USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 836 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot -55:sc= 0.968 USER MOD Single : A 11 GLN : amide:sc= -0.0603 X(o=-0.06,f=-0.24!) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 22 ASN : amide:sc= -0.478 X(o=-0.48,f=-0.025) USER MOD Single : A 25 CYS SG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ -164:sc= 0.0326 (180deg=0.00962) USER MOD Single : A 41 SER OG : rot 180:sc= -0.0467 USER MOD Single : A 43 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.26) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.148 USER MOD Single : A 48 SER OG : rot 64:sc= 0.645 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 147:sc= 0.0792 (180deg=0) USER MOD Single : A 61 SER OG : rot -160:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 93 GLN : amide:sc= -0.0303 X(o=-0.03,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.504 -2.950 -8.536 1.00 0.00 N ATOM 2 CA GLY A 1 -5.315 -2.172 -7.325 1.00 0.00 C ATOM 3 C GLY A 1 -5.108 -0.698 -7.609 1.00 0.00 C ATOM 4 O GLY A 1 -4.148 -0.317 -8.279 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.641 -3.951 -8.288 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.341 -2.602 -9.045 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.665 -2.856 -9.144 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.184 -2.296 -6.678 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.454 -2.558 -6.780 1.00 0.00 H new ATOM 8 N SER A 2 -6.011 0.134 -7.099 1.00 0.00 N ATOM 9 CA SER A 2 -5.926 1.575 -7.307 1.00 0.00 C ATOM 10 C SER A 2 -5.165 2.244 -6.166 1.00 0.00 C ATOM 11 O SER A 2 -5.733 3.018 -5.396 1.00 0.00 O ATOM 12 CB SER A 2 -7.327 2.178 -7.422 1.00 0.00 C ATOM 13 OG SER A 2 -7.271 3.508 -7.909 1.00 0.00 O ATOM 0 H SER A 2 -6.809 -0.165 -6.539 1.00 0.00 H new ATOM 0 HA SER A 2 -5.384 1.752 -8.236 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.935 1.568 -8.090 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.813 2.165 -6.447 1.00 0.00 H new ATOM 0 HG SER A 2 -8.179 3.871 -7.975 1.00 0.00 H new ATOM 19 N SER A 3 -3.875 1.938 -6.065 1.00 0.00 N ATOM 20 CA SER A 3 -3.035 2.506 -5.017 1.00 0.00 C ATOM 21 C SER A 3 -2.218 3.678 -5.551 1.00 0.00 C ATOM 22 O SER A 3 -0.998 3.590 -5.683 1.00 0.00 O ATOM 23 CB SER A 3 -2.102 1.436 -4.446 1.00 0.00 C ATOM 24 OG SER A 3 -2.834 0.316 -3.981 1.00 0.00 O ATOM 0 H SER A 3 -3.389 1.300 -6.696 1.00 0.00 H new ATOM 0 HA SER A 3 -3.685 2.872 -4.222 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.395 1.119 -5.213 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.518 1.858 -3.628 1.00 0.00 H new ATOM 0 HG SER A 3 -2.215 -0.354 -3.623 1.00 0.00 H new ATOM 30 N GLY A 4 -2.901 4.777 -5.857 1.00 0.00 N ATOM 31 CA GLY A 4 -2.223 5.952 -6.373 1.00 0.00 C ATOM 32 C GLY A 4 -2.269 6.029 -7.886 1.00 0.00 C ATOM 33 O GLY A 4 -1.757 5.147 -8.575 1.00 0.00 O ATOM 0 H GLY A 4 -3.911 4.875 -5.757 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.682 6.847 -5.952 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.184 5.942 -6.044 1.00 0.00 H new ATOM 37 N SER A 5 -2.885 7.086 -8.405 1.00 0.00 N ATOM 38 CA SER A 5 -3.001 7.272 -9.847 1.00 0.00 C ATOM 39 C SER A 5 -1.624 7.300 -10.503 1.00 0.00 C ATOM 40 O SER A 5 -0.881 8.273 -10.372 1.00 0.00 O ATOM 41 CB SER A 5 -3.752 8.569 -10.156 1.00 0.00 C ATOM 42 OG SER A 5 -3.302 9.141 -11.372 1.00 0.00 O ATOM 0 H SER A 5 -3.312 7.827 -7.849 1.00 0.00 H new ATOM 0 HA SER A 5 -3.561 6.430 -10.254 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.821 8.368 -10.219 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.609 9.279 -9.341 1.00 0.00 H new ATOM 0 HG SER A 5 -3.798 9.968 -11.548 1.00 0.00 H new ATOM 48 N SER A 6 -1.290 6.225 -11.210 1.00 0.00 N ATOM 49 CA SER A 6 -0.001 6.124 -11.884 1.00 0.00 C ATOM 50 C SER A 6 0.030 7.001 -13.132 1.00 0.00 C ATOM 51 O SER A 6 1.016 7.688 -13.397 1.00 0.00 O ATOM 52 CB SER A 6 0.287 4.669 -12.262 1.00 0.00 C ATOM 53 OG SER A 6 1.059 4.026 -11.262 1.00 0.00 O ATOM 0 H SER A 6 -1.894 5.412 -11.331 1.00 0.00 H new ATOM 0 HA SER A 6 0.769 6.474 -11.197 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.652 4.133 -12.402 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.818 4.635 -13.214 1.00 0.00 H new ATOM 0 HG SER A 6 1.228 3.097 -11.526 1.00 0.00 H new ATOM 59 N GLY A 7 -1.058 6.972 -13.896 1.00 0.00 N ATOM 60 CA GLY A 7 -1.136 7.768 -15.107 1.00 0.00 C ATOM 61 C GLY A 7 -2.352 7.430 -15.945 1.00 0.00 C ATOM 62 O GLY A 7 -3.477 7.419 -15.444 1.00 0.00 O ATOM 0 H GLY A 7 -1.887 6.411 -13.698 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.163 8.825 -14.842 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.235 7.611 -15.700 1.00 0.00 H new ATOM 66 N LYS A 8 -2.129 7.156 -17.226 1.00 0.00 N ATOM 67 CA LYS A 8 -3.216 6.817 -18.137 1.00 0.00 C ATOM 68 C LYS A 8 -2.871 5.580 -18.959 1.00 0.00 C ATOM 69 O LYS A 8 -3.378 5.397 -20.066 1.00 0.00 O ATOM 70 CB LYS A 8 -3.514 7.995 -19.068 1.00 0.00 C ATOM 71 CG LYS A 8 -2.402 8.279 -20.064 1.00 0.00 C ATOM 72 CD LYS A 8 -2.050 9.757 -20.099 1.00 0.00 C ATOM 73 CE LYS A 8 -3.105 10.564 -20.838 1.00 0.00 C ATOM 74 NZ LYS A 8 -2.565 11.174 -22.085 1.00 0.00 N ATOM 0 H LYS A 8 -1.205 7.162 -17.657 1.00 0.00 H new ATOM 0 HA LYS A 8 -4.102 6.599 -17.541 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -4.436 7.792 -19.613 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -3.689 8.887 -18.467 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -1.518 7.699 -19.799 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -2.710 7.954 -21.058 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -1.951 10.133 -19.081 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -1.083 9.890 -20.584 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -3.948 9.919 -21.085 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -3.485 11.349 -20.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -3.315 11.716 -22.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.777 11.809 -21.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.226 10.423 -22.720 1.00 0.00 H new ATOM 88 N TYR A 9 -2.007 4.733 -18.411 1.00 0.00 N ATOM 89 CA TYR A 9 -1.593 3.513 -19.094 1.00 0.00 C ATOM 90 C TYR A 9 -0.990 3.831 -20.459 1.00 0.00 C ATOM 91 O TYR A 9 -1.685 3.825 -21.476 1.00 0.00 O ATOM 92 CB TYR A 9 -2.784 2.567 -19.258 1.00 0.00 C ATOM 93 CG TYR A 9 -3.228 1.923 -17.964 1.00 0.00 C ATOM 94 CD1 TYR A 9 -4.046 2.604 -17.071 1.00 0.00 C ATOM 95 CD2 TYR A 9 -2.830 0.633 -17.635 1.00 0.00 C ATOM 96 CE1 TYR A 9 -4.454 2.020 -15.888 1.00 0.00 C ATOM 97 CE2 TYR A 9 -3.234 0.041 -16.454 1.00 0.00 C ATOM 98 CZ TYR A 9 -4.046 0.738 -15.584 1.00 0.00 C ATOM 99 OH TYR A 9 -4.449 0.152 -14.406 1.00 0.00 O ATOM 0 H TYR A 9 -1.579 4.869 -17.495 1.00 0.00 H new ATOM 0 HA TYR A 9 -0.831 3.026 -18.485 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -3.621 3.120 -19.685 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -2.521 1.786 -19.971 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.368 3.608 -17.306 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -2.194 0.084 -18.314 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -5.089 2.564 -15.205 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -2.916 -0.963 -16.213 1.00 0.00 H new ATOM 0 HH TYR A 9 -4.075 -0.752 -14.346 1.00 0.00 H new ATOM 109 N THR A 10 0.310 4.108 -20.474 1.00 0.00 N ATOM 110 CA THR A 10 1.009 4.429 -21.712 1.00 0.00 C ATOM 111 C THR A 10 2.434 3.889 -21.694 1.00 0.00 C ATOM 112 O THR A 10 3.350 4.514 -22.228 1.00 0.00 O ATOM 113 CB THR A 10 1.051 5.950 -21.955 1.00 0.00 C ATOM 114 OG1 THR A 10 1.657 6.226 -23.223 1.00 0.00 O ATOM 115 CG2 THR A 10 1.827 6.653 -20.852 1.00 0.00 C ATOM 0 H THR A 10 0.900 4.116 -19.642 1.00 0.00 H new ATOM 0 HA THR A 10 0.454 3.955 -22.521 1.00 0.00 H new ATOM 0 HB THR A 10 0.028 6.325 -21.952 1.00 0.00 H new ATOM 0 HG1 THR A 10 2.543 5.808 -23.260 1.00 0.00 H new ATOM 0 HG21 THR A 10 1.843 7.726 -21.045 1.00 0.00 H new ATOM 0 HG22 THR A 10 1.346 6.464 -19.892 1.00 0.00 H new ATOM 0 HG23 THR A 10 2.849 6.274 -20.827 1.00 0.00 H new ATOM 123 N GLN A 11 2.614 2.725 -21.078 1.00 0.00 N ATOM 124 CA GLN A 11 3.929 2.102 -20.992 1.00 0.00 C ATOM 125 C GLN A 11 4.023 0.898 -21.923 1.00 0.00 C ATOM 126 O GLN A 11 3.357 -0.115 -21.712 1.00 0.00 O ATOM 127 CB GLN A 11 4.220 1.673 -19.553 1.00 0.00 C ATOM 128 CG GLN A 11 5.693 1.745 -19.183 1.00 0.00 C ATOM 129 CD GLN A 11 6.006 1.017 -17.891 1.00 0.00 C ATOM 130 OE1 GLN A 11 6.359 -0.162 -17.899 1.00 0.00 O ATOM 131 NE2 GLN A 11 5.879 1.718 -16.770 1.00 0.00 N ATOM 0 H GLN A 11 1.866 2.195 -20.631 1.00 0.00 H new ATOM 0 HA GLN A 11 4.672 2.837 -21.302 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.651 2.306 -18.872 1.00 0.00 H new ATOM 0 HB3 GLN A 11 3.867 0.652 -19.409 1.00 0.00 H new ATOM 0 HG2 GLN A 11 6.288 1.317 -19.990 1.00 0.00 H new ATOM 0 HG3 GLN A 11 5.989 2.790 -19.088 1.00 0.00 H new ATOM 0 HE21 GLN A 11 5.584 2.693 -16.809 1.00 0.00 H new ATOM 0 HE22 GLN A 11 6.077 1.281 -15.870 1.00 0.00 H new ATOM 140 N ASN A 12 4.853 1.016 -22.954 1.00 0.00 N ATOM 141 CA ASN A 12 5.033 -0.064 -23.918 1.00 0.00 C ATOM 142 C ASN A 12 6.505 -0.448 -24.037 1.00 0.00 C ATOM 143 O ASN A 12 6.869 -1.610 -23.865 1.00 0.00 O ATOM 144 CB ASN A 12 4.492 0.352 -25.287 1.00 0.00 C ATOM 145 CG ASN A 12 2.983 0.225 -25.375 1.00 0.00 C ATOM 146 OD1 ASN A 12 2.460 -0.803 -25.806 1.00 0.00 O ATOM 147 ND2 ASN A 12 2.276 1.272 -24.967 1.00 0.00 N ATOM 0 H ASN A 12 5.412 1.848 -23.144 1.00 0.00 H new ATOM 0 HA ASN A 12 4.477 -0.931 -23.562 1.00 0.00 H new ATOM 0 HB2 ASN A 12 4.780 1.384 -25.490 1.00 0.00 H new ATOM 0 HB3 ASN A 12 4.952 -0.265 -26.059 1.00 0.00 H new ATOM 0 HD21 ASN A 12 1.257 1.245 -25.003 1.00 0.00 H new ATOM 0 HD22 ASN A 12 2.752 2.104 -24.617 1.00 0.00 H new ATOM 154 N ASN A 13 7.346 0.538 -24.330 1.00 0.00 N ATOM 155 CA ASN A 13 8.779 0.304 -24.471 1.00 0.00 C ATOM 156 C ASN A 13 9.374 -0.229 -23.171 1.00 0.00 C ATOM 157 O ASN A 13 10.359 -0.968 -23.184 1.00 0.00 O ATOM 158 CB ASN A 13 9.491 1.596 -24.879 1.00 0.00 C ATOM 159 CG ASN A 13 9.880 1.604 -26.344 1.00 0.00 C ATOM 160 OD1 ASN A 13 9.022 1.570 -27.226 1.00 0.00 O ATOM 161 ND2 ASN A 13 11.180 1.649 -26.611 1.00 0.00 N ATOM 0 H ASN A 13 7.061 1.507 -24.474 1.00 0.00 H new ATOM 0 HA ASN A 13 8.924 -0.444 -25.250 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.841 2.446 -24.674 1.00 0.00 H new ATOM 0 HB3 ASN A 13 10.385 1.724 -24.268 1.00 0.00 H new ATOM 0 HD21 ASN A 13 11.502 1.657 -27.579 1.00 0.00 H new ATOM 0 HD22 ASN A 13 11.857 1.676 -25.848 1.00 0.00 H new ATOM 168 N PHE A 14 8.768 0.150 -22.051 1.00 0.00 N ATOM 169 CA PHE A 14 9.237 -0.290 -20.742 1.00 0.00 C ATOM 170 C PHE A 14 8.219 -1.215 -20.082 1.00 0.00 C ATOM 171 O PHE A 14 7.024 -1.144 -20.367 1.00 0.00 O ATOM 172 CB PHE A 14 9.506 0.918 -19.841 1.00 0.00 C ATOM 173 CG PHE A 14 10.655 1.767 -20.304 1.00 0.00 C ATOM 174 CD1 PHE A 14 10.536 2.563 -21.431 1.00 0.00 C ATOM 175 CD2 PHE A 14 11.855 1.769 -19.610 1.00 0.00 C ATOM 176 CE1 PHE A 14 11.592 3.345 -21.859 1.00 0.00 C ATOM 177 CE2 PHE A 14 12.915 2.549 -20.033 1.00 0.00 C ATOM 178 CZ PHE A 14 12.782 3.339 -21.159 1.00 0.00 C ATOM 0 H PHE A 14 7.951 0.761 -22.023 1.00 0.00 H new ATOM 0 HA PHE A 14 10.165 -0.843 -20.883 1.00 0.00 H new ATOM 0 HB2 PHE A 14 8.607 1.532 -19.793 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.708 0.568 -18.829 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.607 2.573 -21.982 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.963 1.154 -18.729 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.486 3.960 -22.740 1.00 0.00 H new ATOM 0 HE2 PHE A 14 13.845 2.541 -19.485 1.00 0.00 H new ATOM 0 HZ PHE A 14 13.608 3.951 -21.491 1.00 0.00 H new ATOM 188 N ILE A 15 8.703 -2.082 -19.198 1.00 0.00 N ATOM 189 CA ILE A 15 7.836 -3.021 -18.497 1.00 0.00 C ATOM 190 C ILE A 15 8.218 -3.127 -17.025 1.00 0.00 C ATOM 191 O ILE A 15 9.395 -3.050 -16.669 