 -14.445 6.220 1.00 1.00 C ATOM 687 CE1 PHE A 45 -16.490 -15.296 5.484 1.00 1.00 C ATOM 688 CE2 PHE A 45 -18.203 -15.013 7.175 1.00 1.00 C ATOM 689 CZ PHE A 45 -16.921 -15.439 6.807 1.00 1.00 C ATOM 0 H PHE A 45 -18.965 -10.678 4.204 1.00 1.00 H new ATOM 0 HA PHE A 45 -17.756 -12.519 3.395 1.00 1.00 H new ATOM 0 HB2 PHE A 45 -20.450 -13.328 4.343 1.00 1.00 H new ATOM 0 HB3 PHE A 45 -19.841 -14.443 3.136 1.00 1.00 H new ATOM 0 HD1 PHE A 45 -17.007 -14.620 3.505 1.00 1.00 H new ATOM 0 HD2 PHE A 45 -20.043 -14.116 6.504 1.00 1.00 H new ATOM 0 HE1 PHE A 45 -15.501 -15.623 5.201 1.00 1.00 H new ATOM 0 HE2 PHE A 45 -18.535 -15.123 8.197 1.00 1.00 H new ATOM 0 HZ PHE A 45 -16.265 -15.878 7.544 1.00 1.00 H new ATOM 699 N ALA A 46 -17.985 -13.291 1.011 1.00 1.00 N ATOM 700 CA ALA A 46 -18.052 -13.450 -0.470 1.00 1.00 C ATOM 701 C ALA A 46 -18.844 -14.707 -0.835 1.00 1.00 C ATOM 702 O ALA A 46 -18.307 -15.793 -0.932 1.00 1.00 O ATOM 703 CB ALA A 46 -16.599 -13.576 -0.925 1.00 1.00 C ATOM 0 H ALA A 46 -17.158 -13.691 1.455 1.00 1.00 H new ATOM 0 HA ALA A 46 -18.555 -12.611 -0.951 1.00 1.00 H new ATOM 0 HB1 ALA A 46 -16.566 -13.697 -2.008 1.00 1.00 H new ATOM 0 HB2 ALA A 46 -16.050 -12.677 -0.643 1.00 1.00 H new ATOM 0 HB3 ALA A 46 -16.143 -14.444 -0.449 1.00 1.00 H new ATOM 709 N LYS A 47 -20.119 -14.555 -1.045 1.00 1.00 N ATOM 710 CA LYS A 47 -20.972 -15.717 -1.415 1.00 1.00 C ATOM 711 C LYS A 47 -21.965 -15.276 -2.488 1.00 1.00 C ATOM 712 O LYS A 47 -21.829 -14.212 -3.061 1.00 1.00 O ATOM 713 CB LYS A 47 -21.700 -16.108 -0.129 1.00 1.00 C ATOM 714 CG LYS A 47 -22.111 -17.579 -0.200 1.00 1.00 C ATOM 715 CD LYS A 47 -23.186 -17.862 0.852 1.00 1.00 C ATOM 716 CE LYS A 47 -24.565 -17.537 0.273 1.00 1.00 C ATOM 717 NZ LYS A 47 -25.517 -18.365 1.064 1.00 1.00 N ATOM 0 H LYS A 47 -20.613 -13.665 -0.975 1.00 1.00 H new ATOM 0 HA LYS A 47 -20.402 -16.556 -1.814 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -21.053 -15.942 0.732 1.00 1.00 H new ATOM 0 HB3 LYS A 47 -22.580 -15.480 0.008 1.00 1.00 H new ATOM 0 HG2 LYS A 47 -22.490 -17.814 -1.195 1.00 1.00 H new ATOM 0 HG3 LYS A 47 -21.244 -18.218 -0.030 1.00 1.00 H new ATOM 0 HD2 LYS A 47 -23.145 -18.908 1.157 1.00 1.00 H new ATOM 0 HD3 LYS A 47 -23.004 -17.263 1.744 1.00 1.00 H new ATOM 0 HE2 LYS A 47 -24.793 -16.475 0.367 1.00 1.00 H new ATOM 0 HE3 LYS A 47 -24.616 -17.782 -0.788 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 -26.486 -18.198 0.726 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 -25.280 -19.371 0.950 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 -25.451 -18.105 2.069 1.00 1.00 H new ATOM 730 N ALA A 48 -22.970 -16.059 -2.764 1.00 1.00 N ATOM 731 CA ALA A 48 -23.946 -15.627 -3.799 1.00 1.00 C ATOM 732 C ALA A 48 -24.406 -14.216 -3.453 1.00 1.00 C ATOM 733 O ALA A 48 -24.797 -13.445 -4.308 1.00 1.00 O ATOM 734 CB ALA A 48 -25.105 -16.621 -3.702 1.00 1.00 C ATOM 0 H ALA A 48 -23.155 -16.962 -2.327 1.00 1.00 H new ATOM 0 HA ALA A 48 -23.534 -15.612 -4.808 1.00 1.00 H new ATOM 0 HB1 ALA A 48 -25.867 -16.365 -4.438 1.00 1.00 H new ATOM 0 HB2 ALA A 48 -24.737 -17.629 -3.896 1.00 1.00 H new ATOM 0 HB3 ALA A 48 -25.538 -16.579 -2.703 1.00 1.00 H new ATOM 740 N LYS A 49 -24.326 -13.864 -2.199 1.00 1.00 N ATOM 741 CA LYS A 49 -24.717 -12.492 -1.781 1.00 1.00 C ATOM 742 C LYS A 49 -23.711 -11.487 -2.350 1.00 1.00 C ATOM 743 O LYS A 49 -24.079 -10.515 -2.980 1.00 1.00 O ATOM 744 CB LYS A 49 -24.657 -12.509 -0.253 1.00 1.00 C ATOM 745 CG LYS A 49 -26.073 -12.618 0.313 1.00 1.00 C ATOM 746 CD LYS A 49 -26.124 -11.954 1.691 1.00 1.00 C ATOM 747 CE LYS A 49 -27.233 -10.900 1.709 1.00 1.00 C ATOM 748 NZ LYS A 49 -28.429 -11.590 1.150 1.00 1.00 N ATOM 0 H LYS A 49 -24.005 -14.471 -1.445 1.00 1.00 H new ATOM 0 HA LYS A 49 -25.706 -12.205 -2.138 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -24.052 -13.349 0.088 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -24.177 -11.601 0.113 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -26.783 -12.138 -0.360 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -26.365 -13.665 0.391 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -26.307 -12.703 2.461 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -25.164 -11.491 1.919 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -27.421 -10.542 2.721 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -26.962 -10.031 1.109 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -29.283 -11.255 1.639 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -28.507 -11.381 0.134 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -28.333 -12.617 1.286 1.00 1.00 H new ATOM 761 N ARG A 50 -22.439 -11.718 -2.134 1.00 1.00 N ATOM 762 CA ARG A 50 -21.415 -10.776 -2.663 1.00 1.00 C ATOM 763 C ARG A 50 -21.510 -10.711 -4.186 1.00 1.00 C ATOM 764 O ARG A 50 -21.180 -9.712 -4.796 1.00 1.00 O ATOM 765 CB ARG A 50 -20.072 -11.366 -2.231 1.00 1.00 C ATOM 766 CG ARG A 50 -19.031 -10.248 -2.132 1.00 1.00 C ATOM 767 CD ARG A 50 -19.444 -9.260 -1.039 1.00 1.00 C ATOM 768 NE ARG A 50 -20.478 -9.978 -0.242 1.00 1.00 N ATOM 769 CZ ARG A 50 -21.734 -9.636 -0.342 1.00 1.00 C ATOM 770 NH1 ARG A 50 -22.084 -8.665 -1.141 1.00 1.00 N ATOM 771 NH2 ARG A 50 -22.639 -10.265 0.356 1.00 1.00 N ATOM 0 H ARG A 50 -22.071 -12.516 -1.616 1.00 1.00 H new ATOM 0 HA ARG A 50 -21.548 -9.761 -2.289 1.00 1.00 H new ATOM 0 HB2 ARG A 50 -20.176 -11.867 -1.269 1.00 1.00 H new ATOM 0 HB3 ARG A 50 -19.746 -12.119 -2.949 1.00 1.00 H new ATOM 0 HG2 ARG A 50 -18.051 -10.668 -1.905 1.00 1.00 H new ATOM 0 HG3 ARG A 50 -18.943 -9.733 -3.088 1.00 1.00 H new ATOM 0 HD2 ARG A 50 -18.593 -8.978 -0.419 1.00 1.00 H new ATOM 0 HD3 ARG A 50 -19.844 -8.341 -1.468 1.00 1.00 H new ATOM 0 HE ARG A 50 -20.204 -10.737 0.382 1.00 1.00 H new ATOM 0 HH11 ARG A 50 -21.376 -8.174 -1.687 1.00 1.00 H new ATOM 0 HH12 ARG A 50 -23.065 -8.398 -1.219 1.00 1.00 H new ATOM 0 HH21 ARG A 50 -22.365 -11.024 0.980 1.00 1.00 H new ATOM 0 HH22 ARG A 50 -23.620 -9.998 0.278 1.00 1.00 H new ATOM 784 N THR A 51 -21.976 -11.760 -4.807 1.00 1.00 N ATOM 785 CA THR A 51 -22.107 -11.745 -6.291 1.00 1.00 C ATOM 786 C THR A 51 -23.184 -10.738 -6.692 1.00 1.00 C ATOM 787 O THR A 51 -23.066 -10.042 -7.682 1.00 1.00 O ATOM 788 CB THR A 51 -22.526 -13.166 -6.671 1.00 1.00 C ATOM 789 OG1 THR A 51 -21.368 -13.948 -6.920 1.00 1.00 O ATOM 790 CG2 THR A 51 -23.397 -13.124 -7.927 1.00 1.00 C ATOM 0 H THR A 51 -22.271 -12.624 -4.352 1.00 1.00 H new ATOM 0 HA THR A 51 -21.184 -11.455 -6.794 1.00 1.00 H new ATOM 0 HB THR A 51 -23.094 -13.609 -5.853 1.00 1.00 H new ATOM 0 HG1 THR A 51 -21.635 -14.859 -7.162 1.00 1.00 H new ATOM 0 HG21 THR A 51 -23.695 -14.137 -8.197 1.00 1.00 H new ATOM 0 HG22 THR A 51 -24.286 -12.524 -7.733 1.00 1.00 H new ATOM 0 HG23 THR A 51 -22.832 -12.681 -8.747 1.00 1.00 H new ATOM 798 N ARG A 52 -24.231 -10.646 -5.917 1.00 1.00 N ATOM 799 CA ARG A 52 -25.314 -9.674 -6.237 1.00 1.00 C ATOM 800 C ARG A 52 -25.076 -8.378 -5.462 1.00 1.00 C ATOM 801 O ARG A 52 -24.888 -7.323 -6.036 1.00 1.00 O ATOM 802 CB ARG A 52 -26.606 -10.351 -5.772 1.00 1.00 C ATOM 803 CG ARG A 52 -27.348 -10.922 -6.983 1.00 1.00 C ATOM 804 CD ARG A 52 -28.461 -11.857 -6.504 1.00 1.00 C ATOM 805 NE ARG A 52 -28.078 -13.202 -7.014 1.00 1.00 N ATOM 806 CZ ARG A 52 -28.709 -13.718 -8.032 1.00 1.00 C ATOM 807 NH1 ARG A 52 -29.677 -13.056 -8.603 1.00 1.00 N ATOM 808 NH2 ARG A 52 -28.371 -14.896 -8.481 1.00 1.00 N ATOM 0 H ARG A 52 -24.383 -11.203 -5.076 1.00 1.00 H new ATOM 0 HA ARG A 52 -25.354 -9.419 -7.296 1.00 1.00 H new ATOM 0 HB2 ARG A 52 -26.377 -11.147 -5.064 1.00 1.00 H new ATOM 0 HB3 ARG A 52 -27.238 -9.632 -5.250 1.00 1.00 H new ATOM 0 HG2 ARG A 52 -27.769 -10.113 -7.580 1.00 1.00 H new ATOM 0 HG3 ARG A 52 -26.654 -11.464 -7.626 1.00 1.00 H new ATOM 0 HD2 ARG A 52 -28.539 -11.854 -5.417 1.00 1.00 H new ATOM 0 HD3 ARG A 52 -29.431 -11.548 -6.894 1.00 1.00 H new ATOM 0 HE ARG A 52 -27.322 -13.720 -6.567 1.00 1.00 H new ATOM 0 HH11 ARG A 52 -29.940 -12.135 -8.253 1.00 1.00 H new ATOM 0 HH12 ARG A 52 -30.171 -13.460 -9.399 1.00 1.00 H new ATOM 0 HH21 ARG A 52 -27.613 -15.413 -8.036 1.00 1.00 H new ATOM 0 HH22 ARG A 52 -28.865 -15.299 -9.277 1.00 1.00 H new ATOM 821 N ILE A 53 -25.078 -8.452 -4.160 1.00 1.00 N ATOM 822 CA ILE A 53 -24.848 -7.227 -3.344 1.00 1.00 C ATOM 823 C ILE A 53 -23.653 -6.450 -3.903 1.00 1.00 C ATOM 824 O ILE A 53 -23.710 -5.248 -4.076 1.00 1.00 O ATOM 825 CB ILE A 53 -24.545 -7.740 -1.936 1.00 1.00 C ATOM 826 CG1 ILE A 53 -25.798 -8.399 -1.355 1.00 1.00 C ATOM 827 CG2 ILE A 53 -24.125 -6.571 -1.044 1.00 1.00 C ATOM 828 CD1 ILE A 53 -27.037 -7.617 -1.795 1.00 1.00 C ATOM 0 H ILE A 53 -25.229 -9.308 -3.626 1.00 1.00 H new ATOM 0 HA ILE A 53 -25.704 -6.552 -3.352 1.00 1.00 H new ATOM 0 HB ILE A 53 -23.736 -8.469 -1.982 1.00 1.00 H new ATOM 0 HG12 ILE A 53 -25.868 -9.433 -1.694 1.00 1.00 H new ATOM 0 HG13 ILE A 53 -25.738 -8.423 -0.267 1.00 1.00 H new ATOM 0 HG21 ILE A 53 -23.909 -6.938 -0.041 1.00 1.00 H new ATOM 0 HG22 ILE A 53 -23.233 -6.100 -1.457 1.00 1.00 H new ATOM 0 HG23 ILE A 53 -24.933 -5.841 -0.997 1.00 1.00 H new ATOM 0 HD11 ILE A 53 -27.929 -8.086 -1.381 1.00 1.00 H new ATOM 0 HD12 ILE A 53 -26.966 -6.591 -1.435 1.00 1.00 H new ATOM 0 HD13 ILE A 53 -27.099 -7.616 -2.883 1.00 1.00 H new ATOM 840 N LEU A 54 -22.579 -7.126 -4.210 1.00 1.00 N ATOM 841 CA LEU A 54 -21.399 -6.419 -4.783 1.00 1.00 C ATOM 842 C LEU A 54 -21.750 -5.900 -6.179 1.00 1.00 C ATOM 843 O LEU A 54 -21.670 -4.721 -6.458 1.00 1.00 O ATOM 844 CB LEU A 54 -20.297 -7.477 -4.861 1.00 1.00 C ATOM 845 CG LEU A 54 -19.005 -6.916 -4.263 1.00 1.00 C ATOM 846 CD1 LEU A 54 -17.857 -7.894 -4.515 1.00 1.00 C ATOM 847 CD2 LEU A 54 -18.683 -5.572 -4.920 1.00 1.00 C ATOM 0 H LEU A 54 -22.468 -8.133 -4.089 1.00 1.00 H new ATOM 0 HA LEU A 54 -21.088 -5.563 -4.184 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -20.601 -8.374 -4.321 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -20.133 -7.770 -5.898 1.00 1.00 H new ATOM 0 HG LEU A 54 -19.132 -6.777 -3.189 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -16.937 -7.493 -4.089 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -18.086 -8.852 -4.048 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -17.728 -8.035 -5.588 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -17.763 -5.171 -4.495 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -18.556 -5.713 -5.993 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -19.500 -4.874 -4.740 1.00 1.00 H new ATOM 859 N GLU A 55 -22.142 -6.786 -7.053 1.00 1.00 N ATOM 860 CA GLU A 55 -22.504 -6.364 -8.436 1.00 1.00 C ATOM 861 C GLU A 55 -23.536 -5.234 -8.382 1.00 1.00 C ATOM 862 O GLU A 55 -23.425 -4.247 -9.080 1.00 1.00 O ATOM 863 CB GLU A 55 -23.105 -7.609 -9.089 1.00 1.00 C ATOM 864 CG GLU A 55 -24.516 -7.294 -9.588 1.00 1.00 C ATOM 865 CD GLU A 55 -25.094 -8.524 -10.292 1.00 1.00 C ATOM 866 OE1 GLU A 55 -24.359 -9.481 -10.467 1.00 1.00 O ATOM 867 OE2 GLU A 55 -26.262 -8.487 -10.643 1.00 1.00 O ATOM 0 H GLU A 55 -22.227 -7.786 -6.869 1.00 1.00 H new ATOM 0 HA GLU A 55 -21.646 -5.990 -8.994 1.00 1.00 H new ATOM 0 HB2 GLU A 55 -22.479 -7.935 -9.919 1.00 1.00 H new ATOM 0 HB3 GLU A 55 -23.136 -8.429 -8.372 1.00 1.00 H new ATOM 0 HG2 GLU A 55 -25.154 -7.007 -8.752 1.00 1.00 H new ATOM 0 HG3 GLU A 55 -24.490 -6.447 -10.274 1.00 1.00 H new ATOM 874 N LYS A 56 -24.531 -5.363 -7.548 1.00 1.00 N ATOM 875 CA LYS A 56 -25.554 -4.284 -7.446 1.00 1.00 C ATOM 876 C LYS A 56 -24.944 -3.067 -6.751 1.00 1.00 C ATOM 877 O LYS A 56 -25.193 -1.937 -7.122 1.00 1.00 O ATOM 878 CB LYS A 56 -26.682 -4.879 -6.603 1.00 1.00 C ATOM 879 CG LYS A 56 -27.537 -3.750 -6.022 1.00 1.00 C ATOM 880 CD LYS A 56 -28.138 -2.926 -7.162 1.00 1.00 C ATOM 881 CE LYS A 56 -28.384 -1.494 -6.683 1.00 1.00 C ATOM 882 NZ LYS A 56 -28.570 -1.609 -5.210 1.00 1.00 N ATOM 0 H LYS A 56 -24.680 -6.165 -6.935 1.00 1.00 H new ATOM 0 HA LYS A 56 -25.915 -3.955 -8.420 1.00 1.00 H new ATOM 0 HB2 LYS A 56 -27.298 -5.538 -7.215 1.00 1.00 H new ATOM 0 HB3 LYS A 56 -26.267 -5.486 -5.798 1.00 1.00 H new ATOM 0 HG2 LYS A 56 -28.331 -4.164 -5.401 1.00 1.00 H new ATOM 0 HG3 LYS A 56 -26.929 -3.113 -5.380 1.00 1.00 H new ATOM 0 HD2 LYS A 56 -27.463 -2.923 -8.018 1.00 1.00 H new ATOM 0 HD3 LYS A 56 -29.074 -3.375 -7.495 1.00 1.00 H new ATOM 0 HE2 LYS A 56 -27.542 -0.846 -6.925 1.00 1.00 H new ATOM 0 HE3 LYS A 56 -29.265 -1.064 -7.160 1.00 1.00 H new ATOM 0 HZ1 LYS A 56 -29.096 -0.782 -4.861 1.00 1.00 H new ATOM 0 HZ2 LYS A 56 -29.104 -2.475 -4.994 1.00 1.00 H new ATOM 0 HZ3 LYS A 56 -27.641 -1.650 -4.745 1.00 1.00 H new ATOM 895 N GLU A 57 -24.134 -3.293 -5.755 1.00 1.00 N ATOM 896 CA GLU A 57 -23.492 -2.152 -5.047 1.00 1.00 C ATOM 897 C GLU A 57 -22.366 -1.586 -5.914 1.00 1.00 C ATOM 898 O GLU A 57 -22.254 -0.391 -6.105 1.00 1.00 O ATOM 899 CB GLU A 57 -22.932 -2.747 -3.754 1.00 1.00 C ATOM 900 CG GLU A 57 -22.165 -1.670 -2.986 1.00 1.00 C ATOM 901 CD GLU A 57 -23.094 -1.012 -1.963 1.00 1.00 C ATOM 902 OE1 GLU A 57 -23.733 -1.738 -1.220 1.00 1.00 O ATOM 903 OE2 GLU A 57 -23.151 0.207 -1.941 1.00 1.00 O ATOM 0 H GLU A 57 -23.889 -4.218 -5.401 1.00 1.00 H new ATOM 0 HA GLU A 57 -24.187 -1.338 -4.843 1.00 1.00 H new ATOM 0 HB2 GLU A 57 -23.743 -3.138 -3.140 1.00 1.00 H new ATOM 0 HB3 GLU A 57 -22.273 -3.585 -3.982 1.00 1.00 H new ATOM 0 HG2 GLU A 57 -21.305 -2.111 -2.481 1.00 1.00 H new ATOM 0 HG3 GLU A 57 -21.779 -0.921 -3.677 1.00 1.00 H new ATOM 910 N VAL A 58 -21.532 -2.440 -6.442 1.00 1.00 N ATOM 911 CA VAL A 58 -20.415 -1.958 -7.302 1.00 1.00 C ATOM 912 C VAL A 58 -20.894 -1.788 -8.747 1.00 1.00 C ATOM 913 O VAL A 58 -20.659 -0.772 -9.371 1.00 1.00 O ATOM 914 CB VAL A 58 -19.349 -3.050 -7.216 1.00 1.00 C ATOM 915 CG1 VAL A 58 -19.498 -4.004 -8.402 1.00 1.00 C ATOM 916 CG2 VAL A 58 -17.960 -2.408 -7.251 1.00 1.00 C ATOM 0 H VAL A 58 -21.576 -3.451 -6.315 1.00 1.00 H new ATOM 0 HA VAL A 58 -20.034 -0.990 -6.978 1.00 1.00 H new ATOM 0 HB VAL A 58 -19.472 -3.605 -6.286 1.00 1.00 H new ATOM 0 HG11 VAL A 58 -18.738 -4.783 -8.340 1.00 1.00 H new ATOM 0 HG12 VAL A 58 -20.488 -4.461 -8.380 1.00 1.00 H new ATOM 0 HG13 VAL A 58 -19.375 -3.450 -9.332 1.00 1.00 H new ATOM 0 HG21 VAL A 58 -17.198 -3.185 -7.190 1.00 1.00 H new ATOM 0 HG22 VAL A 58 -17.839 -1.854 -8.182 1.00 1.00 H new ATOM 0 HG23 VAL A 58 -17.852 -1.727 -6.407 1.00 1.00 H new ATOM 926 N LEU A 59 -21.566 -2.772 -9.288 1.00 1.00 N ATOM 927 CA LEU A 59 -22.049 -2.646 -10.694 1.00 1.00 C ATOM 928 C LEU A 59 -22.597 -1.237 -10.922 1.00 1.00 C ATOM 929 O LEU A 59 -22.278 -0.585 -11.896 1.00 1.00 O ATOM 930 CB LEU A 59 -23.162 -3.681 -10.841 1.00 1.00 C ATOM 931 CG LEU A 59 -23.605 -3.736 -12.302 1.00 1.00 C ATOM 932 CD1 LEU A 59 -24.320 -2.433 -12.665 1.00 1.00 C ATOM 933 CD2 LEU A 59 -22.376 -3.907 -13.197 1.00 1.00 C ATOM 0 H LEU A 59 -21.799 -3.649 -8.822 1.00 1.00 H new ATOM 0 HA LEU A 59 -21.253 -2.812 -11.420 1.00 1.00 H new ATOM 0 HB2 LEU A 59 -22.809 -4.661 -10.518 1.00 1.00 H new ATOM 0 HB3 LEU A 59 -24.005 -3.419 -10.202 1.00 1.00 H new ATOM 0 HG LEU A 59 -24.283 -4.577 -12.447 1.00 1.00 H new ATOM 0 HD11 LEU A 59 -24.637 -2.470 -13.707 1.00 1.00 H new ATOM 0 HD12 LEU A 59 -25.193 -2.306 -12.025 1.00 1.00 H new ATOM 0 HD13 LEU A 59 -23.640 -1.593 -12.522 1.00 1.00 H new ATOM 0 HD21 LEU A 59 -22.688 -3.947 -14.240 1.00 1.00 H new ATOM 0 HD22 LEU A 59 -21.700 -3.064 -13.052 1.00 1.00 H new ATOM 0 HD23 LEU A 59 -21.862 -4.832 -12.937 1.00 1.00 H new ATOM 945 N LYS A 60 -23.403 -0.753 -10.016 1.00 1.00 N ATOM 946 CA LYS A 60 -23.945 0.626 -10.171 1.00 1.00 C ATOM 947 C LYS A 60 -22.809 1.623 -9.963 1.00 1.00 C ATOM 948 O LYS A 60 -22.925 2.798 -10.250 1.00 1.00 O ATOM 949 CB LYS A 60 -25.002 0.767 -9.074 