1.00 0.00 O ATOM 192 CB ILE A 15 7.892 -4.422 -19.133 1.00 0.00 C ATOM 193 CG1 ILE A 15 6.895 -5.358 -18.447 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.302 -4.986 -19.047 1.00 0.00 C ATOM 195 CD1 ILE A 15 6.874 -6.753 -19.032 1.00 0.00 C ATOM 0 H ILE A 15 9.690 -2.153 -18.951 1.00 0.00 H new ATOM 0 HA ILE A 15 6.820 -2.635 -18.579 1.00 0.00 H new ATOM 0 HB ILE A 15 7.618 -4.339 -20.185 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.139 -5.421 -17.387 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.896 -4.928 -18.519 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.326 -5.977 -19.501 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.990 -4.328 -19.577 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.602 -5.058 -18.002 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.145 -7.361 -18.497 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.600 -6.702 -20.086 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.862 -7.203 -18.936 1.00 0.00 H new ATOM 207 N THR A 16 7.216 -3.308 -16.170 1.00 0.00 N ATOM 208 CA THR A 16 7.446 -3.427 -14.736 1.00 0.00 C ATOM 209 C THR A 16 8.235 -4.689 -14.408 1.00 0.00 C ATOM 210 O THR A 16 8.317 -5.610 -15.220 1.00 0.00 O ATOM 211 CB THR A 16 6.119 -3.447 -13.954 1.00 0.00 C ATOM 212 OG1 THR A 16 5.024 -3.191 -14.840 1.00 0.00 O ATOM 213 CG2 THR A 16 6.131 -2.409 -12.841 1.00 0.00 C ATOM 0 H THR A 16 6.237 -3.375 -16.447 1.00 0.00 H new ATOM 0 HA THR A 16 8.023 -2.553 -14.435 1.00 0.00 H new ATOM 0 HB THR A 16 6.001 -4.434 -13.507 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.184 -3.207 -14.335 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.184 -2.442 -12.303 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.948 -2.624 -12.152 1.00 0.00 H new ATOM 0 HG23 THR A 16 6.270 -1.417 -13.270 1.00 0.00 H new ATOM 221 N GLY A 17 8.814 -4.726 -13.212 1.00 0.00 N ATOM 222 CA GLY A 17 9.589 -5.881 -12.798 1.00 0.00 C ATOM 223 C GLY A 17 8.721 -7.092 -12.521 1.00 0.00 C ATOM 224 O GLY A 17 8.794 -8.094 -13.233 1.00 0.00 O ATOM 0 H GLY A 17 8.760 -3.977 -12.522 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.313 -6.127 -13.575 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.156 -5.632 -11.901 1.00 0.00 H new ATOM 228 N VAL A 18 7.898 -7.003 -11.481 1.00 0.00 N ATOM 229 CA VAL A 18 7.012 -8.100 -11.111 1.00 0.00 C ATOM 230 C VAL A 18 6.174 -8.555 -12.300 1.00 0.00 C ATOM 231 O VAL A 18 5.783 -9.719 -12.388 1.00 0.00 O ATOM 232 CB VAL A 18 6.073 -7.699 -9.958 1.00 0.00 C ATOM 233 CG1 VAL A 18 5.124 -6.595 -10.402 1.00 0.00 C ATOM 234 CG2 VAL A 18 5.299 -8.908 -9.456 1.00 0.00 C ATOM 0 H VAL A 18 7.827 -6.182 -10.880 1.00 0.00 H new ATOM 0 HA VAL A 18 7.647 -8.923 -10.783 1.00 0.00 H new ATOM 0 HB VAL A 18 6.678 -7.317 -9.136 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.468 -6.324 -9.575 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.700 -5.722 -10.709 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.524 -6.947 -11.241 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.641 -8.606 -8.641 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.703 -9.322 -10.270 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.998 -9.664 -9.097 1.00 0.00 H new ATOM 244 N ARG A 19 5.901 -7.629 -13.213 1.00 0.00 N ATOM 245 CA ARG A 19 5.108 -7.935 -14.398 1.00 0.00 C ATOM 246 C ARG A 19 5.854 -8.896 -15.319 1.00 0.00 C ATOM 247 O ARG A 19 5.291 -9.885 -15.787 1.00 0.00 O ATOM 248 CB ARG A 19 4.765 -6.650 -15.154 1.00 0.00 C ATOM 249 CG ARG A 19 3.324 -6.202 -14.973 1.00 0.00 C ATOM 250 CD ARG A 19 2.571 -6.202 -16.293 1.00 0.00 C ATOM 251 NE ARG A 19 1.131 -6.354 -16.102 1.00 0.00 N ATOM 252 CZ ARG A 19 0.357 -5.416 -15.567 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.882 -4.264 -15.174 1.00 0.00 N ATOM 254 NH2 ARG A 19 -0.945 -5.629 -15.426 1.00 0.00 N ATOM 0 H ARG A 19 6.217 -6.661 -13.155 1.00 0.00 H new ATOM 0 HA ARG A 19 4.185 -8.415 -14.072 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.429 -5.853 -14.819 1.00 0.00 H new ATOM 0 HB3 ARG A 19 4.959 -6.801 -16.216 1.00 0.00 H new ATOM 0 HG2 ARG A 19 2.822 -6.863 -14.267 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.304 -5.201 -14.542 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.770 -5.271 -16.824 1.00 0.00 H new ATOM 0 HD3 ARG A 19 2.941 -7.012 -16.921 1.00 0.00 H new ATOM 0 HE ARG A 19 0.696 -7.228 -16.396 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.882 -4.096 -15.282 1.00 0.00 H new ATOM 0 HH12 ARG A 19 0.286 -3.545 -14.764 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -1.353 -6.514 -15.728 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.538 -4.908 -15.015 1.00 0.00 H new ATOM 268 N ALA A 20 7.123 -8.597 -15.574 1.00 0.00 N ATOM 269 CA ALA A 20 7.947 -9.435 -16.437 1.00 0.00 C ATOM 270 C ALA A 20 8.236 -10.781 -15.781 1.00 0.00 C ATOM 271 O ALA A 20 8.368 -11.799 -16.462 1.00 0.00 O ATOM 272 CB ALA A 20 9.247 -8.723 -16.779 1.00 0.00 C ATOM 0 H ALA A 20 7.603 -7.781 -15.195 1.00 0.00 H new ATOM 0 HA ALA A 20 7.394 -9.620 -17.358 1.00 0.00 H new ATOM 0 HB1 ALA A 20 9.852 -9.360 -17.424 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.025 -7.790 -17.296 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.796 -8.508 -15.862 1.00 0.00 H new ATOM 278 N ILE A 21 8.334 -10.780 -14.456 1.00 0.00 N ATOM 279 CA ILE A 21 8.608 -12.001 -13.709 1.00 0.00 C ATOM 280 C ILE A 21 7.388 -12.917 -13.687 1.00 0.00 C ATOM 281 O ILE A 21 7.515 -14.132 -13.546 1.00 0.00 O ATOM 282 CB ILE A 21 9.030 -11.693 -12.261 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.273 -10.801 -12.248 1.00 0.00 C ATOM 284 CG2 ILE A 21 9.290 -12.984 -11.499 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.520 -10.127 -10.916 1.00 0.00 C ATOM 0 H ILE A 21 8.228 -9.947 -13.877 1.00 0.00 H new ATOM 0 HA ILE A 21 9.429 -12.505 -14.218 1.00 0.00 H new ATOM 0 HB ILE A 21 8.218 -11.160 -11.767 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.144 -11.402 -12.509 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.170 -10.037 -13.019 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.587 -12.750 -10.477 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.382 -13.587 -11.484 1.00 0.00 H new ATOM 0 HG23 ILE A 21 10.087 -13.542 -11.990 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.417 -9.511 -10.981 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.666 -9.499 -10.662 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.655 -10.885 -10.144 1.00 0.00 H new ATOM 297 N ASN A 22 6.207 -12.324 -13.829 1.00 0.00 N ATOM 298 CA ASN A 22 4.964 -13.086 -13.827 1.00 0.00 C ATOM 299 C ASN A 22 4.566 -13.482 -15.246 1.00 0.00 C ATOM 300 O ASN A 22 3.892 -14.490 -15.453 1.00 0.00 O ATOM 301 CB ASN A 22 3.843 -12.271 -13.180 1.00 0.00 C ATOM 302 CG ASN A 22 3.491 -12.771 -11.792 1.00 0.00 C ATOM 303 OD1 ASN A 22 3.036 -13.903 -11.625 1.00 0.00 O ATOM 304 ND2 ASN A 22 3.701 -11.927 -10.789 1.00 0.00 N ATOM 0 H ASN A 22 6.085 -11.318 -13.947 1.00 0.00 H new ATOM 0 HA ASN A 22 5.125 -13.995 -13.247 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.145 -11.225 -13.121 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.957 -12.311 -13.813 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.484 -12.207 -9.833 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.080 -10.998 -10.975 1.00 0.00 H new ATOM 311 N GLU A 23 4.990 -12.682 -16.219 1.00 0.00 N ATOM 312 CA GLU A 23 4.678 -12.949 -17.618 1.00 0.00 C ATOM 313 C GLU A 23 5.703 -13.897 -18.233 1.00 0.00 C ATOM 314 O GLU A 23 5.359 -14.980 -18.706 1.00 0.00 O ATOM 315 CB GLU A 23 4.634 -11.642 -18.413 1.00 0.00 C ATOM 316 CG GLU A 23 3.347 -10.858 -18.224 1.00 0.00 C ATOM 317 CD GLU A 23 2.490 -10.834 -19.475 1.00 0.00 C ATOM 318 OE1 GLU A 23 1.765 -11.822 -19.716 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.544 -9.828 -20.213 1.00 0.00 O ATOM 0 H GLU A 23 5.550 -11.844 -16.064 1.00 0.00 H new ATOM 0 HA GLU A 23 3.698 -13.424 -17.660 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.477 -11.018 -18.116 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.761 -11.866 -19.472 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.776 -11.296 -17.405 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.588 -9.835 -17.933 1.00 0.00 H new ATOM 326 N PHE A 24 6.966 -13.481 -18.223 1.00 0.00 N ATOM 327 CA PHE A 24 8.042 -14.292 -18.780 1.00 0.00 C ATOM 328 C PHE A 24 8.376 -15.461 -17.859 1.00 0.00 C ATOM 329 O PHE A 24 9.032 -16.420 -18.268 1.00 0.00 O ATOM 330 CB PHE A 24 9.289 -13.435 -19.008 1.00 0.00 C ATOM 331 CG PHE A 24 9.105 -12.373 -20.054 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.476 -11.178 -19.744 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.561 -12.570 -21.347 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.304 -10.200 -20.706 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.392 -11.596 -22.313 1.00 0.00 C ATOM 336 CZ PHE A 24 8.764 -10.409 -21.991 1.00 0.00 C ATOM 0 H PHE A 24 7.269 -12.587 -17.835 1.00 0.00 H new ATOM 0 HA PHE A 24 7.704 -14.692 -19.736 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.572 -12.962 -18.068 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.116 -14.082 -19.300 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.116 -11.009 -18.740 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.055 -13.496 -21.603 1.00 0.00 H new ATOM 0 HE1 PHE A 24 7.810 -9.273 -20.453 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.750 -11.763 -23.318 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.633 -9.645 -22.743 1.00 0.00 H new ATOM 346 N CYS A 25 7.919 -15.375 -16.615 1.00 0.00 N ATOM 347 CA CYS A 25 8.170 -16.425 -15.634 1.00 0.00 C ATOM 348 C CYS A 25 9.667 -16.627 -15.424 1.00 0.00 C ATOM 349 O CYS A 25 10.242 -17.614 -15.884 1.00 0.00 O ATOM 350 CB CYS A 25 7.524 -17.736 -16.083 1.00 0.00 C ATOM 351 SG CYS A 25 5.833 -17.969 -15.486 1.00 0.00 S ATOM 0 H CYS A 25 7.373 -14.589 -16.262 1.00 0.00 H new ATOM 0 HA CYS A 25 7.728 -16.116 -14.687 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.521 -17.773 -17.172 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.138 -18.568 -15.737 1.00 0.00 H new ATOM 0 HG CYS A 25 5.372 -19.104 -15.920 1.00 0.00 H new ATOM 357 N LEU A 26 10.294 -15.685 -14.728 1.00 0.00 N ATOM 358 CA LEU A 26 11.726 -15.758 -14.458 1.00 0.00 C ATOM 359 C LEU A 26 12.001 -15.699 -12.959 1.00 0.00 C ATOM 360 O LEU A 26 11.076 -15.680 -12.147 1.00 0.00 O ATOM 361 CB LEU A 26 12.457 -14.617 -15.167 1.00 0.00 C ATOM 362 CG LEU A 26 12.097 -14.400 -16.637 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.493 -13.001 -17.083 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.767 -15.450 -17.511 1.00 0.00 C ATOM 0 H LEU A 26 9.833 -14.862 -14.340 1.00 0.00 H new ATOM 0 HA LEU A 26 12.095 -16.710 -14.839 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.258 -13.693 -14.625 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.529 -14.802 -15.100 1.00 0.00 H new ATOM 0 HG LEU A 26 11.017 -14.501 -16.745 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.229 -12.865 -18.132 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.966 -12.263 -16.478 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.568 -12.870 -16.960 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.499 -15.280 -18.554 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.849 -15.381 -17.398 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.433 -16.442 -17.208 1.00 0.00 H new ATOM 376 N LYS A 27 13.279 -15.669 -12.598 1.00 0.00 N ATOM 377 CA LYS A 27 13.678 -15.608 -11.197 1.00 0.00 C ATOM 378 C LYS A 27 13.911 -14.166 -10.759 1.00 0.00 C ATOM 379 O LYS A 27 13.951 -13.255 -11.586 1.00 0.00 O ATOM 380 CB LYS A 27 14.947 -16.433 -10.971 1.00 0.00 C ATOM 381 CG LYS A 27 14.702 -17.932 -10.939 1.00 0.00 C ATOM 382 CD LYS A 27 16.002 -18.712 -11.039 1.00 0.00 C ATOM 383 CE LYS A 27 16.497 -18.789 -12.475 1.00 0.00 C ATOM 384 NZ LYS A 27 16.142 -20.086 -13.115 1.00 0.00 N ATOM 0 H LYS A 27 14.057 -15.686 -13.257 1.00 0.00 H new ATOM 0 HA LYS A 27 12.869 -16.024 -10.596 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.662 -16.207 -11.762 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.405 -16.128 -10.030 1.00 0.00 H new ATOM 0 HG2 LYS A 27 14.187 -18.198 -10.016 1.00 0.00 H new ATOM 0 HG3 LYS A 27 14.045 -18.212 -11.762 1.00 0.00 H new ATOM 0 HD2 LYS A 27 16.761 -18.238 -10.416 1.00 0.00 H new ATOM 0 HD3 LYS A 27 15.854 -19.719 -10.650 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.067 -17.970 -13.052 1.00 0.00 H new ATOM 0 HE3 LYS A 27 17.579 -18.659 -12.