1.00 1.00 C ATOM 950 CG LYS A 60 -24.822 2.108 -8.360 1.00 1.00 C ATOM 951 CD LYS A 60 -26.193 2.691 -8.016 1.00 1.00 C ATOM 952 CE LYS A 60 -26.430 2.588 -6.507 1.00 1.00 C ATOM 953 NZ LYS A 60 -26.616 1.133 -6.247 1.00 1.00 N ATOM 0 H LYS A 60 -23.708 -1.250 -9.179 1.00 1.00 H new ATOM 0 HA LYS A 60 -24.374 0.811 -11.156 1.00 1.00 H new ATOM 0 HB2 LYS A 60 -26.001 0.705 -9.506 1.00 1.00 H new ATOM 0 HB3 LYS A 60 -24.912 -0.052 -8.360 1.00 1.00 H new ATOM 0 HG2 LYS A 60 -24.234 1.973 -7.452 1.00 1.00 H new ATOM 0 HG3 LYS A 60 -24.270 2.800 -8.996 1.00 1.00 H new ATOM 0 HD2 LYS A 60 -26.246 3.733 -8.333 1.00 1.00 H new ATOM 0 HD3 LYS A 60 -26.974 2.154 -8.555 1.00 1.00 H new ATOM 0 HE2 LYS A 60 -25.584 2.985 -5.946 1.00 1.00 H new ATOM 0 HE3 LYS A 60 -27.308 3.159 -6.205 1.00 1.00 H new ATOM 0 HZ1 LYS A 60 -27.529 0.979 -5.773 1.00 1.00 H new ATOM 0 HZ2 LYS A 60 -26.602 0.615 -7.149 1.00 1.00 H new ATOM 0 HZ3 LYS A 60 -25.847 0.788 -5.638 1.00 1.00 H new ATOM 966 N GLU A 61 -21.701 1.141 -9.473 1.00 1.00 N ATOM 967 CA GLU A 61 -20.524 2.025 -9.246 1.00 1.00 C ATOM 968 C GLU A 61 -19.401 1.647 -10.214 1.00 1.00 C ATOM 969 O GLU A 61 -19.621 0.970 -11.199 1.00 1.00 O ATOM 970 CB GLU A 61 -20.101 1.760 -7.800 1.00 1.00 C ATOM 971 CG GLU A 61 -19.543 3.046 -7.187 1.00 1.00 C ATOM 972 CD GLU A 61 -20.272 4.253 -7.781 1.00 1.00 C ATOM 973 OE1 GLU A 61 -21.462 4.140 -8.025 1.00 1.00 O ATOM 974 OE2 GLU A 61 -19.628 5.269 -7.982 1.00 1.00 O ATOM 0 H GLU A 61 -21.560 0.164 -9.218 1.00 1.00 H new ATOM 0 HA GLU A 61 -20.753 3.078 -9.412 1.00 1.00 H new ATOM 0 HB2 GLU A 61 -20.954 1.408 -7.219 1.00 1.00 H new ATOM 0 HB3 GLU A 61 -19.347 0.973 -7.769 1.00 1.00 H new ATOM 0 HG2 GLU A 61 -19.668 3.029 -6.104 1.00 1.00 H new ATOM 0 HG3 GLU A 61 -18.473 3.121 -7.384 1.00 1.00 H new ATOM 981 N THR A 62 -18.199 2.072 -9.942 1.00 1.00 N ATOM 982 CA THR A 62 -17.066 1.728 -10.847 1.00 1.00 C ATOM 983 C THR A 62 -16.448 0.391 -10.428 1.00 1.00 C ATOM 984 O THR A 62 -15.255 0.283 -10.229 1.00 1.00 O ATOM 985 CB THR A 62 -16.059 2.866 -10.669 1.00 1.00 C ATOM 986 OG1 THR A 62 -16.019 3.251 -9.302 1.00 1.00 O ATOM 987 CG2 THR A 62 -16.479 4.061 -11.525 1.00 1.00 C ATOM 0 H THR A 62 -17.952 2.642 -9.133 1.00 1.00 H new ATOM 0 HA THR A 62 -17.380 1.622 -11.885 1.00 1.00 H new ATOM 0 HB THR A 62 -15.071 2.529 -10.981 1.00 1.00 H new ATOM 0 HG1 THR A 62 -15.144 3.641 -9.097 1.00 1.00 H new ATOM 0 HG21 THR A 62 -15.761 4.871 -11.397 1.00 1.00 H new ATOM 0 HG22 THR A 62 -16.509 3.765 -12.574 1.00 1.00 H new ATOM 0 HG23 THR A 62 -17.467 4.401 -11.216 1.00 1.00 H new ATOM 995 N HIS A 63 -17.254 -0.626 -10.290 1.00 1.00 N ATOM 996 CA HIS A 63 -16.716 -1.956 -9.879 1.00 1.00 C ATOM 997 C HIS A 63 -15.784 -2.512 -10.960 1.00 1.00 C ATOM 998 O HIS A 63 -16.187 -2.745 -12.082 1.00 1.00 O ATOM 999 CB HIS A 63 -17.947 -2.849 -9.723 1.00 1.00 C ATOM 1000 CG HIS A 63 -18.795 -2.758 -10.962 1.00 1.00 C ATOM 1001 ND1 HIS A 63 -18.953 -3.827 -11.830 1.00 1.00 N ATOM 1002 CD2 HIS A 63 -19.537 -1.732 -11.492 1.00 1.00 C ATOM 1003 CE1 HIS A 63 -19.762 -3.423 -12.826 1.00 1.00 C ATOM 1004 NE2 HIS A 63 -20.147 -2.154 -12.669 1.00 1.00 N ATOM 0 H HIS A 63 -18.262 -0.594 -10.444 1.00 1.00 H new ATOM 0 HA HIS A 63 -16.133 -1.898 -8.960 1.00 1.00 H new ATOM 0 HB2 HIS A 63 -17.641 -3.881 -9.554 1.00 1.00 H new ATOM 0 HB3 HIS A 63 -18.524 -2.541 -8.851 1.00 1.00 H new ATOM 0 HD1 HIS A 63 -18.533 -4.751 -11.732 1.00 1.00 H new ATOM 0 HD2 HIS A 63 -19.633 -0.747 -11.061 1.00 1.00 H new ATOM 0 HE1 HIS A 63 -20.064 -4.049 -13.653 1.00 1.00 H new ATOM 1012 N GLU A 64 -14.541 -2.729 -10.629 1.00 1.00 N ATOM 1013 CA GLU A 64 -13.584 -3.272 -11.635 1.00 1.00 C ATOM 1014 C GLU A 64 -13.080 -4.648 -11.192 1.00 1.00 C ATOM 1015 O GLU A 64 -12.666 -4.833 -10.066 1.00 1.00 O ATOM 1016 CB GLU A 64 -12.433 -2.267 -11.671 1.00 1.00 C ATOM 1017 CG GLU A 64 -12.861 -1.031 -12.465 1.00 1.00 C ATOM 1018 CD GLU A 64 -14.048 -1.385 -13.362 1.00 1.00 C ATOM 1019 OE1 GLU A 64 -14.043 -2.472 -13.915 1.00 1.00 O ATOM 1020 OE2 GLU A 64 -14.941 -0.563 -13.480 1.00 1.00 O ATOM 0 H GLU A 64 -14.146 -2.554 -9.705 1.00 1.00 H new ATOM 0 HA GLU A 64 -14.043 -3.400 -12.615 1.00 1.00 H new ATOM 0 HB2 GLU A 64 -12.153 -1.982 -10.657 1.00 1.00 H new ATOM 0 HB3 GLU A 64 -11.554 -2.721 -12.129 1.00 1.00 H new ATOM 0 HG2 GLU A 64 -13.134 -0.225 -11.784 1.00 1.00 H new ATOM 0 HG3 GLU A 64 -12.030 -0.669 -13.070 1.00 1.00 H new ATOM 1027 N LYS A 65 -13.107 -5.613 -12.070 1.00 1.00 N ATOM 1028 CA LYS A 65 -12.626 -6.975 -11.696 1.00 1.00 C ATOM 1029 C LYS A 65 -11.152 -7.134 -12.076 1.00 1.00 C ATOM 1030 O LYS A 65 -10.773 -6.953 -13.216 1.00 1.00 O ATOM 1031 CB LYS A 65 -13.497 -7.939 -12.502 1.00 1.00 C ATOM 1032 CG LYS A 65 -13.331 -7.651 -13.996 1.00 1.00 C ATOM 1033 CD LYS A 65 -14.701 -7.368 -14.616 1.00 1.00 C ATOM 1034 CE LYS A 65 -14.720 -7.869 -16.062 1.00 1.00 C ATOM 1035 NZ LYS A 65 -16.127 -7.688 -16.513 1.00 1.00 N ATOM 0 H LYS A 65 -13.441 -5.518 -13.029 1.00 1.00 H new ATOM 0 HA LYS A 65 -12.700 -7.161 -10.625 1.00 1.00 H new ATOM 0 HB2 LYS A 65 -13.214 -8.969 -12.286 1.00 1.00 H new ATOM 0 HB3 LYS A 65 -14.542 -7.829 -12.214 1.00 1.00 H new ATOM 0 HG2 LYS A 65 -12.671 -6.796 -14.141 1.00 1.00 H new ATOM 0 HG3 LYS A 65 -12.864 -8.502 -14.492 1.00 1.00 H new ATOM 0 HD2 LYS A 65 -15.482 -7.862 -14.038 1.00 1.00 H new ATOM 0 HD3 LYS A 65 -14.911 -6.299 -14.588 1.00 1.00 H new ATOM 0 HE2 LYS A 65 -14.029 -7.301 -16.686 1.00 1.00 H new ATOM 0 HE3 LYS A 65 -14.418 -8.915 -16.122 1.00 1.00 H new ATOM 0 HZ1 LYS A 65 -16.220 -8.010 -17.498 1.00 1.00 H new ATOM 0 HZ2 LYS A 65 -16.761 -8.245 -15.905 1.00 1.00 H new ATOM 0 HZ3 LYS A 65 -16.385 -6.682 -16.452 1.00 1.00 H new ATOM 1048 N VAL A 66 -10.318 -7.470 -11.131 1.00 1.00 N ATOM 1049 CA VAL A 66 -8.870 -7.636 -11.441 1.00 1.00 C ATOM 1050 C VAL A 66 -8.575 -9.078 -11.860 1.00 1.00 C ATOM 1051 O VAL A 66 -8.946 -10.019 -11.187 1.00 1.00 O ATOM 1052 CB VAL A 66 -8.144 -7.304 -10.139 1.00 1.00 C ATOM 1053 CG1 VAL A 66 -8.837 -8.013 -8.974 1.00 1.00 C ATOM 1054 CG2 VAL A 66 -6.693 -7.780 -10.235 1.00 1.00 C ATOM 0 H VAL A 66 -10.576 -7.637 -10.158 1.00 1.00 H new ATOM 0 HA VAL A 66 -8.553 -6.995 -12.263 1.00 1.00 H new ATOM 0 HB VAL A 66 -8.166 -6.227 -9.972 1.00 1.00 H new ATOM 0 HG11 VAL A 66 -8.319 -7.777 -8.044 1.00 1.00 H new ATOM 0 HG12 VAL A 66 -9.872 -7.678 -8.908 1.00 1.00 H new ATOM 0 HG13 VAL A 66 -8.814 -9.090 -9.138 1.00 1.00 H new ATOM 0 HG21 VAL A 66 -6.171 -7.545 -9.308 1.00 1.00 H new ATOM 0 HG22 VAL A 66 -6.674 -8.857 -10.399 1.00 1.00 H new ATOM 0 HG23 VAL A 66 -6.199 -7.277 -11.067 1.00 1.00 H new ATOM 1064 N GLN A 67 -7.907 -9.258 -12.967 1.00 1.00 N ATOM 1065 CA GLN A 67 -7.586 -10.640 -13.427 1.00 1.00 C ATOM 1066 C GLN A 67 -6.193 -10.675 -14.064 1.00 1.00 C ATOM 1067 O GLN A 67 -5.759 -9.722 -14.680 1.00 1.00 O ATOM 1068 CB GLN A 67 -8.659 -10.972 -14.463 1.00 1.00 C ATOM 1069 CG GLN A 67 -9.054 -9.701 -15.218 1.00 1.00 C ATOM 1070 CD GLN A 67 -10.516 -9.365 -14.920 1.00 1.00 C ATOM 1071 OE1 GLN A 67 -11.369 -9.499 -15.775 1.00 1.00 O ATOM 1072 NE2 GLN A 67 -10.844 -8.930 -13.734 1.00 1.00 N ATOM 0 H GLN A 67 -7.570 -8.509 -13.572 1.00 1.00 H new ATOM 0 HA GLN A 67 -7.577 -11.357 -12.606 1.00 1.00 H new ATOM 0 HB2 GLN A 67 -8.285 -11.721 -15.161 1.00 1.00 H new ATOM 0 HB3 GLN A 67 -9.532 -11.402 -13.972 1.00 1.00 H new ATOM 0 HG2 GLN A 67 -8.411 -8.873 -14.919 1.00 1.00 H new ATOM 0 HG3 GLN A 67 -8.913 -9.843 -16.290 1.00 1.00 H new ATOM 0 HE21 GLN A 67 -10.128 -8.817 -13.016 1.00 1.00 H new ATOM 0 HE22 GLN A 67 -11.816 -8.703 -13.525 1.00 1.00 H new ATOM 1081 N GLY A 68 -5.491 -11.766 -13.920 1.00 1.00 N ATOM 1082 CA GLY A 68 -4.129 -11.860 -14.517 1.00 1.00 C ATOM 1083 C GLY A 68 -3.077 -11.474 -13.473 1.00 1.00 C ATOM 1084 O GLY A 68 -1.922 -11.271 -13.788 1.00 1.00 O ATOM 0 H GLY A 68 -5.802 -12.596 -13.415 1.00 1.00 H new ATOM 0 HA2 GLY A 68 -3.947 -12.874 -14.872 1.00 1.00 H new ATOM 0 HA3 GLY A 68 -4.055 -11.201 -15.382 1.00 1.00 H new ATOM 1088 N GLY A 69 -3.465 -11.383 -12.229 1.00 1.00 N ATOM 1089 CA GLY A 69 -2.482 -11.021 -11.167 1.00 1.00 C ATOM 1090 C GLY A 69 -2.407 -9.500 -11.021 1.00 1.00 C ATOM 1091 O GLY A 69 -1.639 -8.981 -10.235 1.00 1.00 O ATOM 0 H GLY A 69 -4.418 -11.543 -11.903 1.00 1.00 H new ATOM 0 HA2 GLY A 69 -2.776 -11.472 -10.219 1.00 1.00 H new ATOM 0 HA3 GLY A 69 -1.499 -11.420 -11.418 1.00 1.00 H new ATOM 1095 N PHE A 70 -3.198 -8.779 -11.767 1.00 1.00 N ATOM 1096 CA PHE A 70 -3.166 -7.292 -11.663 1.00 1.00 C ATOM 1097 C PHE A 70 -4.344 -6.798 -10.818 1.00 1.00 C ATOM 1098 O PHE A 70 -5.428 -6.576 -11.319 1.00 1.00 O ATOM 1099 CB PHE A 70 -3.292 -6.794 -13.103 1.00 1.00 C ATOM 1100 CG PHE A 70 -2.503 -7.700 -14.018 1.00 1.00 C ATOM 1101 CD1 PHE A 70 -1.576 -8.601 -13.481 1.00 1.00 C ATOM 1102 CD2 PHE A 70 -2.700 -7.641 -15.402 1.00 1.00 C ATOM 1103 CE1 PHE A 70 -0.844 -9.442 -14.329 1.00 1.00 C ATOM 1104 CE2 PHE A 70 -1.969 -8.482 -16.250 1.00 1.00 C ATOM 1105 CZ PHE A 70 -1.041 -9.382 -15.713 1.00 1.00 C ATOM 0 H PHE A 70 -3.864 -9.154 -12.443 1.00 1.00 H new ATOM 0 HA PHE A 70 -2.257 -6.928 -11.184 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -4.340 -6.778 -13.404 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -2.923 -5.771 -13.179 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -1.425 -8.648 -12.413 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -3.416 -6.947 -15.816 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -0.128 -10.136 -13.915 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -2.121 -8.436 -17.318 1.00 1.00 H new ATOM 0 HZ PHE A 70 -0.477 -10.030 -16.367 1.00 1.00 H new ATOM 1115 N GLY A 71 -4.140 -6.625 -9.539 1.00 1.00 N ATOM 1116 CA GLY A 71 -5.254 -6.148 -8.671 1.00 1.00 C ATOM 1117 C GLY A 71 -6.139 -7.333 -8.281 1.00 1.00 C ATOM 1118 O GLY A 71 -7.304 -7.175 -7.971 1.00 1.00 O ATOM 0 H GLY A 71 -3.255 -6.793 -9.061 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -4.854 -5.670 -7.777 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -5.844 -5.397 -9.197 1.00 1.00 H new ATOM 1122 N LYS A 72 -5.595 -8.521 -8.295 1.00 1.00 N ATOM 1123 CA LYS A 72 -6.415 -9.713 -7.935 1.00 1.00 C ATOM 1124 C LYS A 72 -6.686 -9.714 -6.434 1.00 1.00 C ATOM 1125 O LYS A 72 -7.415 -10.540 -5.921 1.00 1.00 O ATOM 1126 CB LYS A 72 -5.560 -10.919 -8.329 1.00 1.00 C ATOM 1127 CG LYS A 72 -5.738 -12.031 -7.294 1.00 1.00 C ATOM 1128 CD LYS A 72 -4.847 -11.748 -6.082 1.00 1.00 C ATOM 1129 CE LYS A 72 -3.418 -12.211 -6.379 1.00 1.00 C ATOM 1130 NZ LYS A 72 -3.278 -13.509 -5.663 1.00 1.00 N ATOM 0 H LYS A 72 -4.624 -8.716 -8.539 1.00 1.00 H new ATOM 0 HA LYS A 72 -7.382 -9.724 -8.439 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -5.851 -11.277 -9.317 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -4.511 -10.630 -8.391 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -6.782 -12.091 -6.985 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -5.479 -12.995 -7.732 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -4.855 -10.682 -5.852 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -5.233 -12.266 -5.204 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -3.257 -12.332 -7.450 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -2.686 -11.484 -6.026 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -2.323 -13.890 -5.819 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -3.430 -13.362 -4.645 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -3.983 -14.183 -6.025 1.00 1.00 H new ATOM 1143 N TYR A 73 -6.126 -8.772 -5.731 1.00 1.00 N ATOM 1144 CA TYR A 73 -6.374 -8.691 -4.269 1.00 1.00 C ATOM 1145 C TYR A 73 -7.584 -7.789 -4.027 1.00 1.00 C ATOM 1146 O TYR A 73 -8.273 -7.905 -3.033 1.00 1.00 O ATOM 1147 CB TYR A 73 -5.106 -8.073 -3.678 1.00 1.00 C ATOM 1148 CG TYR A 73 -4.421 -9.083 -2.788 1.00 1.00 C ATOM 1149 CD1 TYR A 73 -5.092 -10.252 -2.411 1.00 1.00 C ATOM 1150 CD2 TYR A 73 -3.116 -8.849 -2.340 1.00 1.00 C ATOM 1151 CE1 TYR A 73 -4.457 -11.189 -1.587 1.00 1.00 C ATOM 1152 CE2 TYR A 73 -2.482 -9.786 -1.515 1.00 1.00 C ATOM 1153 CZ TYR A 73 -3.152 -10.955 -1.139 1.00 1.00 C ATOM 1154 OH TYR A 73 -2.527 -11.878 -0.326 1.00 1.00 O ATOM 0 H TYR A 73 -5.507 -8.054 -6.107 1.00 1.00 H new ATOM 0 HA TYR A 73 -6.585 -9.660 -3.816 1.00 1.00 H new ATOM 0 HB2 TYR A 73 -4.434 -7.762 -4.477 1.00 1.00 H new ATOM 0 HB3 TYR A 73 -5.357 -7.179 -3.106 1.00 1.00 H new ATOM 0 HD1 TYR A 73 -6.100 -10.431 -2.756 1.00 1.00 H new ATOM 0 HD2 TYR A 73 -2.598 -7.947 -2.630 1.00 1.00 H new ATOM 0 HE1 TYR A 73 -4.974 -12.092 -1.297 1.00 1.00 H new ATOM 0 HE2 TYR A 73 -1.475 -9.606 -1.169 1.00 1.00 H new ATOM 0 HH TYR A 73 -1.625 -11.563 -0.106 1.00 1.00 H new ATOM 1164 N GLN A 74 -7.847 -6.892 -4.942 1.00 1.00 N ATOM 1165 CA GLN A 74 -9.015 -5.981 -4.784 1.00 1.00 C ATOM 1166 C GLN A 74 -10.234 -6.561 -5.507 1.00 1.00 C ATOM 1167 O GLN A 74 -11.333 -6.569 -4.988 1.00 1.00 O ATOM 1168 CB GLN A 74 -8.582 -4.665 -5.431 1.00 1.00 C ATOM 1169 CG GLN A 74 -7.099 -4.740 -5.799 1.00 1.00 C ATOM 1170 CD GLN A 74 -6.951 -4.756 -7.322 1.00 1.00 C ATOM 1171 OE1 GLN A 74 -5.920 -4.384 -7.846 1.00 1.00 O ATOM 1172 NE2 GLN A 74 -7.943 -5.174 -8.058 1.00 1.00 N ATOM 0 H GLN A 74 -7.301 -6.753 -5.792 1.00 1.00 H new ATOM 0 HA GLN A 74 -9.298 -5.846 -3.740 1.00 1.00 H new ATOM 0 HB2 GLN A 74 -9.179 -4.472 -6.322 1.00 1.00 H new ATOM 0 HB3 GLN A 74 -8.756 -3.836 -4.745 1.00 1.00 H new ATOM 0 HG2 GLN A 74 -6.566 -3.886 -5.380 1.00 1.00 H new ATOM 0 HG3 GLN A 74 -6.652 -5.637 -5.370 1.00 1.00 H new ATOM 0 HE21 GLN A 74 -8.808 -5.486 -7.618 1.00 1.00 H new ATOM 0 HE22 GLN A 74 -7.853 -5.189 -9.074 1.00 1.00 H new ATOM 1181 N GLY A 75 -10.050 -7.039 -6.707 1.00 1.00 N ATOM 1182 CA GLY A 75 -11.200 -7.610 -7.461 1.00 1.00 C ATOM 1183 C GLY A 75 -12.105 -6.472 -7.930 1.00 1.00 C ATOM 1184 O GLY A 75 -11.927 -5.926 -9.000 1.00 1.00 O ATOM 0 H GLY A 75 -9.155 -7.059 -7.196 1.00 1.00 H new ATOM 0 HA2 GLY A 75 -10.842 -8.182 -8.317 1.00 1.00 H new ATOM 0 HA3 GLY A 75 -11.760 -8.299 -6.828 1.00 1.00 H new ATOM 1188 N THR A 76 -13.072 -6.107 -7.134 1.00 1.00 N ATOM 1189 CA THR A 76 -13.987 -5.000 -7.533 1.00 1.00 C ATOM 1190 C THR A 76 -13.814 -3.810 -6.586 1.00 1.00 C ATOM 1191 O THR A 76 -14.351 -3.788 -5.497 1.00 1.00 O ATOM 1192 CB THR A 76 -15.395 -5.584 -7.409 1.00 1.00 C ATOM 1193 OG1 THR A 76 -15.377 -6.666 -6.487 1.00 1.00 O ATOM 1194 CG2 THR A 76 -15.865 -6.084 -8.776 1.00 1.00 C ATOM 0 H THR A 76 -13.268 -6.527 -6.225 1.00 1.00 H new ATOM 0 HA THR A 76 -13.785 -4.638 -8.541 1.00 1.00 H new ATOM 0 HB THR A 76 -16.078 -4.813 -7.053 1.00 1.00 H new ATOM 0 HG1 THR A 76 -15.951 -7.388 -6.819 1.00 1.00 H new ATOM 0 HG21 THR A 76 -16.869 -6.500 -8.686 1.00 1.00 H new ATOM 0 HG22 THR A 76 -15.878 -5.254 -9.482 1.00 1.00 H new ATOM 0 HG23 THR A 76 -15.184 -6.855 -9.135 1.00 1.00 H new ATOM 1202 N TRP A 77 -13.062 -2.821 -6.989 1.00 1.00 N ATOM 1203 CA TRP A 77 -12.854 -1.639 -6.104 1.00 1.00 C ATOM 1204 C TRP A 77 -13.945 -0.595 -6.339 1.00 1.00 C ATOM 1205 O TRP A 77 -14.618 -0.597 -7.351 1.00 1.00 O ATOM 1206 CB TRP A 77 -11.490 -1.074 -6.499 1.00 1.00 C ATOM 1207 CG TRP A 77 -10.910 -1.894 -7.603 1.00 1.00 C ATOM 1208 CD1 TRP A 77 -10.348 -3.112 -7.447 1.00 1.00 C ATOM 1209 CD2 TRP A 77 -10.822 -1.578 -9.023 1.00 1.00 C ATOM 1210 NE1 TRP A 77 -9.920 -3.568 -8.682 1.00 1.00 N ATOM 1211 CE2 TRP A 77 -10.190 -2.658 -9.685 1.00 1.00 C ATOM 1212 CE3 TRP A 77 -11.226 -0.474 -9.793 1.00 1.00 C ATOM 1213 CZ2 TRP A 77 -9.967 -2.641 -11.061 1.00 1.00 C ATOM 1214 CZ3 TRP A 77 -11.002 -0.453 -11.180 1.00 1.00 C ATOM 1215 CH2 TRP A 77 -10.374 -1.536 -11.812 1.00 1.00 C ATOM 0 H TRP A 77 -12.584 -2.780 -7.889 1.00 1.00 H new ATOM 0 HA TRP A 77 -12.895 -1.912 -5.049 1.00 1.00 H new ATOM 0 HB2 TRP A 77 -11.593 -0.037 -6.818 1.00 1.00 H new ATOM 0 HB3 TRP A 77 -10.820 -1.078 -5.639 1.00 1.00 H new ATOM 0 HD1 TRP A 77 -10.249 -3.643 -6.512 1.00 1.00 H new ATOM 0 HE1 TRP A 77 -9.461 -4.466 -8.833 1.00 1.00 H new ATOM 0 HE3 TRP A 77 -11.712 0.364 -9.315 1.00 1.00 H new ATOM 0 HZ2 TRP A 77 -9.483 -3.477 -11.543 1.00 1.00 H new ATOM 0 HZ3 TRP A 77 -11.315 0.401 -11.762 1.00 1.00 H new ATOM 0 HH2 TRP A 77 -10.205 -1.516 -12.879 1.00 1.00 H new ATOM 1226 N VAL A 78 -14.115 0.304 -5.412 1.00 1.00 N ATOM 1227 CA VAL A 78 -15.151 1.363 -5.573 1.00 1.00 C ATOM 1228 C VAL A 78 -14.590 2.706 -5.105 1.00 1.00 C ATOM 1229 O VAL A 78 -13.663 2.752 -4.322 1.00 1.00 O ATOM 1230 CB VAL A 78 -16.312 0.925 -4.680 1.00 1.00 C ATOM 1231 CG1 VAL A 78 -17.476 0.449 -5.550 1.00 1.00 C ATOM 1232 CG2 VAL A 78 -15.852 -0.219 -3.773 1.00 1.00 C ATOM 0 H VAL A 78 -13.579 0.352 -4.545 1.00 1.00 H new ATOM 0 HA VAL A 78 -15.465 1.486 -6.609 1.00 1.00 H new ATOM 0 HB VAL A 78 -16.638 1.767 -4.069 1.00 1.00 H new ATOM 0 HG11 VAL A 78 -18.303 0.137 -4.912 1.00 1.00 H new ATOM 0 HG12 VAL A 78 -17.804 1.263 -6.197 1.00 1.00 H new ATOM 0 HG13 VAL A 78 -17.152 -0.393 -6.162 1.00 1.00 H new ATOM 0 HG21 VAL A 78 -16.679 -0.533 -3.135 1.00 1.00 H new ATOM 0 HG22 VAL A 78 -15.526 -1.060 -4.385 1.00 1.00 H new ATOM 0 HG23 VAL A 78 -15.023 0.120 -3.152 1.00 1.00 H new ATOM 1242 N PRO A 79 -15.173 3.761 -5.601 1.00 1.00 N ATOM 1243 CA PRO A 79 -14.721 5.120 -5.224 1.00 1.00 C ATOM 1244 C PRO A 79 -14.637 5.238 -3.701 1.00 1.00 C ATOM 1245 O PRO A 79 -15.641 5.314 -3.019 1.00 1.00 O ATOM 1246 CB PRO A 79 -15.807 6.035 -5.786 1.00 1.00 C ATOM 1247 CG PRO A 79 -16.471 5.247 -6.873 1.00 1.00 C ATOM 1248 CD PRO A 79 -16.295 3.786 -6.545 1.00 1.00 C ATOM 0 HA PRO A 79 -13.732 5.368 -5.608 1.00 1.00 H new ATOM 0 HB2 PRO A 79 -16.522 6.317 -5.013 1.00 1.00 H new ATOM 0 HB3 PRO A 79 -15.379 6.958 -6.176 1.00 1.00 H new ATOM 0 HG2 PRO A 79 -17.529 5.500 -6.939 1.00 1.00 H new ATOM 0 HG3 PRO A 79 -16.027 5.479 -7.841 1.00 1.00 H new ATOM 0 HD2 PRO A 79 -17.198 3.366 -6.102 1.00 1.00 H new ATOM 0 HD3 PRO A 79 -16.077 3.201 -7.438 1.00 1.00 H new ATOM 1256 N LEU A 80 -13.449 5.250 -3.160 1.00 1.00 N ATOM 1257 CA LEU A 80 -13.309 5.360 -1.680 1.00 1.00 C ATOM 1258 C LEU A 80 -14.164 6.515 -1.158 1.00 1.00 C ATOM 1259 O LEU A 80 -14.678 6.472 -0.057 1.00 1.00 O ATOM 1260 CB LEU A 80 -11.826 5.639 -1.441 1.00 1.00 C ATOM 1261 CG LEU A 80 -11.676 6.830 -0.493 1.00 1.00 C ATOM 1262 CD1 LEU A 80 -10.233 6.910 0.006 1.00 1.00 C ATOM 1263 CD2 LEU A 80 -12.029 8.119 -1.238 1.00 1.00 C ATOM 0 H LEU A 80 -12.572 5.189 -3.677 1.00 1.00 H new ATOM 0 HA LEU A 80 -13.640 4.459 -1.164 1.00 1.00 H new ATOM 0 HB2 LEU A 80 -11.344 4.759 -1.015 1.00 1.00 H new ATOM 0 HB3 LEU A 80 -11.328 5.849 -2.387 1.00 1.00 H new ATOM 0 HG LEU A 80 -12.346 6.703 0.357 1.00 1.00 H new ATOM 0 HD11 LEU A 80 -10.128 7.759 0.681 1.00 1.00 H new ATOM 0 HD12 LEU A 80 -9.980 5.992 0.536 1.00 1.00 H new ATOM 0 HD13 LEU A 80 -9.561 7.036 -0.843 1.00 1.00 H new ATOM 0 HD21 LEU A 80 -11.923 8.969 -0.564 1.00 1.00 H new ATOM 0 HD22 LEU A 80 -11.358 8.243 -2.088 1.00 1.00 H new ATOM 0 HD23 LEU A 80 -13.058 8.064 -1.593 1.00 1.00 H new ATOM 1275 N ASN A 81 -14.329 7.545 -1.947 1.00 1.00 N ATOM 1276 CA ASN A 81 -15.159 8.700 -1.501 1.00 1.00 C ATOM 1277 C ASN A 81 -16.593 8.234 -1.247 1.00 1.00 C ATOM 1278 O ASN A 81 -17.310 8.798 -0.445 1.00 1.00 O ATOM 1279 CB ASN A 81 -15.114 9.694 -2.663 1.00 1.00 C ATOM 1280 CG ASN A 81 -13.981 10.696 -2.435 1.00 1.00 C ATOM 1281 OD1 ASN A 81 -13.601 11.415 -3.337 1.00 1.00 O ATOM 1282 ND2 ASN A 81 -13.421 10.774 -1.259 1.00 1.00 N ATOM 0 H ASN A 81 -13.925 7.635 -2.879 1.00 1.00 H new ATOM 0 HA ASN A 81 -14.794 9.146 -0.575 1.00 1.00 H new ATOM 0 HB2 ASN A 81 -14.961 9.164 -3.603 1.00 1.00 H new ATOM 0 HB3 ASN A 81 -16.066 10.218 -2.744 1.00 1.00 H new ATOM 0 HD21 ASN A 81 -12.664 11.439 -1.098 1.00 1.00 H new ATOM 0 HD22 ASN A 81 -13.740 10.170 -0.501 1.00 1.00 H new ATOM 1289 N ILE A 82 -17.008 7.197 -1.919 1.00 1.00 N ATOM 1290 CA ILE A 82 -18.388 6.675 -1.716 1.00 1.00 C ATOM 1291 C ILE A 82 -18.317 5.295 -1.062 1.00 1.00 C ATOM 1292 O ILE A 82 -19.181 4.911 -0.297 1.00 1.00 O ATOM 1293 CB ILE A 82 -18.988 6.577 -3.119 1.00 1.00 C ATOM 1294 CG1 ILE A 82 -20.386 7.199 -3.120 1.00 1.00 C ATOM 1295 CG2 ILE A 82 -19.084 5.108 -3.533 1.00 1.00 C ATOM 1296 CD1 ILE A 82 -20.907 7.284 -4.555 1.00 1.00 C ATOM 0 H ILE A 82 -16.449 6.687 -2.603 1.00 1.00 H new ATOM 0 HA ILE A 82 -18.989 7.313 -1.068 1.00 1.00 H new ATOM 0 HB ILE A 82 -18.351 7.111 -3.824 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -21.063 6.599 -2.511 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -20.353 8.193 -2.674 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -19.512 5.039 -4.533 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -18.088 4.664 -3.533 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -19.720 4.572 -2.829 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -21.903 7.727 -4.555 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -20.235 7.902 -5.150 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -20.955 6.283 -4.984 1.00 1.00 H new ATOM 1308 N ALA A 83 -17.286 4.549 -1.354 1.00 1.00 N ATOM 1309 CA ALA A 83 -17.149 3.197 -0.748 1.00 1.00 C ATOM 1310 C ALA A 83 -16.987 3.317 0.768 1.00 1.00 C ATOM 1311 O ALA A 83 -17.765 2.776 1.528 1.00 1.00 O ATOM 1312 CB ALA A 83 -15.890 2.605 -1.379 1.00 1.00 C ATOM 0 H ALA A 83 -16.533 4.819 -1.987 1.00 1.00 H new ATOM 0 HA ALA A 83 -18.024 2.571 -0.926 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -15.720 1.604 -0.982 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -16.016 2.550 -2.460 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -15.034 3.238 -1.146 1.00 1.00 H new ATOM 1318 N LYS A 84 -15.981 4.021 1.219 1.00 1.00 N ATOM 1319 CA LYS A 84 -15.780 4.166 2.689 1.00 1.00 C ATOM 1320 C LYS A 84 -16.972 4.890 3.317 1.00 1.00 C ATOM 1321 O LYS A 84 -17.342 4.634 4.446 1.00 1.00 O ATOM 1322 CB LYS A 84 -14.507 5.000 2.834 1.00 1.00 C ATOM 1323 CG LYS A 84 -14.875 6.482 2.919 1.00 1.00 C ATOM 1324 CD LYS A 84 -13.817 7.314 2.190 1.00 1.00 C ATOM 1325 CE LYS A 84 -12.450 7.085 2.839 1.00 1.00 C ATOM 1326 NZ LYS A 84 -11.554 8.094 2.211 1.00 1.00 N ATOM 0 H LYS A 84 -15.294 4.499 0.636 1.00 1.00 H new ATOM 0 HA LYS A 84 -15.695 3.202 3.191 1.00 1.00 H new ATOM 0 HB2 LYS A 84 -13.962 4.698 3.728 1.00 1.00 H new ATOM 0 HB3 LYS A 84 -13.847 4.826 1.984 1.00 1.00 H new ATOM 0 HG2 LYS A 84 -15.855 6.650 2.474 1.00 1.00 H new ATOM 0 HG3 LYS A 84 -14.941 6.792 3.962 1.00 1.00 H new ATOM 0 HD2 LYS A 84 -13.782 7.035 1.137 1.00 1.00 H new ATOM 0 HD3 LYS A 84 -14.079 8.371 2.232 1.00 1.00 H new ATOM 0 HE2 LYS A 84 -12.499 7.218 3.920 1.00 1.00 H new ATOM 0 HE3 LYS A 84 -12.092 6.072 2.658 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 -10.605 7.686 2.087 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 -11.937 8.369 1.284 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 -11.493 8.933 2.823 1.00 1.00 H new ATOM 1339 N GLN A 85 -17.583 5.790 2.595 1.00 1.00 N ATOM 1340 CA GLN A 85 -18.753 6.521 3.159 1.00 1.00 C ATOM 1341 C GLN A 85 -19.947 5.575 3.287 1.00 1.00 C ATOM 1342 O GLN A 85 -20.830 5.777 4.096 1.00 1.00 O ATOM 1343 CB GLN A 85 -19.049 7.634 2.157 1.00 1.00 C ATOM 1344 CG GLN A 85 -20.240 8.461 2.646 1.00 1.00 C ATOM 1345 CD GLN A 85 -20.837 9.241 1.474 1.00 1.00 C ATOM 1346 OE1 GLN A 85 -21.940 9.745 1.563 1.00 1.00 O ATOM 1347 NE2 GLN A 85 -20.151 9.363 0.370 1.00 1.00 N ATOM 0 H GLN A 85 -17.324 6.050 1.643 1.00 1.00 H new ATOM 0 HA GLN A 85 -18.554 6.919 4.154 1.00 1.00 H new ATOM 0 HB2 GLN A 85 -18.174 8.273 2.039 1.00 1.00 H new ATOM 0 HB3 GLN A 85 -19.267 7.207 1.178 1.00 1.00 H new ATOM 0 