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 16.497 -20.099 -14.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.573 -20.867 -12.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.108 -20.199 -13.120 1.00 0.00 H new ATOM 398 N SER A 28 14.067 -13.966 -9.454 1.00 0.00 N ATOM 399 CA SER A 28 14.295 -12.634 -8.907 1.00 0.00 C ATOM 400 C SER A 28 15.689 -12.130 -9.266 1.00 0.00 C ATOM 401 O SER A 28 15.853 -10.999 -9.724 1.00 0.00 O ATOM 402 CB SER A 28 14.121 -12.648 -7.387 1.00 0.00 C ATOM 403 OG SER A 28 14.039 -11.330 -6.871 1.00 0.00 O ATOM 0 H SER A 28 14.040 -14.710 -8.756 1.00 0.00 H new ATOM 0 HA SER A 28 13.560 -11.958 -9.344 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.219 -13.201 -7.126 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.959 -13.171 -6.927 1.00 0.00 H new ATOM 0 HG SER A 28 13.927 -11.366 -5.898 1.00 0.00 H new ATOM 409 N SER A 29 16.691 -12.977 -9.056 1.00 0.00 N ATOM 410 CA SER A 29 18.072 -12.618 -9.353 1.00 0.00 C ATOM 411 C SER A 29 18.255 -12.351 -10.844 1.00 0.00 C ATOM 412 O SER A 29 19.132 -11.586 -11.247 1.00 0.00 O ATOM 413 CB SER A 29 19.020 -13.731 -8.904 1.00 0.00 C ATOM 414 OG SER A 29 20.230 -13.197 -8.396 1.00 0.00 O ATOM 0 H SER A 29 16.572 -13.918 -8.681 1.00 0.00 H new ATOM 0 HA SER A 29 18.309 -11.706 -8.805 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.537 -14.337 -8.138 1.00 0.00 H new ATOM 0 HB3 SER A 29 19.235 -14.391 -9.744 1.00 0.00 H new ATOM 0 HG SER A 29 20.818 -13.929 -8.114 1.00 0.00 H new ATOM 420 N ASP A 30 17.420 -12.987 -11.659 1.00 0.00 N ATOM 421 CA ASP A 30 17.487 -12.818 -13.106 1.00 0.00 C ATOM 422 C ASP A 30 17.252 -11.362 -13.495 1.00 0.00 C ATOM 423 O ASP A 30 18.144 -10.698 -14.026 1.00 0.00 O ATOM 424 CB ASP A 30 16.458 -13.716 -13.794 1.00 0.00 C ATOM 425 CG ASP A 30 17.016 -15.083 -14.133 1.00 0.00 C ATOM 426 OD1 ASP A 30 17.818 -15.611 -13.335 1.00 0.00 O ATOM 427 OD2 ASP A 30 16.653 -15.626 -15.198 1.00 0.00 O ATOM 0 H ASP A 30 16.689 -13.624 -11.342 1.00 0.00 H new ATOM 0 HA ASP A 30 18.486 -13.106 -13.435 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.590 -13.832 -13.145 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.111 -13.232 -14.707 1.00 0.00 H new ATOM 432 N LEU A 31 16.047 -10.871 -13.229 1.00 0.00 N ATOM 433 CA LEU A 31 15.693 -9.493 -13.552 1.00 0.00 C ATOM 434 C LEU A 31 16.720 -8.520 -12.981 1.00 0.00 C ATOM 435 O LEU A 31 17.055 -7.517 -13.611 1.00 0.00 O ATOM 436 CB LEU A 31 14.302 -9.162 -13.008 1.00 0.00 C ATOM 437 CG LEU A 31 13.124 -9.534 -13.909 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.111 -8.666 -15.157 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.182 -11.008 -14.282 1.00 0.00 C ATOM 0 H LEU A 31 15.298 -11.407 -12.790 1.00 0.00 H new ATOM 0 HA LEU A 31 15.686 -9.390 -14.637 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.177 -9.670 -12.052 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.257 -8.091 -12.808 1.00 0.00 H new ATOM 0 HG LEU A 31 12.200 -9.356 -13.358 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.266 -8.945 -15.786 1.00 0.00 H new ATOM 0 HD12 LEU A 31 13.019 -7.618 -14.871 1.00 0.00 H new ATOM 0 HD13 LEU A 31 14.039 -8.811 -15.711 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.336 -11.255 -14.923 1.00 0.00 H new ATOM 0 HD22 LEU A 31 14.112 -11.213 -14.813 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.140 -11.614 -13.377 1.00 0.00 H new ATOM 451 N GLU A 32 17.216 -8.824 -11.786 1.00 0.00 N ATOM 452 CA GLU A 32 18.206 -7.976 -11.132 1.00 0.00 C ATOM 453 C GLU A 32 19.469 -7.860 -11.981 1.00 0.00 C ATOM 454 O GLU A 32 20.105 -6.808 -12.023 1.00 0.00 O ATOM 455 CB GLU A 32 18.555 -8.533 -9.751 1.00 0.00 C ATOM 456 CG GLU A 32 17.403 -8.473 -8.761 1.00 0.00 C ATOM 457 CD GLU A 32 17.163 -7.073 -8.231 1.00 0.00 C ATOM 458 OE1 GLU A 32 17.814 -6.697 -7.233 1.00 0.00 O ATOM 459 OE2 GLU A 32 16.324 -6.353 -8.812 1.00 0.00 O ATOM 0 H GLU A 32 16.949 -9.650 -11.251 1.00 0.00 H new ATOM 0 HA GLU A 32 17.775 -6.982 -11.016 1.00 0.00 H new ATOM 0 HB2 GLU A 32 18.878 -9.569 -9.857 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.400 -7.976 -9.347 1.00 0.00 H new ATOM 0 HG2 GLU A 32 16.495 -8.836 -9.243 1.00 0.00 H new ATOM 0 HG3 GLU A 32 17.610 -9.143 -7.927 1.00 0.00 H new ATOM 466 N GLN A 33 19.825 -8.950 -12.653 1.00 0.00 N ATOM 467 CA GLN A 33 21.012 -8.972 -13.499 1.00 0.00 C ATOM 468 C GLN A 33 20.902 -7.941 -14.618 1.00 0.00 C ATOM 469 O GLN A 33 21.911 -7.442 -15.118 1.00 0.00 O ATOM 470 CB GLN A 33 21.216 -10.367 -14.092 1.00 0.00 C ATOM 471 CG GLN A 33 22.649 -10.644 -14.517 1.00 0.00 C ATOM 472 CD GLN A 33 23.403 -11.490 -13.510 1.00 0.00 C ATOM 473 OE1 GLN A 33 23.733 -11.028 -12.417 1.00 0.00 O ATOM 474 NE2 GLN A 33 23.679 -12.737 -13.873 1.00 0.00 N ATOM 0 H GLN A 33 19.308 -9.829 -12.628 1.00 0.00 H new ATOM 0 HA GLN A 33 21.873 -8.719 -12.880 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.913 -11.113 -13.357 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.561 -10.485 -14.955 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.646 -11.151 -15.482 1.00 0.00 H new ATOM 0 HG3 GLN A 33 23.172 -9.698 -14.655 1.00 0.00 H new ATOM 0 HE21 GLN A 33 23.386 -13.078 -14.789 1.00 0.00 H new ATOM 0 HE22 GLN A 33 24.184 -13.354 -13.236 1.00 0.00 H new ATOM 483 N LEU A 34 19.672 -7.627 -15.007 1.00 0.00 N ATOM 484 CA LEU A 34 19.430 -6.655 -16.067 1.00 0.00 C ATOM 485 C LEU A 34 19.600 -5.230 -15.550 1.00 0.00 C ATOM 486 O LEU A 34 19.559 -4.988 -14.344 1.00 0.00 O ATOM 487 CB LEU A 34 18.023 -6.836 -16.641 1.00 0.00 C ATOM 488 CG LEU A 34 17.721 -8.203 -17.256 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.219 -8.412 -17.381 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.395 -8.338 -18.614 1.00 0.00 C ATOM 0 H LEU A 34 18.826 -8.031 -14.604 1.00 0.00 H new ATOM 0 HA LEU A 34 20.163 -6.826 -16.856 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.301 -6.650 -15.846 1.00 0.00 H new ATOM 0 HB3 LEU A 34 17.862 -6.073 -17.403 1.00 0.00 H new ATOM 0 HG LEU A 34 18.121 -8.973 -16.596 1.00 0.00 H new ATOM 0 HD11 LEU A 34 16.023 -9.390 -17.821 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.761 -8.360 -16.393 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.796 -7.636 -18.019 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.169 -9.317 -19.037 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.026 -7.560 -19.282 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.474 -8.234 -18.497 1.00 0.00 H new ATOM 502 N ARG A 35 19.789 -4.290 -16.471 1.00 0.00 N ATOM 503 CA ARG A 35 19.964 -2.889 -16.108 1.00 0.00 C ATOM 504 C ARG A 35 18.741 -2.364 -15.361 1.00 0.00 C ATOM 505 O ARG A 35 17.606 -2.546 -15.801 1.00 0.00 O ATOM 506 CB ARG A 35 20.213 -2.044 -17.358 1.00 0.00 C ATOM 507 CG ARG A 35 21.478 -1.204 -17.283 1.00 0.00 C ATOM 508 CD ARG A 35 22.258 -1.254 -18.587 1.00 0.00 C ATOM 509 NE ARG A 35 23.392 -2.171 -18.512 1.00 0.00 N ATOM 510 CZ ARG A 35 24.550 -1.863 -17.939 1.00 0.00 C ATOM 511 NH1 ARG A 35 24.726 -0.667 -17.394 1.00 0.00 N ATOM 512 NH2 ARG A 35 25.535 -2.752 -17.910 1.00 0.00 N ATOM 0 H ARG A 35 19.825 -4.474 -17.474 1.00 0.00 H new ATOM 0 HA ARG A 35 20.830 -2.815 -15.450 1.00 0.00 H new ATOM 0 HB2 ARG A 35 20.275 -2.702 -18.225 1.00 0.00 H new ATOM 0 HB3 ARG A 35 19.359 -1.386 -17.518 1.00 0.00 H new ATOM 0 HG2 ARG A 35 21.217 -0.171 -17.053 1.00 0.00 H new ATOM 0 HG3 ARG A 35 22.106 -1.563 -16.468 1.00 0.00 H new ATOM 0 HD2 ARG A 35 21.594 -1.563 -19.395 1.00 0.00 H new ATOM 0 HD3 ARG A 35 22.616 -0.254 -18.834 1.00 0.00 H new ATOM 0 HE ARG A 35 23.289 -3.099 -18.922 1.00 0.00 H new ATOM 0 HH11 ARG A 35 23.971 0.019 -17.414 1.00 0.00 H new ATOM 0 HH12 ARG A 35 25.616 -0.433 -16.955 1.00 0.00 H new ATOM 0 HH21 ARG A 35 25.403 -3.673 -18.328 1.00 0.00 H new ATOM 0 HH22 ARG A 35 26.424 -2.514 -17.470 1.00 0.00 H new ATOM 526 N LYS A 36 18.982 -1.712 -14.229 1.00 0.00 N ATOM 527 CA LYS A 36 17.902 -1.159 -13.420 1.00 0.00 C ATOM 528 C LYS A 36 17.721 0.330 -13.699 1.00 0.00 C ATOM 529 O LYS A 36 18.537 1.152 -13.282 1.00 0.00 O ATOM 530 CB LYS A 36 18.187 -1.379 -11.932 1.00 0.00 C ATOM 531 CG LYS A 36 18.211 -2.843 -11.528 1.00 0.00 C ATOM 532 CD LYS A 36 17.786 -3.029 -10.081 1.00 0.00 C ATOM 533 CE LYS A 36 18.988 -3.113 -9.153 1.00 0.00 C ATOM 534 NZ LYS A 36 18.596 -3.508 -7.772 1.00 0.00 N ATOM 0 H LYS A 36 19.916 -1.553 -13.851 1.00 0.00 H new ATOM 0 HA LYS A 36 16.980 -1.676 -13.687 1.00 0.00 H new ATOM 0 HB2 LYS A 36 19.147 -0.926 -11.684 1.00 0.00 H new ATOM 0 HB3 LYS A 36 17.429 -0.861 -11.345 1.00 0.00 H new ATOM 0 HG2 LYS A 36 17.547 -3.412 -12.179 1.00 0.00 H new ATOM 0 HG3 LYS A 36 19.215 -3.244 -11.668 1.00 0.00 H new ATOM 0 HD2 LYS A 36 17.149 -2.198 -9.778 1.00 0.00 H new ATOM 0 HD3 LYS A 36 17.190 -3.937 -9.990 1.00 0.00 H new ATOM 0 HE2 LYS A 36 19.702 -3.835 -9.548 1.00 0.00 H new ATOM 0 HE3 LYS A 36 19.493 -2.148 -9.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 19.375 -3.296 -7.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 17.748 -2.978 -7.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 18.391 -4.527 -7.747 1.00 0.00 H new ATOM 548 N ILE A 37 16.646 0.669 -14.403 1.00 0.00 N ATOM 549 CA ILE A 37 16.357 2.059 -14.734 1.00 0.00 C ATOM 550 C ILE A 37 15.320 2.646 -13.784 1.00 0.00 C ATOM 551 O ILE A 37 14.268 2.051 -13.552 1.00 0.00 O ATOM 552 CB ILE A 37 15.849 2.199 -16.181 1.00 0.00 C ATOM 553 CG1 ILE A 37 16.827 1.538 -17.155 1.00 0.00 C ATOM 554 CG2 ILE A 37 15.651 3.666 -16.534 1.00 0.00 C ATOM 555 CD1 ILE A 37 16.464 0.112 -17.503 1.00 0.00 C ATOM 0 H ILE A 37 15.961 0.000 -14.755 1.00 0.00 H new ATOM 0 HA ILE A 37 17.292 2.609 -14.631 1.00 0.00 H new ATOM 0 HB ILE A 37 14.887 1.693 -16.263 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.869 2.127 -18.071 1.00 0.00 H new ATOM 0 HG13 ILE A 37 17.826 1.554 -16.720 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.292 3.748 -17.560 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.920 4.108 -15.857 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.600 4.194 -16.438 1.00 0.00 H new ATOM 0 HD11 ILE A 37 17.201 -0.292 -18.197 1.00 0.00 H new ATOM 0 HD12 ILE A 37 16.451 -0.492 -16.596 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.478 0.091 -17.968 1.00 0.00 H new ATOM 567 N ARG A 38 15.624 3.819 -13.237 1.00 0.00 N ATOM 568 CA ARG A 38 14.717 4.488 -12.311 1.00 0.00 C ATOM 569 C ARG A 38 14.153 5.764 -12.930 1.00 0.00 C ATOM 570 O ARG A 38 14.722 6.844 -12.776 1.00 0.00 O ATOM 571 CB ARG A 38 15.440 4.819 -11.005 1.00 0.00 C ATOM 572 CG ARG A 38 15.078 3.891 -9.856 1.00 0.00 C ATOM 573 CD ARG A 38 16.047 2.723 -9.757 1.00 0.00 C ATOM 574 NE ARG A 38 17.399 3.161 -9.423 1.00 0.00 N ATOM 575 CZ ARG A 38 18.357 2.338 -9.011 1.00 0.00 C ATOM 576 NH1 ARG A 38 18.112 1.041 -8.882 1.00 0.00 N ATOM 577 NH2 ARG A 38 19.564 2.812 -8.726 1.00 0.00 N ATOM 0 H ARG A 38 16.491 4.325 -13.419 1.00 0.00 H new ATOM 0 HA ARG A 38 13.890 3.811 -12.099 1.00 0.00 H new ATOM 0 HB2 ARG A 38 16.516 4.772 -11.173 1.00 0.00 H new ATOM 0 HB3 ARG A 38 15.206 5.845 -10.720 1.00 0.00 H new ATOM 0 HG2 ARG A 38 15.083 4.450 -8.920 1.00 0.00 H new ATOM 0 HG3 ARG A 38 14.065 3.514 -9.997 1.00 0.00 H new ATOM 0 HD2 ARG A 38 15.695 2.023 -8.999 1.00 0.00 H new ATOM 0 HD3 ARG A 38 16.064 2.185 -10.705 1.00 0.00 H new ATOM 0 HE ARG A 38 17.620 4.153 -9.511 1.00 0.00 H new ATOM 0 HH11 ARG A 38 17.186 0.673 -9.099 1.00 0.00 H new ATOM 0 HH12 ARG A 38 18.850 0.412 -8.565 1.00 0.00 H new ATOM 0 HH21 ARG A 38 19.756 3.809 -8.823 1.00 0.00 H new ATOM 0 HH22 ARG A 38 20.299 2.179 -8.410 1.00 0.00 H new ATOM 591 N ARG A 39 13.032 5.629 -13.631 1.00 0.00 N ATOM 592 CA ARG A 39 12.392 6.771 -14.274 1.00 0.00 C ATOM 593 C ARG A 39 12.031 7.841 -13.249 1.00 0.00 C ATOM 594 O ARG A 39 12.086 7.603 -12.042 1.00 0.00 O ATOM 595 CB ARG A 39 11.135 6.322 -15.023 1.00 0.00 C ATOM 596 CG ARG A 39 11.428 5.491 -16.261 1.00 0.00 C ATOM 597 CD ARG A 39 10.420 5.764 -17.367 1.00 0.00 C ATOM 598 NE ARG A 39 11.054 5.831 -18.681 1.00 0.00 N ATOM 599 CZ ARG A 39 11.689 6.905 -19.137 1.00 0.00 C ATOM 600 NH1 ARG A 39 11.774 7.996 -18.389 1.00 0.00 N ATOM 601 NH2 ARG A 39 12.241 6.888 -20.344 1.00 0.00 N ATOM 0 H ARG A 39 12.548 4.741 -13.768 1.00 0.00 H new ATOM 0 HA ARG A 39 13.098 7.199 -14.986 1.00 0.00 H new ATOM 0 HB2 ARG A 39 10.507 5.742 -14.347 1.00 0.00 H new ATOM 0 HB3 ARG A 39 10.562 7.202 -15.314 1.00 0.00 H new ATOM 0 HG2 ARG A 39 12.433 5.713 -16.620 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.409 4.432 -16.003 1.00 0.00 H new ATOM 0 HD2 ARG A 39 9.663 4.980 -17.369 1.00 0.00 H new ATOM 0 HD3 ARG A 39 9.905 6.703 -17.165 1.00 0.00 H new ATOM 0 HE ARG A 39 11.007 5.008 -19.282 1.00 0.00 H new ATOM 0 HH11 ARG A 39 11.351 8.012 -17.461 1.00 0.00 H new ATOM 0 HH12 ARG A 39 12.262 8.819 -18.742 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.178 6.050 -20.922 1.00 0.00 H new ATOM 0 HH22 ARG A 39 12.728 7.713 -20.694 1.00 0.00 H new ATOM 615 N ARG A 40 11.662 9.021 -13.737 1.00 0.00 N ATOM 616 CA ARG A 40 11.295 10.128 -12.863 1.00 0.00 C ATOM 617 C ARG A 40 9.821 10.489 -13.032 1.00 0.00 C ATOM 618 O ARG A 40 9.221 11.116 -12.160 1.00 0.00 O ATOM 619 CB ARG A 40 12.166 11.350 -13.158 1.00 0.00 C ATOM 620 CG ARG A 40 13.516 11.319 -12.459 1.00 0.00 C ATOM 621 CD ARG A 40 14.609 10.800 -13.380 1.00 0.00 C ATOM 622 NE ARG A 40 15.570 11.843 -13.730 1.00 0.00 N ATOM 623 CZ ARG A 40 16.369 11.780 -14.789 1.00 0.00 C ATOM 624 NH1 ARG A 40 16.321 10.732 -15.599 1.00 0.00 N ATOM 625 NH2 ARG A 40 17.217 12.769 -15.041 1.00 0.00 N ATOM 0 H ARG A 40 11.609 9.235 -14.733 1.00 0.00 H new ATOM 0 HA ARG A 40 11.459 9.813 -11.832 1.00 0.00 H new ATOM 0 HB2 ARG A 40 12.325 11.421 -14.234 1.00 0.00 H new ATOM 0 HB3 ARG A 40 11.630 12.249 -12.855 1.00 0.00 H new ATOM 0 HG2 ARG A 40 13.773 12.322 -12.117 1.00 0.00 H new ATOM 0 HG3 ARG A 40 13.454 10.686 -11.574 1.00 0.00 H new ATOM 0 HD2 ARG A 40 15.130 9.975 -12.895 1.00 0.00 H new ATOM 0 HD3 ARG A 40 14.158 10.402 -14.289 1.00 0.00 H new ATOM 0 HE ARG A 40 15.631 12.664 -13.128 1.00 0.00 H new ATOM 0 HH11 ARG A 40 15.669 9.971 -15.410 1.00 0.00 H new ATOM 0 HH12 ARG A 40 16.936 10.687 -16.411 1.00 0.00 H new ATOM 0 HH21 ARG A 40 17.255 13.578 -14.421 1.00 0.00 H new ATOM 0 HH22 ARG A 40 17.830 12.720 -15.854 1.00 0.00 H new ATOM 639 N SER A 41 9.246 10.088 -14.161 1.00 0.00 N ATOM 640 CA SER A 41 7.844 10.372 -14.447 1.00 0.00 C ATOM 641 C SER A 41 7.603 11.875 -14.543 1.00 0.00 C ATOM 642 O SER A 41 8.390 12.688 -14.058 1.00 0.00 O ATOM 643 CB SER A 41 6.948 9.768 -13.364 1.00 0.00 C ATOM 644 OG SER A 41 6.223 8.657 -13.863 1.00 0.00 O ATOM 0 H SER A 41 9.729 9.566 -14.892 1.00 0.00 H new ATOM 0 HA SER A 41 7.596 9.920 -15.407 1.00 0.00 H new ATOM 0 HB2 SER A 41 7.557 9.457 -12.515 1.00 0.00 H new ATOM 0 HB3 SER A 41 6.254 10.525 -12.998 1.00 0.00 H new ATOM 0 HG SER A 41 5.659 8.288 -13.151 1.00 0.00 H new ATOM 650 N PRO A 42 6.488 12.255 -15.184 1.00 0.00 N ATOM 651 CA PRO A 42 6.116 13.662 -15.359 1.00 0.00 C ATOM 652 C PRO A 42 5.703 14.320 -14.046 1.00 0.00 C ATOM 653 O PRO A 42 6.120 15.438 -13.742 1.00 0.00 O ATOM 654 CB PRO A 42 4.928 13.598 -16.322 1.00 0.00 C ATOM 655 CG PRO A 42 4.346 12.242 -16.116 1.00 0.00 C ATOM 656 CD PRO A 42 5.504 11.340 -15.787 1.00 0.00 C ATOM 0 HA PRO A 42 6.949 14.261 -15.727 1.00 0.00 H new ATOM 0 HB2 PRO A 42 4.199 14.379 -16.104 1.00 0.00 H new ATOM 0 HB3 PRO A 42 5.247 13.739 -17.355 1.00 0.00 H new ATOM 0 HG2 PRO A 42 3.615 12.250 -15.307 1.00 0.00 H new ATOM 0 HG3 PRO A 42 3.827 11.900 -17.011 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.214 10.549 -15.095 1.00 0.00 H new ATOM 0 HD3 PRO A 42 5.901 10.854 -16.678 1.00 0.00 H new ATOM 664 N HIS A 43 4.881 13.619 -13.271 1.00 0.00 N ATOM 665 CA HIS A 43 4.412 14.135 -11.990 1.00 0.00 C ATOM 666 C HIS A 43 4.866 13.237 -10.844 1.00 0.00 C ATOM 667 O HIS A 43 5.285 12.100 -11.062 1.00 0.00 O ATOM 668 CB HIS A 43 2.888 14.251 -11.990 1.00 0.00 C ATOM 669 CG HIS A 43 2.390 15.602 -12.404 1.00 0.00 C ATOM 670 ND1 HIS A 43 2.876 16.778 -11.873 1.00 0.00 N ATOM 671 CD2 HIS A 43 1.444 15.959 -13.304 1.00 0.00 C ATOM 672 CE1 HIS A 43 2.249 17.801 -12.428 1.00 0.00 C ATOM 673 NE2 HIS A 43 1.376 17.331 -13.300 1.00 0.00 N ATOM 0 H HIS A 43 4.526 12.692 -13.508 1.00 0.00 H new ATOM 0 HA HIS A 43 4.844 15.125 -11.845 1.00 0.00 H new ATOM 0 HB2 HIS A 43 2.475 13.499 -12.662 1.00 0.00 H new ATOM 0 HB3 HIS A 43 2.515 14.026 -10.991 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.853 15.290 -13.912 1.00 0.00 H new ATOM 0 HE1 HIS A 43 2.421 18.844 -12.206 1.00 0.00 H new ATOM 0 HE2 HIS A 43 0.752 17.895 -13.877 1.00 0.00 H new ATOM 681 N GLU A 44 4.780 13.755 -9.622 1.00 0.00 N ATOM 682 CA GLU A 44 5.184 12.999 -8.443 1.00 0.00 C ATOM 683 C GLU A 44 6.598 12.448 -8.607 1.00 0.00 C ATOM 684 O GLU A 44 6.788 11.250 -8.819 1.00 0.00 O ATOM 685 CB GLU A 44 4.205 11.852 -8.185 1.00 0.00 C ATOM 686 CG GLU A 44 2.779 12.313 -7.937 1.00 0.00 C ATOM 687 CD GLU A 44 1.748 11.312 -8.422 1.00 0.00 C ATOM 688 OE1 GLU A 44 1.987 10.676 -9.470 1.00 0.00 O ATOM 689 OE2 GLU A 44 0.703 11.166 -7.754 1.00 0.00 O ATOM 0 H GLU A 44 4.435 14.694 -9.424 1.00 0.00 H new ATOM 0 HA GLU A 44 5.173 13.676 -7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.216 11.177 -9.041 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.548 11.280 -7.323 1.00 0.00 H new ATOM 0 HG2 GLU A 44 2.638 12.486 -6.870 1.00 0.00 H new ATOM 0 HG3 GLU A 44 2.617 13.267 -8.439 1.00 0.00 H new ATOM 696 N ASP A 45 7.585 13.330 -8.509 1.00 0.00 N ATOM 697 CA ASP A 45 8.982 12.934 -8.646 1.00 0.00 C ATOM 698 C ASP A 45 9.390 11.984 -7.524 1.00 0.00 C ATOM 699 O ASP A 45 10.281 11.151 -7.693 1.00 0.00 O ATOM 700 CB ASP A 45 9.887 14.167 -8.641 1.00 0.00 C ATOM 701 CG ASP A 45 10.089 14.732 -7.249 1.00 0.00 C ATOM 702 OD1 ASP A 45 9.084 15.100 -6.607 1.00 0.00 O ATOM 703 OD2 ASP A 45 11.253 14.806 -6.802 1.00 0.00 O ATOM 0 H ASP A 45 7.444 14.325 -8.335 1.00 0.00 H new ATOM 0 HA ASP A 45 9.095 12.414 -9.597 1.00 0.00 H new ATOM 0 HB2 ASP A 45 10.855 13.905 -9.067 1.00 0.00 H new ATOM 0 HB3 ASP A 45 9.454 14.935 -9.282 1.00 0.00 H new ATOM 708 N THR A 46 8.732 12.115 -6.376 1.00 0.00 N ATOM 709 CA THR A 46 9.027 11.271 -5.225 1.00 0.00 C ATOM 710 C THR A 46 8.876 9.794 -5.573 1.00 0.00 C ATOM 711 O THR A 46 9.798 9.003 -5.374 1.00 0.00 O ATOM 712 CB THR A 46 8.107 11.602 -4.035 1.00 0.00 C ATOM 713 OG1 THR A 46 6.736 11.431 -4.412 1.00 0.00 O ATOM 714 CG2 THR A 46 8.333 13.029 -3.557 1.00 0.00 C ATOM 0 H THR A 46 7.991 12.798 -6.219 1.00 0.00 H new ATOM 0 HA THR A 46 10.061 11.472 -4.943 1.00 0.00 H new ATOM 0 HB THR A 46 8.346 10.920 -3.219 1.00 0.00 H new ATOM 0 HG1 THR A 46 6.158 11.642 -3.649 1.00 0.00 H new ATOM 0 HG21 THR A 46 7.672 13.240 -2.716 1.00 0.00 H new ATOM 0 HG22 THR A 46 9.370 13.147 -3.242 1.00 0.00 H new ATOM 0 HG23 THR A 46 8.119 13.723 -4.370 1.00 0.00 H new ATOM 722 N GLU A 47 7.709 9.430 -6.095 1.00 0.00 N ATOM 723 CA GLU A 47 7.439 8.047 -6.471 1.00 0.00 C ATOM 724 C GLU A 47 8.510 7.523 -7.423 1.00 0.00 C ATOM 725 O GLU A 47 8.684 8.043 -8.525 1.00 0.00 O ATOM 726 CB GLU A 47 6.060 7.932 -7.124 1.00 0.00 C ATOM 727 CG GLU A 47 4.986 7.405 -6.188 1.00 0.00 C ATOM 728 CD GLU A 47 4.039 8.491 -5.715 1.00 0.00 C ATOM 729 OE1 GLU A 47 3.369 9.106 -6.571 1.00 0.00 O ATOM 730 OE2 GLU A 47 3.969 8.725 -4.491 1.00 0.00 O ATOM 0 H GLU A 47 6.936 10.073 -6.267 1.00 0.00 H new ATOM 0 HA GLU A 47 7.455 7.442 -5.565 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.759 8.912 -7.493 1.00 0.00 H new ATOM 0 HB3 GLU A 47 6.131 7.273 -7.990 1.00 0.00 H new ATOM 0 HG2 GLU A 47 4.416 6.627 -6.697 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.459 6.939 -5.324 1.00 0.00 H new ATOM 737 N SER A 48 9.226 6.490 -6.990 1.00 0.00 N ATOM 738 CA SER A 48 10.283 5.898 -7.801 1.00 0.00 C ATOM 739 C SER A 48 10.167 4.377 -7.817 1.00 0.00 C ATOM 740 O SER A 48 9.830 3.758 -6.808 1.00 0.00 O ATOM 741 CB SER A 48 11.656 6.311 -7.267 1.00 0.00 C ATOM 742 OG SER A 48 11.636 7.643 -6.783 1.00 0.00 O ATOM 0 H SER A 48 9.093 6.046 -6.082 1.00 0.00 H new ATOM 0 HA SER A 48 10.173 6.264 -8.822 1.00 0.00 H new ATOM 0 HB2 SER A 48 11.957 5.635 -6.467 1.00 0.00 H new ATOM 0 HB3 SER A 48 12.400 6.220 -8.058 1.00 0.00 H new ATOM 0 HG SER A 48 11.029 7.703 -6.016 1.00 0.00 H new ATOM 748 N PHE A 49 10.450 3.781 -8.971 1.00 0.00 N ATOM 749 CA PHE A 49 10.377 2.332 -9.121 1.00 0.00 C ATOM 750 C PHE A 49 11.279 1.857 -10.256 1.00 0.00 C ATOM 751 O PHE A 49 11.404 2.521 -11.286 1.00 0.00 O ATOM 752 CB PHE A 49 8.934 1.897 -9.385 1.00 0.00 C ATOM 753 CG PHE A 49 8.262 2.680 -10.477 1.00 0.00 C ATOM 754 CD1 PHE A 49 7.617 3.873 -10.196 1.00 0.00 C ATOM 755 CD2 PHE A 49 8.277 2.222 -11.785 1.00 0.00 C ATOM 756 CE1 PHE A 49 6.997 4.594 -11.199 1.00 0.00 C ATOM 757 CE2 PHE A 49 7.660 2.940 -12.792 1.00 0.00 C ATOM 758 CZ PHE A 49 7.020 4.128 -12.499 1.00 0.00 C ATOM 0 H PHE A 49 10.732 4.279 -9.815 1.00 0.00 H new ATOM 0 HA PHE A 49 10.722 1.878 -8.192 1.00 0.00 H new ATOM 0 HB2 PHE A 49 8.924 0.839 -9.648 1.00 0.00 H new ATOM 0 HB3 PHE A 49 8.357 2.002 -8.466 1.00 0.00 H new ATOM 0 HD1 PHE A 49 7.598 4.244 -9.182 1.00 0.00 H new ATOM 0 HD2 PHE A 49 8.776 1.294 -12.020 1.00 0.00 H new ATOM 0 HE1 PHE A 49 6.495 5.521 -10.966 1.00 0.00 H new ATOM 0 HE2 PHE A 49 7.678 2.572 -13.807 1.00 0.00 H new ATOM 0 HZ PHE A 49 6.539 4.691 -13.285 1.00 0.00 H new ATOM 768 N THR A 50 11.908 0.702 -10.060 1.00 0.00 N ATOM 769 CA THR A 50 12.801 0.138 -11.065 1.00 0.00 C ATOM 770 C THR A 50 12.014 -0.434 -12.239 1.00 0.00 C ATOM 771 O THR A 50 11.031 -1.150 -12.050 1.00 0.00 O ATOM 772 CB THR A 50 13.690 -0.969 -10.468 1.00 0.00 C ATOM 773 OG1 THR A 50 14.487 -0.437 -9.405 1.00 0.00 O ATOM 774 CG2 THR A 50 14.593 -1.571 -11.534 1.00 0.00 C ATOM 0 H THR A 50 11.815 0.139 -9.214 1.00 0.00 H new ATOM 0 HA THR A 50 13.435 0.951 -11.418 1.00 0.00 H new ATOM 0 HB THR A 50 13.042 -1.754 -10.078 1.00 0.00 H new ATOM 0 HG1 THR A 50 15.048 -1.147 -9.030 1.00 0.00 H new ATOM 0 HG21 THR A 50 15.212 -2.350 -11.089 1.00 0.00 H new ATOM 0 HG22 THR A 50 13.982 -2.001 -12.328 1.00 0.00 H new ATOM 0 HG23 THR A 50 15.233 -0.793 -11.950 1.00 0.00 H new ATOM 782 N VAL A 51 12.455 -0.115 -13.452 1.00 0.00 N ATOM 783 CA VAL A 51 11.793 -0.600 -14.657 1.00 0.00 C ATOM 784 C VAL A 51 12.797 -1.210 -15.628 1.00 0.00 C ATOM 785 O VAL A 51 13.920 -0.722 -15.765 1.00 0.00 O ATOM 786 CB VAL A 51 11.028 0.531 -15.371 1.00 0.00 C ATOM 787 CG1 VAL A 51 9.817 0.956 -14.553 1.00 0.00 C ATOM 788 CG2 VAL A 51 11.948 1.715 -15.630 1.00 0.00 C ATOM 0 H VAL A 51 13.267 0.477 -13.626 1.00 0.00 H new ATOM 0 HA VAL A 51 11.084 -1.366 -14.342 1.00 0.00 H new ATOM 0 HB VAL A 51 10.675 0.157 -16.332 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.289 1.756 -15.073 1.00 0.00 H new ATOM 0 HG12 VAL A 51 9.149 0.105 -14.423 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.145 1.313 -13.576 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.391 2.505 -16.135 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.332 2.091 -14.682 1.00 0.00 H new ATOM 0 HG23 VAL A 51 12.780 1.398 -16.259 1.00 0.00 H new ATOM 798 N TYR A 52 12.386 -2.279 -16.301 1.00 0.00 N ATOM 799 CA TYR A 52 13.251 -2.958 -17.259 1.00 0.00 C ATOM 800 C TYR A 52 12.782 -2.709 -18.689 