HG2 GLN A 85 -20.995 7.807 3.083 1.00 1.00 H new ATOM 0 HG3 GLN A 85 -19.921 9.149 3.429 1.00 1.00 H new ATOM 0 HE21 GLN A 85 -19.226 8.940 0.295 1.00 1.00 H new ATOM 0 HE22 GLN A 85 -20.540 9.881 -0.418 1.00 1.00 H new ATOM 1356 N LEU A 86 -19.970 4.534 2.502 1.00 1.00 N ATOM 1357 CA LEU A 86 -21.098 3.565 2.590 1.00 1.00 C ATOM 1358 C LEU A 86 -20.810 2.551 3.696 1.00 1.00 C ATOM 1359 O LEU A 86 -21.659 2.243 4.510 1.00 1.00 O ATOM 1360 CB LEU A 86 -21.142 2.879 1.228 1.00 1.00 C ATOM 1361 CG LEU A 86 -22.519 2.250 1.015 1.00 1.00 C ATOM 1362 CD1 LEU A 86 -23.488 3.309 0.484 1.00 1.00 C ATOM 1363 CD2 LEU A 86 -22.406 1.110 0.001 1.00 1.00 C ATOM 0 H LEU A 86 -19.259 4.313 1.805 1.00 1.00 H new ATOM 0 HA LEU A 86 -22.048 4.045 2.826 1.00 1.00 H new ATOM 0 HB2 LEU A 86 -20.935 3.602 0.439 1.00 1.00 H new ATOM 0 HB3 LEU A 86 -20.368 2.113 1.170 1.00 1.00 H new ATOM 0 HG LEU A 86 -22.891 1.860 1.963 1.00 1.00 H new ATOM 0 HD11 LEU A 86 -24.470 2.860 0.332 1.00 1.00 H new ATOM 0 HD12 LEU A 86 -23.568 4.123 1.205 1.00 1.00 H new ATOM 0 HD13 LEU A 86 -23.117 3.699 -0.464 1.00 1.00 H new ATOM 0 HD21 LEU A 86 -23.387 0.660 -0.152 1.00 1.00 H new ATOM 0 HD22 LEU A 86 -22.034 1.501 -0.946 1.00 1.00 H new ATOM 0 HD23 LEU A 86 -21.716 0.355 0.378 1.00 1.00 H new ATOM 1375 N ALA A 87 -19.613 2.032 3.733 1.00 1.00 N ATOM 1376 CA ALA A 87 -19.263 1.041 4.788 1.00 1.00 C ATOM 1377 C ALA A 87 -18.769 1.762 6.046 1.00 1.00 C ATOM 1378 O ALA A 87 -19.340 1.628 7.112 1.00 1.00 O ATOM 1379 CB ALA A 87 -18.145 0.195 4.180 1.00 1.00 C ATOM 0 H ALA A 87 -18.863 2.252 3.078 1.00 1.00 H new ATOM 0 HA ALA A 87 -20.118 0.433 5.085 1.00 1.00 H new ATOM 0 HB1 ALA A 87 -17.830 -0.562 4.898 1.00 1.00 H new ATOM 0 HB2 ALA A 87 -18.508 -0.292 3.275 1.00 1.00 H new ATOM 0 HB3 ALA A 87 -17.298 0.835 3.932 1.00 1.00 H new ATOM 1385 N GLU A 88 -17.708 2.519 5.935 1.00 1.00 N ATOM 1386 CA GLU A 88 -17.171 3.239 7.120 1.00 1.00 C ATOM 1387 C GLU A 88 -18.303 3.679 8.046 1.00 1.00 C ATOM 1388 O GLU A 88 -18.109 3.869 9.230 1.00 1.00 O ATOM 1389 CB GLU A 88 -16.447 4.448 6.541 1.00 1.00 C ATOM 1390 CG GLU A 88 -17.294 5.705 6.750 1.00 1.00 C ATOM 1391 CD GLU A 88 -16.671 6.875 5.989 1.00 1.00 C ATOM 1392 OE1 GLU A 88 -15.594 6.695 5.444 1.00 1.00 O ATOM 1393 OE2 GLU A 88 -17.279 7.932 5.965 1.00 1.00 O ATOM 0 H GLU A 88 -17.191 2.668 5.069 1.00 1.00 H new ATOM 0 HA GLU A 88 -16.512 2.611 7.720 1.00 1.00 H new ATOM 0 HB2 GLU A 88 -15.476 4.568 7.022 1.00 1.00 H new ATOM 0 HB3 GLU A 88 -16.259 4.297 5.478 1.00 1.00 H new ATOM 0 HG2 GLU A 88 -18.312 5.532 6.401 1.00 1.00 H new ATOM 0 HG3 GLU A 88 -17.357 5.941 7.812 1.00 1.00 H new ATOM 1400 N LYS A 89 -19.488 3.829 7.524 1.00 1.00 N ATOM 1401 CA LYS A 89 -20.626 4.240 8.390 1.00 1.00 C ATOM 1402 C LYS A 89 -20.971 3.103 9.352 1.00 1.00 C ATOM 1403 O LYS A 89 -20.333 2.919 10.370 1.00 1.00 O ATOM 1404 CB LYS A 89 -21.785 4.502 7.428 1.00 1.00 C ATOM 1405 CG LYS A 89 -23.044 4.844 8.225 1.00 1.00 C ATOM 1406 CD LYS A 89 -23.725 6.067 7.607 1.00 1.00 C ATOM 1407 CE LYS A 89 -25.235 5.829 7.532 1.00 1.00 C ATOM 1408 NZ LYS A 89 -25.407 4.771 6.499 1.00 1.00 N ATOM 0 H LYS A 89 -19.717 3.686 6.540 1.00 1.00 H new ATOM 0 HA LYS A 89 -20.399 5.119 8.993 1.00 1.00 H new ATOM 0 HB2 LYS A 89 -21.534 5.322 6.755 1.00 1.00 H new ATOM 0 HB3 LYS A 89 -21.962 3.623 6.808 1.00 1.00 H new ATOM 0 HG2 LYS A 89 -23.728 3.995 8.226 1.00 1.00 H new ATOM 0 HG3 LYS A 89 -22.785 5.046 9.264 1.00 1.00 H new ATOM 0 HD2 LYS A 89 -23.515 6.954 8.205 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -23.326 6.253 6.610 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -25.632 5.509 8.495 1.00 1.00 H new ATOM 0 HE3 LYS A 89 -25.765 6.740 7.256 1.00 1.00 H new ATOM 0 HZ1 LYS A 89 -26.276 4.953 5.958 1.00 1.00 H new ATOM 0 HZ2 LYS A 89 -24.590 4.778 5.855 1.00 1.00 H new ATOM 0 HZ3 LYS A 89 -25.475 3.842 6.962 1.00 1.00 H new ATOM 1421 N PHE A 90 -21.969 2.333 9.027 1.00 1.00 N ATOM 1422 CA PHE A 90 -22.355 1.195 9.911 1.00 1.00 C ATOM 1423 C PHE A 90 -22.019 -0.134 9.230 1.00 1.00 C ATOM 1424 O PHE A 90 -22.231 -1.197 9.780 1.00 1.00 O ATOM 1425 CB PHE A 90 -23.866 1.335 10.101 1.00 1.00 C ATOM 1426 CG PHE A 90 -24.576 0.290 9.273 1.00 1.00 C ATOM 1427 CD1 PHE A 90 -24.037 -0.118 8.047 1.00 1.00 C ATOM 1428 CD2 PHE A 90 -25.775 -0.270 9.732 1.00 1.00 C ATOM 1429 CE1 PHE A 90 -24.695 -1.087 7.281 1.00 1.00 C ATOM 1430 CE2 PHE A 90 -26.433 -1.239 8.965 1.00 1.00 C ATOM 1431 CZ PHE A 90 -25.893 -1.648 7.740 1.00 1.00 C ATOM 0 H PHE A 90 -22.537 2.441 8.186 1.00 1.00 H new ATOM 0 HA PHE A 90 -21.824 1.209 10.863 1.00 1.00 H new ATOM 0 HB2 PHE A 90 -24.124 1.217 11.154 1.00 1.00 H new ATOM 0 HB3 PHE A 90 -24.190 2.332 9.803 1.00 1.00 H new ATOM 0 HD1 PHE A 90 -23.113 0.315 7.692 1.00 1.00 H new ATOM 0 HD2 PHE A 90 -26.192 0.046 10.677 1.00 1.00 H new ATOM 0 HE1 PHE A 90 -24.279 -1.402 6.336 1.00 1.00 H new ATOM 0 HE2 PHE A 90 -27.358 -1.671 9.319 1.00 1.00 H new ATOM 0 HZ PHE A 90 -26.400 -2.396 7.149 1.00 1.00 H new ATOM 1441 N SER A 91 -21.511 -0.081 8.029 1.00 1.00 N ATOM 1442 CA SER A 91 -21.179 -1.336 7.299 1.00 1.00 C ATOM 1443 C SER A 91 -20.040 -2.094 7.988 1.00 1.00 C ATOM 1444 O SER A 91 -20.261 -2.892 8.877 1.00 1.00 O ATOM 1445 CB SER A 91 -20.748 -0.880 5.907 1.00 1.00 C ATOM 1446 OG SER A 91 -20.922 -1.950 4.987 1.00 1.00 O ATOM 0 H SER A 91 -21.311 0.781 7.521 1.00 1.00 H new ATOM 0 HA SER A 91 -22.028 -2.019 7.269 1.00 1.00 H new ATOM 0 HB2 SER A 91 -21.338 -0.018 5.595 1.00 1.00 H new ATOM 0 HB3 SER A 91 -19.705 -0.564 5.922 1.00 1.00 H new ATOM 0 HG SER A 91 -20.648 -1.660 4.092 1.00 1.00 H new ATOM 1452 N VAL A 92 -18.823 -1.846 7.586 1.00 1.00 N ATOM 1453 CA VAL A 92 -17.662 -2.542 8.213 1.00 1.00 C ATOM 1454 C VAL A 92 -16.692 -1.511 8.799 1.00 1.00 C ATOM 1455 O VAL A 92 -15.564 -1.821 9.125 1.00 1.00 O ATOM 1456 CB VAL A 92 -17.001 -3.317 7.073 1.00 1.00 C ATOM 1457 CG1 VAL A 92 -15.630 -2.710 6.770 1.00 1.00 C ATOM 1458 CG2 VAL A 92 -16.829 -4.780 7.485 1.00 1.00 C ATOM 0 H VAL A 92 -18.581 -1.187 6.846 1.00 1.00 H new ATOM 0 HA VAL A 92 -17.961 -3.200 9.029 1.00 1.00 H new ATOM 0 HB VAL A 92 -17.628 -3.260 6.184 1.00 1.00 H new ATOM 0 HG11 VAL A 92 -15.159 -3.263 5.957 1.00 1.00 H new ATOM 0 HG12 VAL A 92 -15.751 -1.667 6.477 1.00 1.00 H new ATOM 0 HG13 VAL A 92 -15.002 -2.767 7.659 1.00 1.00 H new ATOM 0 HG21 VAL A 92 -16.358 -5.334 6.673 1.00 1.00 H new ATOM 0 HG22 VAL A 92 -16.201 -4.836 8.374 1.00 1.00 H new ATOM 0 HG23 VAL A 92 -17.805 -5.214 7.702 1.00 1.00 H new ATOM 1468 N TYR A 93 -17.119 -0.283 8.916 1.00 1.00 N ATOM 1469 CA TYR A 93 -16.209 0.765 9.461 1.00 1.00 C ATOM 1470 C TYR A 93 -15.218 0.134 10.442 1.00 1.00 C ATOM 1471 O TYR A 93 -14.022 0.147 10.225 1.00 1.00 O ATOM 1472 CB TYR A 93 -17.127 1.751 10.184 1.00 1.00 C ATOM 1473 CG TYR A 93 -17.321 1.302 11.612 1.00 1.00 C ATOM 1474 CD1 TYR A 93 -16.238 1.302 12.499 1.00 1.00 C ATOM 1475 CD2 TYR A 93 -18.584 0.885 12.050 1.00 1.00 C ATOM 1476 CE1 TYR A 93 -16.417 0.887 13.824 1.00 1.00 C ATOM 1477 CE2 TYR A 93 -18.763 0.470 13.375 1.00 1.00 C ATOM 1478 CZ TYR A 93 -17.680 0.471 14.261 1.00 1.00 C ATOM 1479 OH TYR A 93 -17.857 0.061 15.568 1.00 1.00 O ATOM 0 H TYR A 93 -18.052 0.039 8.660 1.00 1.00 H new ATOM 0 HA TYR A 93 -15.623 1.254 8.683 1.00 1.00 H new ATOM 0 HB2 TYR A 93 -16.694 2.751 10.161 1.00 1.00 H new ATOM 0 HB3 TYR A 93 -18.089 1.809 9.675 1.00 1.00 H new ATOM 0 HD1 TYR A 93 -15.264 1.622 12.161 1.00 1.00 H new ATOM 0 HD2 TYR A 93 -19.420 0.884 11.366 1.00 1.00 H new ATOM 0 HE1 TYR A 93 -15.581 0.888 14.508 1.00 1.00 H new ATOM 0 HE2 TYR A 93 -19.737 0.149 13.713 1.00 1.00 H new ATOM 0 HH TYR A 93 -18.793 -0.194 15.707 1.00 1.00 H new ATOM 1489 N ASP A 94 -15.703 -0.417 11.522 1.00 1.00 N ATOM 1490 CA ASP A 94 -14.784 -1.044 12.514 1.00 1.00 C ATOM 1491 C ASP A 94 -13.782 -1.961 11.808 1.00 