1.00 0.00 C ATOM 801 O TYR A 52 11.773 -2.039 -18.916 1.00 0.00 O ATOM 802 CB TYR A 52 13.281 -4.461 -16.975 1.00 0.00 C ATOM 803 CG TYR A 52 13.613 -4.799 -15.539 1.00 0.00 C ATOM 804 CD1 TYR A 52 14.839 -4.449 -14.987 1.00 0.00 C ATOM 805 CD2 TYR A 52 12.699 -5.468 -14.733 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.146 -4.757 -13.676 1.00 0.00 C ATOM 807 CE2 TYR A 52 12.998 -5.779 -13.421 1.00 0.00 C ATOM 808 CZ TYR A 52 14.223 -5.422 -12.897 1.00 0.00 C ATOM 809 OH TYR A 52 14.525 -5.729 -11.590 1.00 0.00 O ATOM 0 H TYR A 52 11.460 -2.694 -16.201 1.00 0.00 H new ATOM 0 HA TYR A 52 14.258 -2.554 -17.151 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.310 -4.889 -17.225 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.015 -4.931 -17.629 1.00 0.00 H new ATOM 0 HD1 TYR A 52 15.564 -3.927 -15.593 1.00 0.00 H new ATOM 0 HD2 TYR A 52 11.739 -5.749 -15.140 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.104 -4.478 -13.263 1.00 0.00 H new ATOM 0 HE2 TYR A 52 12.276 -6.299 -12.808 1.00 0.00 H new ATOM 0 HH TYR A 52 13.767 -6.196 -11.180 1.00 0.00 H new ATOM 819 N LEU A 53 13.520 -3.252 -19.650 1.00 0.00 N ATOM 820 CA LEU A 53 13.181 -3.090 -21.059 1.00 0.00 C ATOM 821 C LEU A 53 12.602 -4.380 -21.632 1.00 0.00 C ATOM 822 O LEU A 53 13.150 -5.463 -21.426 1.00 0.00 O ATOM 823 CB LEU A 53 14.418 -2.675 -21.858 1.00 0.00 C ATOM 824 CG LEU A 53 14.521 -1.191 -22.211 1.00 0.00 C ATOM 825 CD1 LEU A 53 15.338 -0.448 -21.165 1.00 0.00 C ATOM 826 CD2 LEU A 53 15.134 -1.013 -23.593 1.00 0.00 C ATOM 0 H LEU A 53 14.358 -3.809 -19.479 1.00 0.00 H new ATOM 0 HA LEU A 53 12.426 -2.308 -21.137 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.304 -2.955 -21.289 1.00 0.00 H new ATOM 0 HB3 LEU A 53 14.438 -3.251 -22.783 1.00 0.00 H new ATOM 0 HG LEU A 53 13.516 -0.770 -22.223 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.400 0.607 -21.434 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.858 -0.547 -20.191 1.00 0.00 H new ATOM 0 HD13 LEU A 53 16.342 -0.871 -21.120 1.00 0.00 H new ATOM 0 HD21 LEU A 53 15.200 0.049 -23.828 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.132 -1.450 -23.607 1.00 0.00 H new ATOM 0 HD23 LEU A 53 14.509 -1.511 -24.335 1.00 0.00 H new ATOM 838 N ARG A 54 11.493 -4.256 -22.353 1.00 0.00 N ATOM 839 CA ARG A 54 10.840 -5.412 -22.956 1.00 0.00 C ATOM 840 C ARG A 54 11.830 -6.222 -23.789 1.00 0.00 C ATOM 841 O ARG A 54 11.731 -7.446 -23.871 1.00 0.00 O ATOM 842 CB ARG A 54 9.668 -4.964 -23.831 1.00 0.00 C ATOM 843 CG ARG A 54 8.449 -5.865 -23.723 1.00 0.00 C ATOM 844 CD ARG A 54 7.165 -5.055 -23.628 1.00 0.00 C ATOM 845 NE ARG A 54 5.980 -5.909 -23.609 1.00 0.00 N ATOM 846 CZ ARG A 54 5.446 -6.450 -24.699 1.00 0.00 C ATOM 847 NH1 ARG A 54 5.989 -6.226 -25.888 1.00 0.00 N ATOM 848 NH2 ARG A 54 4.367 -7.216 -24.601 1.00 0.00 N ATOM 0 H ARG A 54 11.028 -3.367 -22.534 1.00 0.00 H new ATOM 0 HA ARG A 54 10.463 -6.045 -22.153 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.385 -3.949 -23.553 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.994 -4.930 -24.871 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.403 -6.522 -24.591 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.544 -6.504 -22.845 1.00 0.00 H new ATOM 0 HD2 ARG A 54 7.187 -4.445 -22.725 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.105 -4.370 -24.474 1.00 0.00 H new ATOM 0 HE ARG A 54 5.538 -6.101 -22.710 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.818 -5.637 -25.967 1.00 0.00 H new ATOM 0 HH12 ARG A 54 5.577 -6.642 -26.723 1.00 0.00 H new ATOM 0 HH21 ARG A 54 3.946 -7.390 -23.688 1.00 0.00 H new ATOM 0 HH22 ARG A 54 3.958 -7.631 -25.438 1.00 0.00 H new ATOM 862 N SER A 55 12.782 -5.529 -24.405 1.00 0.00 N ATOM 863 CA SER A 55 13.787 -6.183 -25.235 1.00 0.00 C ATOM 864 C SER A 55 14.749 -7.002 -24.380 1.00 0.00 C ATOM 865 O SER A 55 15.119 -8.120 -24.740 1.00 0.00 O ATOM 866 CB SER A 55 14.565 -5.144 -26.045 1.00 0.00 C ATOM 867 OG SER A 55 14.706 -5.551 -27.396 1.00 0.00 O ATOM 0 H SER A 55 12.879 -4.515 -24.345 1.00 0.00 H new ATOM 0 HA SER A 55 13.273 -6.857 -25.920 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.049 -4.185 -26.003 1.00 0.00 H new ATOM 0 HB3 SER A 55 15.550 -4.996 -25.602 1.00 0.00 H new ATOM 0 HG SER A 55 15.205 -4.869 -27.893 1.00 0.00 H new ATOM 873 N ASP A 56 15.150 -6.437 -23.246 1.00 0.00 N ATOM 874 CA ASP A 56 16.068 -7.114 -22.338 1.00 0.00 C ATOM 875 C ASP A 56 15.436 -8.381 -21.771 1.00 0.00 C ATOM 876 O ASP A 56 16.009 -9.467 -21.859 1.00 0.00 O ATOM 877 CB ASP A 56 16.475 -6.178 -21.199 1.00 0.00 C ATOM 878 CG ASP A 56 17.879 -5.633 -21.371 1.00 0.00 C ATOM 879 OD1 ASP A 56 18.827 -6.444 -21.430 1.00 0.00 O ATOM 880 OD2 ASP A 56 18.030 -4.396 -21.447 1.00 0.00 O ATOM 0 H ASP A 56 14.854 -5.512 -22.934 1.00 0.00 H new ATOM 0 HA ASP A 56 16.957 -7.395 -22.902 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.770 -5.348 -21.145 1.00 0.00 H new ATOM 0 HB3 ASP A 56 16.410 -6.713 -20.252 1.00 0.00 H new ATOM 885 N VAL A 57 14.250 -8.235 -21.187 1.00 0.00 N ATOM 886 CA VAL A 57 13.540 -9.367 -20.604 1.00 0.00 C ATOM 887 C VAL A 57 13.305 -10.460 -21.641 1.00 0.00 C ATOM 888 O VAL A 57 13.332 -11.648 -21.320 1.00 0.00 O ATOM 889 CB VAL A 57 12.184 -8.935 -20.014 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.481 -10.120 -19.368 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.376 -7.807 -19.011 1.00 0.00 C ATOM 0 H VAL A 57 13.761 -7.344 -21.105 1.00 0.00 H new ATOM 0 HA VAL A 57 14.168 -9.758 -19.804 1.00 0.00 H new ATOM 0 HB VAL A 57 11.554 -8.567 -20.824 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.525 -9.796 -18.957 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.310 -10.894 -20.116 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.103 -10.520 -18.568 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.408 -7.514 -18.604 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.023 -8.146 -18.202 1.00 0.00 H new ATOM 0 HG23 VAL A 57 12.835 -6.952 -19.508 1.00 0.00 H new ATOM 901 N GLU A 58 13.075 -10.050 -22.884 1.00 0.00 N ATOM 902 CA GLU A 58 12.835 -10.995 -23.968 1.00 0.00 C ATOM 903 C GLU A 58 13.939 -12.048 -24.026 1.00 0.00 C ATOM 904 O GLU A 58 13.678 -13.244 -23.899 1.00 0.00 O ATOM 905 CB GLU A 58 12.746 -10.260 -25.306 1.00 0.00 C ATOM 906 CG GLU A 58 12.180 -11.109 -26.431 1.00 0.00 C ATOM 907 CD GLU A 58 11.388 -10.295 -27.436 1.00 0.00 C ATOM 908 OE1 GLU A 58 12.004 -9.747 -28.373 1.00 0.00 O ATOM 909 OE2 GLU A 58 10.152 -10.206 -27.284 1.00 0.00 O ATOM 0 H GLU A 58 13.050 -9.070 -23.165 1.00 0.00 H new ATOM 0 HA GLU A 58 11.887 -11.497 -23.774 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.124 -9.373 -25.183 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.741 -9.915 -25.588 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.997 -11.617 -26.944 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.538 -11.883 -26.009 1.00 0.00 H new ATOM 916 N ALA A 59 15.172 -11.593 -24.220 1.00 0.00 N ATOM 917 CA ALA A 59 16.316 -12.493 -24.293 1.00 0.00 C ATOM 918 C ALA A 59 16.488 -13.270 -22.993 1.00 0.00 C ATOM 919 O ALA A 59 16.823 -14.455 -23.004 1.00 0.00 O ATOM 920 CB ALA A 59 17.582 -11.713 -24.616 1.00 0.00 C ATOM 0 H ALA A 59 15.404 -10.606 -24.330 1.00 0.00 H new ATOM 0 HA ALA A 59 16.131 -13.211 -25.092 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.428 -12.398 -24.667 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.464 -11.209 -25.575 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.762 -10.972 -23.837 1.00 0.00 H new ATOM 926 N LYS A 60 16.256 -12.596 -21.871 1.00 0.00 N ATOM 927 CA LYS A 60 16.385 -13.222 -20.561 1.00 0.00 C ATOM 928 C LYS A 60 15.504 -14.464 -20.463 1.00 0.00 C ATOM 929 O LYS A 60 15.791 -15.380 -19.693 1.00 0.00 O ATOM 930 CB LYS A 60 16.010 -12.229 -19.459 1.00 0.00 C ATOM 931 CG LYS A 60 16.057 -12.823 -18.062 1.00 0.00 C ATOM 932 CD LYS A 60 17.458 -13.286 -17.701 1.00 0.00 C ATOM 933 CE LYS A 60 18.405 -12.110 -17.521 1.00 0.00 C ATOM 934 NZ LYS A 60 19.748 -12.545 -17.046 1.00 0.00 N ATOM 0 H LYS A 60 15.977 -11.615 -21.843 1.00 0.00 H new ATOM 0 HA LYS A 60 17.424 -13.524 -20.431 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.687 -11.376 -19.505 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.006 -11.850 -19.650 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.720 -12.081 -17.338 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.367 -13.665 -18.000 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.423 -13.871 -16.782 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.838 -13.944 -18.483 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.509 -11.580 -18.468 1.00 0.00 H new ATOM 0 HE3 LYS A 60 17.978 -11.406 -16.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 20.476 -11.917 -17.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 19.780 -12.501 -16.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.927 -13.521 -17.356 1.00 0.00 H new ATOM 948 N SER A 61 14.432 -14.486 -21.248 1.00 0.00 N ATOM 949 CA SER A 61 13.507 -15.614 -21.247 1.00 0.00 C ATOM 950 C SER A 61 14.017 -16.735 -22.149 1.00 0.00 C ATOM 951 O SER A 61 13.696 -17.906 -21.945 1.00 0.00 O ATOM 952 CB SER A 61 12.120 -15.165 -21.708 1.00 0.00 C ATOM 953 OG SER A 61 11.514 -16.145 -22.532 1.00 0.00 O ATOM 0 H SER A 61 14.182 -13.736 -21.893 1.00 0.00 H new ATOM 0 HA SER A 61 13.437 -15.994 -20.228 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.489 -14.975 -20.840 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.202 -14.226 -22.255 1.00 0.00 H new ATOM 0 HG SER A 61 10.801 -15.731 -23.062 1.00 0.00 H new ATOM 959 N LEU A 62 14.814 -16.367 -23.146 1.00 0.00 N ATOM 960 CA LEU A 62 15.369 -17.339 -24.080 1.00 0.00 C ATOM 961 C LEU A 62 16.593 -18.029 -23.485 1.00 0.00 C ATOM 962 O LEU A 62 16.838 -19.207 -23.741 1.00 0.00 O ATOM 963 CB LEU A 62 15.745 -16.655 -25.396 1.00 0.00 C ATOM 964 CG LEU A 62 14.716 -15.675 -25.960 1.00 0.00 C ATOM 965 CD1 LEU A 62 15.166 -15.150 -27.315 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.351 -16.338 -26.070 1.00 0.00 C ATOM 0 H LEU A 62 15.090 -15.402 -23.328 1.00 0.00 H new ATOM 0 HA LEU A 62 14.607 -18.094 -24.275 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.684 -16.121 -25.250 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.930 -17.426 -26.143 1.00 0.00 H new ATOM 0 HG LEU A 62 14.633 -14.831 -25.275 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.421 -14.454 -27.701 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.121 -14.636 -27.207 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.278 -15.983 -28.009 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.632 -15.625 -26.473 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.418 -17.201 -26.733 1.00 0.00 H new ATOM 0 HD23 LEU A 62 13.024 -16.664 -25.083 1.00 0.00 H new ATOM 978 N GLU A 63 17.355 -17.286 -22.689 1.00 0.00 N ATOM 979 CA GLU A 63 18.553 -17.828 -22.057 1.00 0.00 C ATOM 980 C GLU A 63 18.186 -18.763 -20.909 1.00 0.00 C ATOM 981 O GLU A 63 18.955 -19.655 -20.549 1.00 0.00 O ATOM 982 CB GLU A 63 19.441 -16.694 -21.541 1.00 0.00 C ATOM 983 CG GLU A 63 18.906 -16.024 -20.286 1.00 0.00 C ATOM 984 CD GLU A 63 19.628 -16.476 -19.031 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.885 -17.690 -18.899 1.00 0.00 O ATOM 986 OE2 GLU A 63 19.936 -15.613 -18.182 1.00 0.00 O ATOM 0 H GLU A 63 17.165 -16.309 -22.466 1.00 0.00 H new ATOM 0 HA GLU A 63 19.102 -18.398 -22.806 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.436 -17.088 -21.336 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.550 -15.944 -22.325 1.00 0.00 H new ATOM 0 HG2 GLU A 63 19.002 -14.943 -20.387 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.843 -16.242 -20.187 1.00 0.00 H new ATOM 993 N VAL A 64 17.004 -18.554 -20.337 1.00 0.00 N ATOM 994 CA VAL A 64 16.533 -19.378 -19.230 1.00 0.00 C ATOM 995 C VAL A 64 15.747 -20.581 -19.736 1.00 0.00 C ATOM 996 O VAL A 64 16.229 -21.713 -19.694 