1.00 C ATOM 1492 O ASP A 94 -12.585 -1.771 11.895 1.00 1.00 O ATOM 1493 CB ASP A 94 -15.694 -1.853 13.438 1.00 1.00 C ATOM 1494 CG ASP A 94 -15.174 -3.289 13.539 1.00 1.00 C ATOM 1495 OD1 ASP A 94 -13.968 -3.464 13.493 1.00 1.00 O ATOM 1496 OD2 ASP A 94 -15.991 -4.187 13.662 1.00 1.00 O ATOM 0 H ASP A 94 -16.694 -0.460 11.760 1.00 1.00 H new ATOM 0 HA ASP A 94 -14.201 -0.303 13.061 1.00 1.00 H new ATOM 0 HB2 ASP A 94 -15.725 -1.396 14.427 1.00 1.00 H new ATOM 0 HB3 ASP A 94 -16.714 -1.851 13.054 1.00 1.00 H new ATOM 1501 N GLN A 95 -14.259 -2.956 11.113 1.00 1.00 N ATOM 1502 CA GLN A 95 -13.330 -3.885 10.405 1.00 1.00 C ATOM 1503 C GLN A 95 -12.231 -3.095 9.691 1.00 1.00 C ATOM 1504 O GLN A 95 -11.057 -3.280 9.943 1.00 1.00 O ATOM 1505 CB GLN A 95 -14.204 -4.624 9.393 1.00 1.00 C ATOM 1506 CG GLN A 95 -14.149 -6.127 9.674 1.00 1.00 C ATOM 1507 CD GLN A 95 -15.217 -6.492 10.706 1.00 1.00 C ATOM 1508 OE1 GLN A 95 -15.615 -7.636 10.807 1.00 1.00 O ATOM 1509 NE2 GLN A 95 -15.703 -5.562 11.482 1.00 1.00 N ATOM 0 H GLN A 95 -15.251 -3.167 11.004 1.00 1.00 H new ATOM 0 HA GLN A 95 -12.831 -4.571 11.090 1.00 1.00 H new ATOM 0 HB2 GLN A 95 -15.232 -4.269 9.456 1.00 1.00 H new ATOM 0 HB3 GLN A 95 -13.858 -4.420 8.380 1.00 1.00 H new ATOM 0 HG2 GLN A 95 -14.312 -6.686 8.753 1.00 1.00 H new ATOM 0 HG3 GLN A 95 -13.161 -6.403 10.044 1.00 1.00 H new ATOM 0 HE21 GLN A 95 -15.369 -4.602 11.398 1.00 1.00 H new ATOM 0 HE22 GLN A 95 -16.416 -5.795 12.173 1.00 1.00 H new ATOM 1518 N LEU A 96 -12.601 -2.215 8.801 1.00 1.00 N ATOM 1519 CA LEU A 96 -11.573 -1.416 8.073 1.00 1.00 C ATOM 1520 C LEU A 96 -10.981 -0.352 9.000 1.00 1.00 C ATOM 1521 O LEU A 96 -10.752 0.774 8.604 1.00 1.00 O ATOM 1522 CB LEU A 96 -12.325 -0.761 6.914 1.00 1.00 C ATOM 1523 CG LEU A 96 -13.339 -1.750 6.340 1.00 1.00 C ATOM 1524 CD1 LEU A 96 -13.365 -1.631 4.815 1.00 1.00 C ATOM 1525 CD2 LEU A 96 -12.938 -3.174 6.732 1.00 1.00 C ATOM 0 H LEU A 96 -13.568 -2.015 8.546 1.00 1.00 H new ATOM 0 HA LEU A 96 -10.744 -2.030 7.722 1.00 1.00 H new ATOM 0 HB2 LEU A 96 -12.834 0.139 7.259 1.00 1.00 H new ATOM 0 HB3 LEU A 96 -11.623 -0.453 6.139 1.00 1.00 H new ATOM 0 HG LEU A 96 -14.329 -1.526 6.738 1.00 1.00 H new ATOM 0 HD11 LEU A 96 -14.089 -2.337 4.407 1.00 1.00 H new ATOM 0 HD12 LEU A 96 -13.649 -0.617 4.534 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -12.376 -1.854 4.416 1.00 1.00 H new ATOM 0 HD21 LEU A 96 -13.660 -3.881 6.323 1.00 1.00 H new ATOM 0 HD22 LEU A 96 -11.948 -3.396 6.334 1.00 1.00 H new ATOM 0 HD23 LEU A 96 -12.920 -3.261 7.818 1.00 1.00 H new ATOM 1537 N LYS A 97 -10.730 -0.700 10.233 1.00 1.00 N ATOM 1538 CA LYS A 97 -10.152 0.290 11.185 1.00 1.00 C ATOM 1539 C LYS A 97 -8.762 0.727 10.715 1.00 1.00 C ATOM 1540 O LYS A 97 -8.483 1.905 10.613 1.00 1.00 O ATOM 1541 CB LYS A 97 -10.059 -0.453 12.519 1.00 1.00 C ATOM 1542 CG LYS A 97 -11.022 0.180 13.524 1.00 1.00 C ATOM 1543 CD LYS A 97 -10.235 1.040 14.513 1.00 1.00 C ATOM 1544 CE LYS A 97 -11.110 2.198 14.997 1.00 1.00 C ATOM 1545 NZ LYS A 97 -10.287 2.901 16.018 1.00 1.00 N ATOM 0 H LYS A 97 -10.900 -1.627 10.622 1.00 1.00 H new ATOM 0 HA LYS A 97 -10.758 1.193 11.262 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -10.303 -1.506 12.379 1.00 1.00 H new ATOM 0 HB3 LYS A 97 -9.039 -0.411 12.901 1.00 1.00 H new ATOM 0 HG2 LYS A 97 -11.760 0.790 13.002 1.00 1.00 H new ATOM 0 HG3 LYS A 97 -11.570 -0.597 14.057 1.00 1.00 H new ATOM 0 HD2 LYS A 97 -9.914 0.435 15.361 1.00 1.00 H new ATOM 0 HD3 LYS A 97 -9.334 1.426 14.037 1.00 1.00 H new ATOM 0 HE2 LYS A 97 -11.373 2.864 14.175 1.00 1.00 H new ATOM 0 HE3 LYS A 97 -12.044 1.835 15.425 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 -10.820 3.709 16.397 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 -10.057 2.244 16.791 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 -9.407 3.242 15.580 1.00 1.00 H new ATOM 1558 N PRO A 98 -7.935 -0.246 10.445 1.00 1.00 N ATOM 1559 CA PRO A 98 -6.555 0.036 9.981 1.00 1.00 C ATOM 1560 C PRO A 98 -6.586 0.905 8.720 1.00 1.00 C ATOM 1561 O PRO A 98 -6.053 1.998 8.694 1.00 1.00 O ATOM 1562 CB PRO A 98 -5.979 -1.345 9.671 1.00 1.00 C ATOM 1563 CG PRO A 98 -6.849 -2.316 10.407 1.00 1.00 C ATOM 1564 CD PRO A 98 -8.206 -1.681 10.548 1.00 1.00 C ATOM 0 HA PRO A 98 -5.963 0.579 10.717 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -5.990 -1.543 8.599 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -4.942 -1.420 9.999 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -6.920 -3.258 9.863 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -6.428 -2.544 11.386 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -8.887 -2.016 9.766 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -8.668 -1.933 11.503 1.00 1.00 H new ATOM 1572 N LEU A 99 -7.208 0.430 7.676 1.00 1.00 N ATOM 1573 CA LEU A 99 -7.275 1.230 6.420 1.00 1.00 C ATOM 1574 C LEU A 99 -7.944 2.581 6.689 1.00 1.00 C ATOM 1575 O LEU A 99 -7.672 3.563 6.028 1.00 1.00 O ATOM 1576 CB LEU A 99 -8.126 0.394 5.463 1.00 1.00 C ATOM 1577 CG LEU A 99 -8.790 1.312 4.437 1.00 1.00 C ATOM 1578 CD1 LEU A 99 -7.712 2.051 3.639 1.00 1.00 C ATOM 1579 CD2 LEU A 99 -9.645 0.475 3.482 1.00 1.00 C ATOM 0 H LEU A 99 -7.673 -0.477 7.638 1.00 1.00 H new ATOM 0 HA LEU A 99 -6.287 1.440 6.011 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -7.504 -0.345 4.957 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -8.885 -0.156 6.020 1.00 1.00 H new ATOM 0 HG LEU A 99 -9.421 2.036 4.953 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -8.186 2.706 2.907 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -7.101 2.647 4.317 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -7.081 1.327 3.123 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -10.119 1.129 2.750 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -9.013 -0.248 2.967 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -10.413 -0.052 4.048 1.00 1.00 H new ATOM 1591 N PHE A 100 -8.816 2.637 7.658 1.00 1.00 N ATOM 1592 CA PHE A 100 -9.502 3.923 7.970 1.00 1.00 C ATOM 1593 C PHE A 100 -8.537 4.880 8.675 1.00 1.00 C ATOM 1594 O PHE A 100 -8.629 6.084 8.535 1.00 1.00 O ATOM 1595 CB PHE A 100 -10.654 3.540 8.901 1.00 1.00 C ATOM 1596 CG PHE A 100 -11.927 3.404 8.100 1.00 1.00 C ATOM 1597 CD1 PHE A 100 -11.925 3.693 6.729 1.00 1.00 C ATOM 1598 CD2 PHE A 100 -13.108 2.991 8.727 1.00 1.00 C ATOM 1599 CE1 PHE A 100 -13.106 3.566 5.987 1.00 1.00 C ATOM 1600 CE2 PHE A 100 -14.288 2.864 7.984 1.00 1.00 C ATOM 1601 CZ PHE A 100 -14.287 3.152 6.614 1.00 1.00 C ATOM 0 H PHE A 100 -9.083 1.848 8.247 1.00 1.00 H new ATOM 0 HA PHE A 100 -9.854 4.432 7.073 1.00 1.00 H new ATOM 0 HB2 PHE A 100 -10.429 2.602 9.408 1.00 1.00 H new ATOM 0 HB3 PHE A 100 -10.778 4.298 9.674 1.00 1.00 H new ATOM 0 HD1 PHE A 100 -11.014 4.013 6.245 1.00 1.00 H new ATOM 0 HD2 PHE A 100 -13.109 2.770 9.784 1.00 1.00 H new ATOM 0 HE1 PHE A 100 -13.105 3.788 4.930 1.00 1.00 H new ATOM 0 HE2 PHE A 100 -15.199 2.544 8.468 1.00 1.00 H new ATOM 0 HZ PHE A 100 -15.197 3.055 6.041 1.00 1.00 H new ATOM 1611 N ASP A 101 -7.611 4.355 9.432 1.00 1.00 N ATOM 1612 CA ASP A 101 -6.641 5.236 10.143 1.00 1.00 C ATOM 1613 C ASP A 101 -5.479 5.598 9.215 1.00 1.00 C ATOM 1614 O ASP A 101 -4.953 6.691 9.263 1.00 1.00 O ATOM 1615 CB ASP A 101 -6.145 4.404 11.326 1.00 1.00 C ATOM 1616 CG ASP A 101 -7.281 3.518 11.841 1.00 1.00 C ATOM 1617 OD1 ASP A 101 -8.297 4.065 12.240 1.00 1.00 O ATOM 1618 OD2 ASP A 101 -7.116 2.310 11.830 1.00 1.00 O ATOM 0 H ASP A 101 -7.485 3.355 9.588 1.00 1.00 H new ATOM 0 HA ASP A 101 -7.093 6.174 10.466 1.00 1.00 H new ATOM 0 HB2 ASP A 101 -5.299 3.788 11.021 1.00 1.00 H new ATOM 0 HB3 ASP A 101 -5.792 5.059 12.122 1.00 1.00 H new ATOM 1805 N LYS A 116 10.308 0.397 4.584 1.00 1.00 N ATOM 1806 CA LYS A 116 11.538 0.106 3.791 1.00 1.00 C ATOM 1807 C LYS A 116 12.529 -0.705 4.629 1.00 