1.00 0.00 O ATOM 997 CB VAL A 64 15.647 -18.568 -18.264 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.121 -19.458 -17.149 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.419 -17.387 -17.696 1.00 0.00 C ATOM 0 H VAL A 64 16.355 -17.821 -20.622 1.00 0.00 H new ATOM 0 HA VAL A 64 17.417 -19.725 -18.695 1.00 0.00 H new ATOM 0 HB VAL A 64 14.793 -18.180 -18.820 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.497 -18.869 -16.477 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.529 -20.267 -17.578 1.00 0.00 H new ATOM 0 HG13 VAL A 64 15.959 -19.877 -16.592 1.00 0.00 H new ATOM 0 HG21 VAL A 64 15.778 -16.826 -17.016 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.293 -17.750 -17.155 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.741 -16.737 -18.510 1.00 0.00 H new ATOM 1009 N TRP A 65 14.534 -20.329 -20.215 1.00 0.00 N ATOM 1010 CA TRP A 65 13.679 -21.393 -20.730 1.00 0.00 C ATOM 1011 C TRP A 65 14.338 -22.095 -21.912 1.00 0.00 C ATOM 1012 O TRP A 65 14.056 -23.260 -22.190 1.00 0.00 O ATOM 1013 CB TRP A 65 12.322 -20.826 -21.150 1.00 0.00 C ATOM 1014 CG TRP A 65 11.378 -20.634 -20.001 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.177 -19.486 -19.290 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.510 -21.619 -19.431 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.235 -19.698 -18.312 1.00 0.00 N ATOM 1018 CE2 TRP A 65 9.810 -20.998 -18.378 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.254 -22.965 -19.709 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 8.874 -21.679 -17.604 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.325 -23.638 -18.940 1.00 0.00 C ATOM 1022 CH2 TRP A 65 8.643 -22.995 -17.898 1.00 0.00 C ATOM 0 H TRP A 65 14.120 -19.398 -20.258 1.00 0.00 H new ATOM 0 HA TRP A 65 13.529 -22.123 -19.935 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.475 -19.869 -21.650 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.865 -21.496 -21.878 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.684 -18.549 -19.470 1.00 0.00 H new ATOM 0 HE1 TRP A 65 9.906 -19.000 -17.645 1.00 0.00 H new ATOM 0 HE3 TRP A 65 10.773 -23.469 -20.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.349 -21.186 -16.800 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.120 -24.678 -19.145 1.00 0.00 H new ATOM 0 HH2 TRP A 65 7.921 -23.549 -17.316 1.00 0.00 H new ATOM 1033 N GLY A 66 15.218 -21.379 -22.606 1.00 0.00 N ATOM 1034 CA GLY A 66 15.903 -21.951 -23.750 1.00 0.00 C ATOM 1035 C GLY A 66 15.421 -21.370 -25.064 1.00 0.00 C ATOM 1036 O GLY A 66 16.215 -21.137 -25.976 1.00 0.00 O ATOM 0 H GLY A 66 15.468 -20.413 -22.396 1.00 0.00 H new ATOM 0 HA2 GLY A 66 16.975 -21.779 -23.651 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.753 -23.031 -23.757 1.00 0.00 H new ATOM 1040 N SER A 67 14.116 -21.137 -25.164 1.00 0.00 N ATOM 1041 CA SER A 67 13.529 -20.585 -26.379 1.00 0.00 C ATOM 1042 C SER A 67 12.208 -19.884 -26.073 1.00 0.00 C ATOM 1043 O SER A 67 11.578 -20.114 -25.041 1.00 0.00 O ATOM 1044 CB SER A 67 13.305 -21.692 -27.411 1.00 0.00 C ATOM 1045 OG SER A 67 13.374 -22.973 -26.808 1.00 0.00 O ATOM 0 H SER A 67 13.445 -21.322 -24.418 1.00 0.00 H new ATOM 0 HA SER A 67 14.224 -19.852 -26.789 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.332 -21.561 -27.884 1.00 0.00 H new ATOM 0 HB3 SER A 67 14.055 -21.616 -28.199 1.00 0.00 H new ATOM 0 HG SER A 67 13.226 -23.663 -27.488 1.00 0.00 H new ATOM 1051 N PRO A 68 11.778 -19.008 -26.993 1.00 0.00 N ATOM 1052 CA PRO A 68 10.529 -18.255 -26.846 1.00 0.00 C ATOM 1053 C PRO A 68 9.297 -19.145 -26.976 1.00 0.00 C ATOM 1054 O PRO A 68 8.201 -18.765 -26.567 1.00 0.00 O ATOM 1055 CB PRO A 68 10.584 -17.248 -27.997 1.00 0.00 C ATOM 1056 CG PRO A 68 11.463 -17.885 -29.017 1.00 0.00 C ATOM 1057 CD PRO A 68 12.478 -18.684 -28.248 1.00 0.00 C ATOM 0 HA PRO A 68 10.445 -17.794 -25.862 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.590 -17.051 -28.399 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.989 -16.292 -27.667 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.886 -18.526 -29.684 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.948 -17.133 -29.639 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.773 -19.584 -28.787 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.386 -18.110 -28.065 1.00 0.00 H new ATOM 1065 N GLU A 69 9.487 -20.330 -27.547 1.00 0.00 N ATOM 1066 CA GLU A 69 8.390 -21.273 -27.731 1.00 0.00 C ATOM 1067 C GLU A 69 8.008 -21.927 -26.406 1.00 0.00 C ATOM 1068 O GLU A 69 6.836 -22.210 -26.156 1.00 0.00 O ATOM 1069 CB GLU A 69 8.776 -22.347 -28.750 1.00 0.00 C ATOM 1070 CG GLU A 69 7.962 -22.290 -30.032 1.00 0.00 C ATOM 1071 CD GLU A 69 8.821 -22.043 -31.257 1.00 0.00 C ATOM 1072 OE1 GLU A 69 9.483 -22.997 -31.719 1.00 0.00 O ATOM 1073 OE2 GLU A 69 8.832 -20.898 -31.755 1.00 0.00 O ATOM 0 H GLU A 69 10.389 -20.660 -27.890 1.00 0.00 H new ATOM 0 HA GLU A 69 7.529 -20.720 -28.106 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.833 -22.240 -28.995 1.00 0.00 H new ATOM 0 HB3 GLU A 69 8.652 -23.329 -28.294 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.420 -23.227 -30.156 1.00 0.00 H new ATOM 0 HG3 GLU A 69 7.216 -21.499 -29.950 1.00 0.00 H new ATOM 1080 N ALA A 70 9.005 -22.166 -25.562 1.00 0.00 N ATOM 1081 CA ALA A 70 8.775 -22.786 -24.262 1.00 0.00 C ATOM 1082 C ALA A 70 7.909 -21.897 -23.376 1.00 0.00 C ATOM 1083 O ALA A 70 7.016 -22.380 -22.679 1.00 0.00 O ATOM 1084 CB ALA A 70 10.100 -23.085 -23.578 1.00 0.00 C ATOM 0 H ALA A 70 9.981 -21.940 -25.754 1.00 0.00 H new ATOM 0 HA ALA A 70 8.242 -23.723 -24.423 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.913 -23.547 -22.609 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.684 -23.765 -24.198 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.654 -22.157 -23.436 1.00 0.00 H new ATOM 1090 N LEU A 71 8.178 -20.596 -23.408 1.00 0.00 N ATOM 1091 CA LEU A 71 7.423 -19.639 -22.606 1.00 0.00 C ATOM 1092 C LEU A 71 6.033 -19.414 -23.193 1.00 0.00 C ATOM 1093 O LEU A 71 5.051 -19.298 -22.461 1.00 0.00 O ATOM 1094 CB LEU A 71 8.175 -18.310 -22.522 1.00 0.00 C ATOM 1095 CG LEU A 71 7.400 -17.137 -21.919 1.00 0.00 C ATOM 1096 CD1 LEU A 71 7.101 -17.393 -20.450 1.00 0.00 C ATOM 1097 CD2 LEU A 71 8.177 -15.840 -22.089 1.00 0.00 C ATOM 0 H LEU A 71 8.913 -20.180 -23.980 1.00 0.00 H new ATOM 0 HA LEU A 71 7.311 -20.050 -21.603 1.00 0.00 H new ATOM 0 HB2 LEU A 71 9.079 -18.464 -21.933 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.493 -18.031 -23.527 1.00 0.00 H new ATOM 0 HG LEU A 71 6.453 -17.042 -22.450 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.549 -16.548 -20.038 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.503 -18.299 -20.353 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.037 -17.516 -19.904 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.610 -15.017 -21.654 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.140 -15.924 -21.585 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.338 -15.649 -23.150 1.00 0.00 H new ATOM 1109 N ALA A 72 5.959 -19.355 -24.519 1.00 0.00 N ATOM 1110 CA ALA A 72 4.689 -19.149 -25.204 1.00 0.00 C ATOM 1111 C ALA A 72 3.668 -20.206 -24.799 1.00 0.00 C ATOM 1112 O ALA A 72 2.467 -19.940 -24.760 1.00 0.00 O ATOM 1113 CB ALA A 72 4.895 -19.162 -26.712 1.00 0.00 C ATOM 0 H ALA A 72 6.763 -19.447 -25.140 1.00 0.00 H new ATOM 0 HA ALA A 72 4.300 -18.175 -24.909 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.939 -19.007 -27.211 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.584 -18.365 -26.992 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.310 -20.123 -27.014 1.00 0.00 H new ATOM 1119 N ARG A 73 4.153 -21.406 -24.498 1.00 0.00 N ATOM 1120 CA ARG A 73 3.282 -22.505 -24.097 1.00 0.00 C ATOM 1121 C ARG A 73 2.409 -22.102 -22.913 1.00 0.00 C ATOM 1122 O ARG A 73 1.279 -22.568 -22.776 1.00 0.00 O ATOM 1123 CB ARG A 73 4.113 -23.737 -23.737 1.00 0.00 C ATOM 1124 CG ARG A 73 5.055 -24.182 -24.844 1.00 0.00 C ATOM 1125 CD ARG A 73 4.770 -25.612 -25.277 1.00 0.00 C ATOM 1126 NE ARG A 73 5.185 -25.859 -26.655 1.00 0.00 N ATOM 1127 CZ ARG A 73 4.822 -26.931 -27.351 1.00 0.00 C ATOM 1128 NH1 ARG A 73 4.039 -27.849 -26.800 1.00 0.00 N ATOM 1129 NH2 ARG A 73 5.241 -27.086 -28.600 1.00 0.00 N ATOM 0 H ARG A 73 5.145 -21.642 -24.524 1.00 0.00 H new ATOM 0 HA ARG A 73 2.633 -22.747 -24.939 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.695 -23.523 -22.841 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.441 -24.559 -23.492 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.954 -23.515 -25.700 1.00 0.00 H new ATOM 0 HG3 ARG A 73 6.086 -24.104 -24.499 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.290 -26.302 -24.613 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.704 -25.815 -25.177 1.00 0.00 H new ATOM 0 HE ARG A 73 5.786 -25.171 -27.108 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.714 -27.733 -25.840 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.762 -28.671 -27.336 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.843 -26.382 -29.027 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.962 -27.909 -29.133 1.00 0.00 H new ATOM 1143 N GLU A 74 2.943 -21.234 -22.059 1.00 0.00 N ATOM 1144 CA GLU A 74 2.213 -20.770 -20.885 1.00 0.00 C ATOM 1145 C GLU A 74 1.470 -19.471 -21.185 1.00 0.00 C ATOM 1146 O GLU A 74 0.369 -19.242 -20.683 1.00 0.00 O ATOM 1147 CB GLU A 74 3.171 -20.563 -19.710 1.00 0.00 C ATOM 1148 CG GLU A 74 3.771 -21.854 -19.180 1.00 0.00 C ATOM 1149 CD GLU A 74 2.852 -22.570 -18.209 1.00 0.00 C ATOM 1150 OE1 GLU A 74 1.891 -21.938 -17.725 1.00 0.00 O ATOM 1151 OE2 GLU A 74 3.095 -23.764 -17.934 1.00 0.00 O ATOM 0 H GLU A 74 3.878 -20.838 -22.158 1.00 0.00 H new ATOM 0 HA GLU A 74 1.482 -21.533 -20.618 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.977 -19.899 -20.022 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.639 -20.061 -18.902 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.996 -22.516 -20.016 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.717 -21.634 -18.684 1.00 0.00 H new ATOM 1158 N LYS A 75 2.081 -18.623 -22.006 1.00 0.00 N ATOM 1159 CA LYS A 75 1.479 -17.347 -22.374 1.00 0.00 C ATOM 1160 C LYS A 75 0.138 -17.558 -23.068 1.00 0.00 C ATOM 1161 O LYS A 75 -0.809 -16.801 -22.856 1.00 0.00 O ATOM 1162 CB LYS A 75 2.421 -16.561 -23.289 1.00 0.00 C ATOM 1163 CG LYS A 75 3.798 -16.332 -22.692 1.00 0.00 C ATOM 1164 CD LYS A 75 4.392 -15.010 -23.150 1.00 0.00 C ATOM 1165 CE LYS A 75 4.005 -13.872 -22.219 1.00 0.00 C ATOM 1166 NZ LYS A 75 3.046 -12.931 -22.861 1.00 0.00 N ATOM 0 H LYS A 75 2.993 -18.797 -22.429 1.00 0.00 H new ATOM 0 HA LYS A 75 1.309 -16.777 -21.461 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.528 -17.096 -24.233 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.969 -15.596 -23.519 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.730 -16.344 -21.604 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.460 -17.149 -22.979 1.00 0.00 H new ATOM 0 HD2 LYS A 75 5.478 -15.093 -23.192 1.00 0.00 H new ATOM 0 HD3 LYS A 75 4.050 -14.787 -24.161 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.560 -14.281 -21.312 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.901 -13.328 -21.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.807 -12.170 -22.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.479 -12.521 -23.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.181 -13.444 -23.125 1.00 0.00 H new ATOM 1180 N LYS A 76 0.062 -18.593 -23.898 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.164 -18.907 -24.622 1.00 0.00 C ATOM 1182 C LYS A 76 -2.331 -19.099 -23.658 1.00 0.00 C ATOM 1183 O LYS A 76 -3.395 -18.503 -23.829 1.00 0.00 O ATOM 1184 CB LYS A 76 -0.974 -20.169 -25.466 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.255 -20.667 -26.113 1.00 0.00 C ATOM 1186 CD LYS A 76 -1.975 -21.747 -27.145 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.516 -23.040 -26.489 1.00 0.00 C ATOM 1188 NZ LYS A 76 -1.363 -24.141 -27.480 1.00 0.00 N ATOM 0 H LYS A 76 0.837 -19.230 -24.086 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.392 -18.068 -25.280 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.238 -19.968 -26.245 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.564 -20.959 -24.836 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.922 -21.060 -25.346 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.772 -19.833 -26.588 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -2.875 -21.934 -27.730 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.210 -21.399 -27.839 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.565 -22.873 -25.982 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.236 -23.336 -25.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.049 -25.005 -26.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.276 -24.318 -27.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.657 -23.870 -28.194 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.124 -19.932 -22.645 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.159 -20.201 -21.652 1.00 0.00 C ATOM 1204 C LEU A 77 -3.644 -18.907 -21.007 1.00 0.00 C ATOM 1205 O LEU A 77 -4.820 -18.555 -21.106 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.628 -21.152 -20.578 1.00 0.00 C ATOM 1207 CG LEU A 77 -2.723 -22.644 -20.896 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -4.177 -23.075 -21.008 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -1.969 -22.965 -22.179 1.00 0.00 C ATOM 0 H LEU A 77 -1.249 -20.433 -22.489 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.002 -20.670 -22.160 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.583 -20.907 -20.389 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.172 -20.963 -19.653 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.263 -23.200 -20.079 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.224 -24.140 -21.235 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.687 -22.882 -20.064 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.663 -22.512 -21.805 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.047 -24.032 -22.390 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.399 -22.399 -23.005 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.920 -22.694 -22.062 1.00 0.00 H new ATOM 1221 N ARG A 78 -2.730 -18.201 -20.348 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.065 -16.945 -19.688 1.00 0.00 C ATOM 1223 C ARG A 78 -3.755 -15.989 -20.656 1.00 0.00 C ATOM 1224 O ARG A 78 -4.649 -15.235 -20.271 1.00 0.00 O ATOM 1225 CB ARG A 78 -1.804 -16.291 -19.120 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.275 -16.974 -17.869 1.00 0.00 C ATOM 1227 CD ARG A 78 0.215 -16.731 -17.690 1.00 0.00 C ATOM 1228 NE ARG A 78 0.638 -16.916 -16.304 1.00 0.00 N ATOM 1229 CZ ARG A 78 0.391 -16.039 -15.338 1.00 0.00 C ATOM 1230 NH1 ARG A 78 -0.272 -14.922 -15.604 1.00 0.00 N ATOM 1231 NH2 ARG A 78 0.808 -16.278 -14.101 1.00 0.00 N ATOM 0 H ARG A 78 -1.752 -18.478 -20.257 1.00 0.00 H new ATOM 0 HA ARG A 78 -3.752 -17.165 -18.871 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.026 -16.297 -19.884 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.018 -15.247 -18.891 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -1.813 -16.604 -16.996 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.465 -18.046 -17.930 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.773 -17.412 -18.333 1.00 0.00 H new ATOM 0 HD3 ARG A 78 0.458 -15.718 -18.011 1.00 0.00 H new ATOM 0 HE ARG A 78 1.151 -17.765 -16.065 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.594 -14.734 -16.553 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -0.460 -14.251 -14.859 1.00 0.00 H new ATOM 0 HH21 ARG A 78 1.319 -17.136 -13.892 1.00 0.00 H new ATOM 0 HH22 ARG A 78 0.618 -15.604 -13.360 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.333 -16.025 -21.916 1.00 0.00 N ATOM 1246 CA LYS A 79 -3.909 -15.163 -22.941 1.00 0.00 C ATOM 1247 C LYS A 79 -5.373 -15.514 -23.187 1.00 0.00 C ATOM 1248 O LYS A 79 -6.258 -14.675 -23.022 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.118 -15.286 -24.245 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.620 -14.374 -25.350 1.00 0.00 C ATOM 1251 CD LYS A 79 -2.866 -14.604 -26.649 1.00 0.00 C ATOM 1252 CE LYS A 79 -3.794 -14.537 -27.852 1.00 0.00 C ATOM 1253 NZ LYS A 79 -3.152 -13.857 -29.011 1.00 0.00 N ATOM 0 H LYS A 79 -2.594 -16.642 -22.251 1.00 0.00 H new ATOM 0 HA LYS A 79 -3.855 -14.134 -22.587 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.070 -15.060 -24.047 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.162 -16.319 -24.590 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.684 -14.547 -25.510 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.509 -13.334 -25.043 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.080 -13.856 -26.752 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.377 -15.578 -26.619 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -4.088 -15.546 -28.140 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.705 -14.005 -27.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.817 -13.832 -29.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -2.894 -12.885 -28.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -2.296 -14.378 -29.289 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.620 -16.759 -23.582 1.00 0.00 N ATOM 1268 CA GLU A 80 -6.978 -17.220 -23.849 1.00 0.00 C ATOM 1269 C GLU A 80 -7.863 -17.049 -22.618 1.00 0.00 C ATOM 1270 O GLU A 80 -9.074 -16.863 -22.733 1.00 0.00 O ATOM 1271 CB GLU A 80 -6.966 -18.687 -24.283 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.100 -18.954 -25.503 1.00 0.00 C ATOM 1273 CD GLU A 80 -6.918 -19.182 -26.760 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -8.064 -18.692 -26.820 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -6.410 -19.852 -27.684 1.00 0.00 O ATOM 0 H GLU A 80 -4.899 -17.466 -23.724 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.388 -16.613 -24.656 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.610 -19.299 -23.454 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.987 -19.002 -24.497 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.428 -18.110 -25.659 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.476 -19.828 -25.317 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.249 -17.116 -21.441 1.00 0.00 N ATOM 1283 CA ALA A 81 -7.980 -16.967 -20.189 1.00 0.00 C ATOM 1284 C ALA A 81 -8.793 -15.678 -20.178 1.00 0.00 C ATOM 1285 O ALA A 81 -9.987 -15.689 -19.877 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.018 -16.997 -19.010 1.00 0.00 C ATOM 0 H ALA A 81 -6.247 -17.272 -21.329 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.673 -17.803 -20.100 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.577 -16.885 -18.081 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -6.485 -17.947 -19.000 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.302 -16.180 -19.104 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.140 -14.568 -20.507 1.00 0.00 N ATOM 1293 CA GLU A 82 -8.804 -13.270 -20.532 1.00 0.00 C ATOM 1294 C GLU A 82 -9.891 -13.236 -21.603 1.00 0.00 C ATOM 1295 O GLU A 82 -10.931 -12.601 -21.426 1.00 0.00 O ATOM 1296 CB GLU A 82 -7.786 -12.156 -20.787 1.00 0.00 C ATOM 1297 CG GLU A 82 -7.219 -11.547 -19.516 1.00 0.00 C ATOM 1298 CD GLU A 82 -7.454 -10.051 -19.431 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -6.893 -9.313 -20.267 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -8.201 -9.620 -18.527 1.00 0.00 O ATOM 0 H GLU A 82 -7.152 -14.542 -20.760 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.270 -13.110 -19.560 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -6.967 -12.554 -21.386 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.259 -11.371 -21.376 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.672 -12.032 -18.651 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.148 -11.746 -19.468 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.642 -13.923 -22.712 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.598 -13.972 -23.811 1.00 0.00 C ATOM 1309 C ILE A 83 -11.872 -14.702 -23.399 1.00 0.00 C ATOM 1310 O ILE A 83 -12.979 -14.226 -23.647 1.00 0.00 O ATOM 1311 CB ILE A 83 -9.999 -14.667 -25.048 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.663 -14.024 -25.424 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -10.972 -14.601 -26.216 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -7.990 -14.678 -26.611 1.00 0.00 C ATOM 0 H ILE A 83 -8.786 -14.454 -22.874 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.839 -12.940 -24.066 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.821 -15.715 -24.807 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.826 -12.969 -25.645 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.993 -14.070 -24.566 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -10.534 -15.096 -27.083 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.902 -15.101 -25.944 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.178 -13.559 -26.460 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.048 -14.170 -26.821 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.795 -15.727 -26.386 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.641 -14.609 -27.482 1.00 0.00 H new ATOM 1326 N GLU A 84 -11.706 -15.859 -22.766 1.00 0.00 N ATOM 1327 CA GLU A 84 -12.844 -16.654 -22.318 1.00 0.00 C ATOM 1328 C GLU A 84 -13.634 -15.915 -21.243 1.00 0.00 C ATOM 1329 O GLU A 84 -14.841 -16.112 -21.098 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.369 -18.006 -21.780 1.00 0.00 C ATOM 1331 CG GLU A 84 -11.579 -18.820 -22.790 1.00 0.00 C ATOM 1332 CD GLU A 84 -12.451 -19.776 -23.580 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -13.690 -19.617 -23.542 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -11.897 -20.683 -24.235 1.00 0.00 O ATOM 0 H GLU A 84 -10.796 -16.267 -22.552 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.498 -16.821 -23.174 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.751 -17.839 -20.898 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.235 -18.584 -21.458 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.072 -18.144 -23.478 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.806 -19.385 -22.270 1.00 0.00 H new ATOM 1341 N TYR A 85 -12.945 -15.064 -20.491 1.00 0.00 N ATOM 1342 CA TYR A 85 -13.581 -14.297 -19.426 1.00 0.00 C ATOM 1343 C TYR A 85 -14.368 -13.121 -19.997 1.00 0.00 C ATOM 1344 O TYR A 85 -15.575 -13.006 -19.786 1.00 0.00 O ATOM 1345 CB TYR A 85 -12.531 -13.790 -18.436 1.00 0.00 C ATOM 1346 CG TYR A 85 -13.099 -12.902 -17.353 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -13.704 -13.447 -16.226 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -13.030 -11.518 -17.455 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -14.224 -12.639 -15.234 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -13.547 -10.702 -16.467 1.00 0.00 C ATOM 1351 CZ TYR A 85 -14.143 -11.267 -15.359 1.00 0.00 C ATOM 1352 OH TYR A 85 -14.660 -10.459 -14.372 1.00 0.00 O ATOM 0 H TYR A 85 -11.946 -14.888 -20.599 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.275 -14.956 -18.903 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.039 -14.645 -17.972 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.765 -13.239 -18.982 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -13.768 -14.520 -16.125 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.564 -11.072 -18.322 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -14.691 -13.078 -14.365 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.485 -9.628 -16.562 1.00 0.00 H new ATOM 0 HH TYR A 85 -14.521 -9.519 -14.612 1.00 0.00 H new ATOM 1362 N ARG A 86 -13.673 -12.250 -20.722 1.00 0.00 N ATOM 1363 CA ARG A 86 -14.305 -11.082 -21.324 1.00 0.00 C ATOM 1364 C ARG A 86 -15.392 -11.499 -22.310 