1.00 C ATOM 1808 O LYS A 116 12.493 -0.685 5.843 1.00 1.00 O ATOM 1809 CB LYS A 116 12.122 1.476 3.448 1.00 1.00 C ATOM 1810 CG LYS A 116 13.354 1.737 4.317 1.00 1.00 C ATOM 1811 CD LYS A 116 13.312 3.173 4.846 1.00 1.00 C ATOM 1812 CE LYS A 116 14.612 3.481 5.592 1.00 1.00 C ATOM 1813 NZ LYS A 116 14.331 4.729 6.352 1.00 1.00 N ATOM 0 HA LYS A 116 11.323 -0.481 2.898 1.00 1.00 H new ATOM 0 HB2 LYS A 116 12.393 1.514 2.393 1.00 1.00 H new ATOM 0 HB3 LYS A 116 11.376 2.253 3.613 1.00 1.00 H new ATOM 0 HG2 LYS A 116 13.381 1.033 5.148 1.00 1.00 H new ATOM 0 HG3 LYS A 116 14.262 1.579 3.735 1.00 1.00 H new ATOM 0 HD2 LYS A 116 13.180 3.872 4.020 1.00 1.00 H new ATOM 0 HD3 LYS A 116 12.459 3.302 5.512 1.00 1.00 H new ATOM 0 HE2 LYS A 116 14.887 2.665 6.260 1.00 1.00 H new ATOM 0 HE3 LYS A 116 15.442 3.619 4.899 1.00 1.00 H new ATOM 0 HZ1 LYS A 116 14.720 4.645 7.313 1.00 1.00 H new ATOM 0 HZ2 LYS A 116 14.773 5.537 5.869 1.00 1.00 H new ATOM 0 HZ3 LYS A 116 13.303 4.878 6.407 1.00 1.00 H new ATOM 1826 N HIS A 117 13.415 -1.418 3.990 1.00 1.00 N ATOM 1827 CA HIS A 117 14.410 -2.229 4.749 1.00 1.00 C ATOM 1828 C HIS A 117 15.426 -1.312 5.435 1.00 1.00 C ATOM 1829 O HIS A 117 15.686 -0.213 4.987 1.00 1.00 O ATOM 1830 CB HIS A 117 15.097 -3.100 3.697 1.00 1.00 C ATOM 1831 CG HIS A 117 15.459 -2.255 2.507 1.00 1.00 C ATOM 1832 ND1 HIS A 117 16.129 -2.773 1.409 1.00 1.00 N ATOM 1833 CD2 HIS A 117 15.251 -0.928 2.227 1.00 1.00 C ATOM 1834 CE1 HIS A 117 16.299 -1.770 0.528 1.00 1.00 C ATOM 1835 NE2 HIS A 117 15.781 -0.623 0.977 1.00 1.00 N ATOM 0 H HIS A 117 13.494 -1.475 2.975 1.00 1.00 H new ATOM 0 HA HIS A 117 13.944 -2.828 5.532 1.00 1.00 H new ATOM 0 HB2 HIS A 117 15.992 -3.559 4.117 1.00 1.00 H new ATOM 0 HB3 HIS A 117 14.436 -3.912 3.393 1.00 1.00 H new ATOM 0 HD2 HIS A 117 14.751 -0.226 2.878 1.00 1.00 H new ATOM 0 HE1 HIS A 117 16.794 -1.879 -0.426 1.00 1.00 H new ATOM 0 HE2 HIS A 117 15.775 0.281 0.505 1.00 1.00 H new ATOM 1843 N HIS A 118 16.003 -1.755 6.518 1.00 1.00 N ATOM 1844 CA HIS A 118 17.001 -0.908 7.231 1.00 1.00 C ATOM 1845 C HIS A 118 18.038 -0.370 6.242 1.00 1.00 C ATOM 1846 O HIS A 118 18.710 -1.119 5.562 1.00 1.00 O ATOM 1847 CB HIS A 118 17.661 -1.843 8.244 1.00 1.00 C ATOM 1848 CG HIS A 118 16.655 -2.849 8.729 1.00 1.00 C ATOM 1849 ND1 HIS A 118 16.197 -2.865 10.038 1.00 1.00 N ATOM 1850 CD2 HIS A 118 16.010 -3.881 8.094 1.00 1.00 C ATOM 1851 CE1 HIS A 118 15.316 -3.877 10.147 1.00 1.00 C ATOM 1852 NE2 HIS A 118 15.165 -4.528 8.991 1.00 1.00 N ATOM 0 H HIS A 118 15.827 -2.667 6.940 1.00 1.00 H new ATOM 0 HA HIS A 118 16.542 -0.044 7.712 1.00 1.00 H new ATOM 0 HB2 HIS A 118 18.509 -2.353 7.786 1.00 1.00 H new ATOM 0 HB3 HIS A 118 18.051 -1.269 9.084 1.00 1.00 H new ATOM 0 HD2 HIS A 118 16.139 -4.150 7.056 1.00 1.00 H new ATOM 0 HE1 HIS A 118 14.795 -4.131 11.058 1.00 1.00 H new ATOM 0 HE2 HIS A 118 14.560 -5.328 8.805 1.00 1.00 H new ATOM 1860 N HIS A 119 18.173 0.926 6.156 1.00 1.00 N ATOM 1861 CA HIS A 119 19.165 1.512 5.211 1.00 1.00 C ATOM 1862 C HIS A 119 20.450 1.886 5.954 1.00 1.00 C ATOM 1863 O HIS A 119 20.436 2.158 7.138 1.00 1.00 O ATOM 1864 CB HIS A 119 18.488 2.763 4.651 1.00 1.00 C ATOM 1865 CG HIS A 119 17.965 3.599 5.787 1.00 1.00 C ATOM 1866 ND1 HIS A 119 17.186 4.726 5.576 1.00 1.00 N ATOM 1867 CD2 HIS A 119 18.100 3.486 7.148 1.00 1.00 C ATOM 1868 CE1 HIS A 119 16.885 5.242 6.782 1.00 1.00 C ATOM 1869 NE2 HIS A 119 17.417 4.523 7.775 1.00 1.00 N ATOM 0 H HIS A 119 17.639 1.604 6.700 1.00 1.00 H new ATOM 0 HA HIS A 119 19.446 0.812 4.424 1.00 1.00 H new ATOM 0 HB2 HIS A 119 19.198 3.339 4.058 1.00 1.00 H new ATOM 0 HB3 HIS A 119 17.671 2.481 3.986 1.00 1.00 H new ATOM 0 HD2 HIS A 119 18.653 2.709 7.656 1.00 1.00 H new ATOM 0 HE1 HIS A 119 16.287 6.129 6.929 1.00 1.00 H new ATOM 0 HE2 HIS A 119 17.339 4.697 8.777 1.00 1.00 H new ATOM 1877 N ALA A 120 21.560 1.903 5.268 1.00 1.00 N ATOM 1878 CA ALA A 120 22.844 2.261 5.936 1.00 1.00 C ATOM 1879 C ALA A 120 22.605 3.335 7.000 1.00 1.00 C ATOM 1880 O ALA A 120 21.818 4.243 6.814 1.00 1.00 O ATOM 1881 CB ALA A 120 23.735 2.802 4.817 1.00 1.00 C ATOM 0 H ALA A 120 21.634 1.685 4.274 1.00 1.00 H new ATOM 0 HA ALA A 120 23.298 1.409 6.442 1.00 1.00 H new ATOM 0 HB1 ALA A 120 24.703 3.089 5.229 1.00 1.00 H new ATOM 0 HB2 ALA A 120 23.877 2.031 4.060 1.00 1.00 H new ATOM 0 HB3 ALA A 120 23.261 3.673 4.364 1.00 1.00 H new ATOM 1887 N SER A 121 23.288 3.249 8.108 1.00 1.00 N ATOM 1888 CA SER A 121 23.113 4.275 9.176 1.00 1.00 C ATOM 1889 C SER A 121 24.418 5.050 9.372 1.00 1.00 C ATOM 1890 O SER A 121 25.217 4.724 10.228 1.00 1.00 O ATOM 1891 CB SER A 121 22.765 3.481 10.435 1.00 1.00 C ATOM 1892 OG SER A 121 21.400 3.701 10.764 1.00 1.00 O ATOM 0 H SER A 121 23.960 2.512 8.321 1.00 1.00 H new ATOM 0 HA SER A 121 22.341 5.004 8.931 1.00 1.00 H new ATOM 0 HB2 SER A 121 22.945 2.419 10.271 1.00 1.00 H new ATOM 0 HB3 SER A 121 23.405 3.789 11.262 1.00 1.00 H new ATOM 0 HG SER A 121 21.172 3.192 11.570 1.00 1.00 H new ATOM 1898 N LYS A 122 24.656 6.064 8.585 1.00 1.00 N ATOM 1899 CA LYS A 122 25.921 6.837 8.733 1.00 1.00 C ATOM 1900 C LYS A 122 25.989 7.514 10.104 1.00 1.00 C ATOM 1901 O LYS A 122 25.100 8.243 10.496 1.00 1.00 O ATOM 1902 CB LYS A 122 25.878 7.886 7.620 1.00 1.00 C ATOM 1903 CG LYS A 122 24.449 8.410 7.468 1.00 1.00 C ATOM 1904 CD LYS A 122 24.343 9.236 6.184 1.00 1.00 C ATOM 1905 CE LYS A 122 24.292 10.724 6.535 1.00 1.00 C ATOM 1906 NZ LYS A 122 23.950 11.409 5.258 1.00 1.00 N ATOM 0 H LYS A 122 24.031 6.390 7.848 1.00 1.00 H new ATOM 0 HA LYS A 122 26.799 6.195 8.660 1.00 1.00 H new ATOM 0 HB2 LYS A 122 26.555 8.708 7.854 1.00 1.00 H new ATOM 0 HB3 LYS A 122 26.219 7.450 6.681 1.00 1.00 H new ATOM 0 HG2 LYS A 122 23.746 7.577 7.437 1.00 1.00 H new ATOM 0 HG3 LYS A 122 24.181 9.021 8.330 1.00 1.00 H new ATOM 0 HD2 LYS A 122 25.197 9.033 5.538 1.00 1.00 H new ATOM 0 HD3 LYS A 122 23.449 8.952 5.629 1.00 1.00 H new ATOM 0 HE2 LYS A 122 23.544 10.923 7.302 1.00 1.00 H new ATOM 0 HE3 LYS A 122 25.249 11.071 6.925 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 23.897 12.435 5.418 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 24.683 11.207 4.548 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 23.031 11.064 4.914 1.00 1.00 H new ATOM 1919 N VAL A 123 27.047 7.278 10.833 1.00 1.00 N ATOM 1920 CA VAL A 123 27.187 7.906 12.179 1.00 1.00 C ATOM 1921 C VAL A 123 27.232 9.430 12.044 1.00 1.00 C ATOM 1922 O VAL A 123 27.693 9.961 11.052 1.00 1.00 O ATOM 1923 CB VAL A 123 28.511 7.375 12.728 1.00 1.00 C ATOM 1924 CG1 VAL A 123 29.666 8.209 12.174 1.00 1.00 C ATOM 1925 CG2 VAL A 123 28.501 7.470 14.256 1.00 1.00 C ATOM 0 H VAL A 123 27.822 6.676 10.554 1.00 1.00 H new ATOM 0 HA VAL A 123 26.351 7.669 12.837 1.00 1.00 H new ATOM 0 HB VAL A 123 28.639 6.335 12.427 1.00 1.00 H new ATOM 0 HG11 VAL A 123 30.610 7.830 12.566 1.00 1.00 H new ATOM 0 HG12 VAL A 123 29.673 8.144 11.086 1.00 1.00 H new ATOM 0 HG13 VAL A 123 29.540 9.249 12.474 1.00 1.00 H new ATOM 0 HG21 VAL A 123 29.444 7.092 14.650 1.00 1.00 H new ATOM 0 HG22 VAL A 123 28.374 8.510 14.555 1.00 1.00 H new ATOM 0 HG23 VAL A 123 27.678 6.875 14.652 1.00 1.00 H new ATOM 1935 N ASP A 124 26.758 10.138 13.032 1.00 1.00 N ATOM 1936 CA ASP A 124 26.776 11.628 12.957 1.00 1.00 C ATOM 1937 C ASP A 124 28.211 12.131 12.774 1.00 1.00 C ATOM 1938 O ASP A 124 28.526 12.579 11.684 1.00 1.00 O ATOM 1939 CB ASP A 124 26.209 12.098 14.297 1.00 1.00 C ATOM 1940 CG ASP A 124 25.790 10.884 15.129 1.00 1.00 C ATOM 1941 OD1 ASP A 124 26.542 9.924 15.159 1.00 1.00 O ATOM 1942 OD2 ASP A 124 24.724 10.936 15.721 1.00 1.00 O ATOM 0 H ASP A 124 26.359 9.751 13.887 1.00 1.00 H new ATOM 0 HA ASP A 124 26.198 12.007 12.114 1.00 1.00 H new ATOM 0 HB2 ASP A 124 26.956 12.681 14.836 1.00 1.00 H new ATOM 0 HB3 ASP A 124 25.353 12.752 14.132 1.00 1.00 H new