1.00 0.00 C ATOM 1365 O ARG A 86 -16.356 -10.767 -22.531 1.00 0.00 O ATOM 1366 CB ARG A 86 -13.260 -10.220 -22.035 1.00 0.00 C ATOM 1367 CG ARG A 86 -12.629 -10.898 -23.240 1.00 0.00 C ATOM 1368 CD ARG A 86 -13.181 -10.342 -24.544 1.00 0.00 C ATOM 1369 NE ARG A 86 -12.169 -10.309 -25.596 1.00 0.00 N ATOM 1370 CZ ARG A 86 -12.392 -9.829 -26.815 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -13.584 -9.344 -27.132 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -11.420 -9.833 -27.719 1.00 0.00 N ATOM 0 H ARG A 86 -12.673 -12.331 -20.907 1.00 0.00 H new ATOM 0 HA ARG A 86 -14.766 -10.499 -20.527 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -13.727 -9.289 -22.356 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -12.476 -9.956 -21.326 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.548 -10.759 -23.213 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.814 -11.971 -23.193 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -14.024 -10.952 -24.870 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.563 -9.335 -24.376 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.241 -10.674 -25.384 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -14.333 -9.339 -26.440 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -13.752 -8.976 -28.068 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.501 -10.205 -27.478 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -11.592 -9.464 -28.654 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.228 -12.679 -22.899 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.195 -13.192 -23.863 1.00 0.00 C ATOM 1388 C GLU A 87 -17.599 -13.214 -23.265 1.00 0.00 C ATOM 1389 O GLU A 87 -18.497 -12.518 -23.739 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.800 -14.599 -24.316 1.00 0.00 C ATOM 1391 CG GLU A 87 -15.073 -14.627 -25.650 1.00 0.00 C ATOM 1392 CD GLU A 87 -16.023 -14.644 -26.832 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -16.966 -13.825 -26.845 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -15.824 -15.474 -27.742 1.00 0.00 O ATOM 0 H GLU A 87 -14.436 -13.297 -22.726 1.00 0.00 H new ATOM 0 HA GLU A 87 -16.196 -12.527 -24.727 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.164 -15.051 -23.555 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.697 -15.214 -24.388 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.423 -13.755 -25.724 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.432 -15.507 -25.692 1.00 0.00 H new ATOM 1401 N ARG A 88 -17.780 -14.018 -22.223 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.074 -14.132 -21.562 1.00 0.00 C ATOM 1403 C ARG A 88 -19.526 -12.782 -21.013 1.00 0.00 C ATOM 1404 O ARG A 88 -20.723 -12.516 -20.895 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.003 -15.157 -20.428 1.00 0.00 C ATOM 1406 CG ARG A 88 -17.858 -14.914 -19.459 1.00 0.00 C ATOM 1407 CD ARG A 88 -18.161 -15.489 -18.084 1.00 0.00 C ATOM 1408 NE ARG A 88 -17.774 -14.576 -17.011 1.00 0.00 N ATOM 1409 CZ ARG A 88 -17.730 -14.924 -15.730 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -18.047 -16.158 -15.364 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -17.367 -14.037 -14.813 1.00 0.00 N ATOM 0 H ARG A 88 -17.047 -14.600 -21.818 1.00 0.00 H new ATOM 0 HA ARG A 88 -19.802 -14.467 -22.301 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -19.943 -15.143 -19.877 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -18.900 -16.154 -20.857 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -16.946 -15.365 -19.851 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -17.673 -13.843 -19.374 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -19.227 -15.706 -18.009 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -17.634 -16.435 -17.963 1.00 0.00 H new ATOM 0 HE ARG A 88 -17.524 -13.619 -17.259 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -18.325 -16.843 -16.067 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -18.012 -16.423 -14.380 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -17.121 -13.087 -15.091 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -17.333 -14.305 -13.829 1.00 0.00 H new ATOM 1425 N LEU A 89 -18.560 -11.933 -20.678 1.00 0.00 N ATOM 1426 CA LEU A 89 -18.858 -10.609 -20.141 1.00 0.00 C ATOM 1427 C LEU A 89 -19.684 -9.794 -21.130 1.00 0.00 C ATOM 1428 O LEU A 89 -20.708 -9.213 -20.769 1.00 0.00 O ATOM 1429 CB LEU A 89 -17.561 -9.869 -19.810 1.00 0.00 C ATOM 1430 CG LEU A 89 -17.266 -9.664 -18.324 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -17.066 -11.002 -17.630 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -16.043 -8.777 -18.140 1.00 0.00 C ATOM 0 H LEU A 89 -17.565 -12.137 -20.769 1.00 0.00 H new ATOM 0 HA LEU A 89 -19.440 -10.736 -19.228 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -16.730 -10.418 -20.253 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.590 -8.892 -20.292 1.00 0.00 H new ATOM 0 HG LEU A 89 -18.122 -9.166 -17.869 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.857 -10.836 -16.573 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -17.970 -11.603 -17.731 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -16.228 -11.527 -18.087 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.848 -8.642 -17.076 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.179 -9.246 -18.610 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -16.225 -7.806 -18.601 1.00 0.00 H new ATOM 1444 N PHE A 90 -19.234 -9.756 -22.380 1.00 0.00 N ATOM 1445 CA PHE A 90 -19.933 -9.013 -23.422 1.00 0.00 C ATOM 1446 C PHE A 90 -21.318 -9.601 -23.675 1.00 0.00 C ATOM 1447 O PHE A 90 -22.297 -8.869 -23.820 1.00 0.00 O ATOM 1448 CB PHE A 90 -19.119 -9.022 -24.718 1.00 0.00 C ATOM 1449 CG PHE A 90 -18.318 -7.769 -24.932 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -18.880 -6.672 -25.564 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -17.004 -7.689 -24.501 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -18.146 -5.517 -25.762 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -16.265 -6.537 -24.696 1.00 0.00 C ATOM 1454 CZ PHE A 90 -16.837 -5.450 -25.328 1.00 0.00 C ATOM 0 H PHE A 90 -18.388 -10.231 -22.696 1.00 0.00 H new ATOM 0 HA PHE A 90 -20.051 -7.984 -23.082 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -18.444 -9.878 -24.708 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -19.795 -9.160 -25.562 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -19.903 -6.719 -25.906 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -16.552 -8.536 -24.007 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -18.596 -4.668 -26.256 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -15.242 -6.487 -24.355 1.00 0.00 H new ATOM 0 HZ PHE A 90 -16.261 -4.549 -25.482 1.00 0.00 H new ATOM 1464 N ARG A 91 -21.391 -10.927 -23.725 1.00 0.00 N ATOM 1465 CA ARG A 91 -22.654 -11.614 -23.962 1.00 0.00 C ATOM 1466 C ARG A 91 -23.709 -11.176 -22.950 1.00 0.00 C ATOM 1467 O ARG A 91 -24.898 -11.120 -23.263 1.00 0.00 O ATOM 1468 CB ARG A 91 -22.458 -13.129 -23.885 1.00 0.00 C ATOM 1469 CG ARG A 91 -23.560 -13.922 -24.569 1.00 0.00 C ATOM 1470 CD ARG A 91 -24.000 -15.107 -23.724 1.00 0.00 C ATOM 1471 NE ARG A 91 -24.552 -16.185 -24.539 1.00 0.00 N ATOM 1472 CZ ARG A 91 -25.345 -17.138 -24.059 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -25.676 -17.144 -22.775 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -25.807 -18.086 -24.864 1.00 0.00 N ATOM 0 H ARG A 91 -20.590 -11.547 -23.604 1.00 0.00 H new ATOM 0 HA ARG A 91 -23.000 -11.349 -24.961 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -21.501 -13.386 -24.339 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -22.404 -13.427 -22.838 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -24.414 -13.272 -24.758 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -23.208 -14.276 -25.538 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -23.149 -15.482 -23.155 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -24.748 -14.779 -23.002 1.00 0.00 H new ATOM 0 HE ARG A 91 -24.316 -16.208 -25.531 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -25.322 -16.417 -22.154 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -26.285 -17.876 -22.409 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -25.554 -18.084 -25.852 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -26.415 -18.817 -24.495 1.00 0.00 H new ATOM 1488 N ASN A 92 -23.265 -10.866 -21.736 1.00 0.00 N ATOM 1489 CA ASN A 92 -24.171 -10.434 -20.678 1.00 0.00 C ATOM 1490 C ASN A 92 -24.762 -9.064 -20.994 1.00 0.00 C ATOM 1491 O ASN A 92 -25.871 -8.743 -20.568 1.00 0.00 O ATOM 1492 CB ASN A 92 -23.436 -10.388 -19.337 1.00 0.00 C ATOM 1493 CG ASN A 92 -24.381 -10.493 -18.156 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -25.134 -11.460 -18.033 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -24.347 -9.496 -17.279 1.00 0.00 N ATOM 0 H ASN A 92 -22.284 -10.906 -21.461 1.00 0.00 H new ATOM 0 HA ASN A 92 -24.986 -11.155 -20.614 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -22.713 -11.203 -19.294 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -22.872 -9.458 -19.266 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -24.961 -9.512 -16.464 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -23.707 -8.714 -17.420 1.00 0.00 H new ATOM 1502 N GLN A 93 -24.014 -8.262 -21.745 1.00 0.00 N ATOM 1503 CA GLN A 93 -24.465 -6.926 -22.118 1.00 0.00 C ATOM 1504 C GLN A 93 -25.242 -6.961 -23.430 1.00 0.00 C ATOM 1505 O GLN A 93 -26.410 -6.573 -23.483 1.00 0.00 O ATOM 1506 CB GLN A 93 -23.271 -5.978 -22.244 1.00 0.00 C ATOM 1507 CG GLN A 93 -22.705 -5.532 -20.905 1.00 0.00 C ATOM 1508 CD GLN A 93 -21.206 -5.305 -20.952 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -20.468 -5.776 -20.087 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -20.749 -4.580 -21.967 1.00 0.00 N ATOM 0 H GLN A 93 -23.094 -8.514 -22.107 1.00 0.00 H new ATOM 0 HA GLN A 93 -25.128 -6.561 -21.333 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -22.485 -6.471 -22.815 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -23.574 -5.099 -22.812 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -23.199 -4.611 -20.595 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -22.931 -6.285 -20.150 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -21.397 -4.209 -22.662 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -19.750 -4.394 -22.052 1.00 0.00 H new ATOM 1519 N LYS A 94 -24.587 -7.427 -24.488 1.00 0.00 N ATOM 1520 CA LYS A 94 -25.216 -7.514 -25.800 1.00 0.00 C ATOM 1521 C LYS A 94 -26.159 -8.710 -25.874 1.00 0.00 C ATOM 1522 O LYS A 94 -25.716 -9.858 -25.931 1.00 0.00 O ATOM 1523 CB LYS A 94 -24.150 -7.622 -26.893 1.00 0.00 C ATOM 1524 CG LYS A 94 -23.171 -6.461 -26.905 1.00 0.00 C ATOM 1525 CD LYS A 94 -22.667 -6.171 -28.309 1.00 0.00 C ATOM 1526 CE LYS A 94 -23.506 -5.103 -28.992 1.00 0.00 C ATOM 1527 NZ LYS A 94 -22.662 -4.023 -29.575 1.00 0.00 N ATOM 0 H LYS A 94 -23.620 -7.750 -24.462 1.00 0.00 H new ATOM 0 HA LYS A 94 -25.798 -6.606 -25.957 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -23.597 -8.551 -26.758 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -24.642 -7.682 -27.864 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -23.655 -5.572 -26.500 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -22.327 -6.689 -26.254 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -21.628 -5.845 -28.264 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -22.689 -7.086 -28.901 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -24.105 -5.560 -29.779 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -24.201 -4.672 -28.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -23.271 -3.314 -30.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -22.109 -3.569 -28.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -22.016 -4.430 -30.281 1.00 0.00 H new ATOM 1541 N ILE A 95 -27.459 -8.435 -25.875 1.00 0.00 N ATOM 1542 CA ILE A 95 -28.462 -9.490 -25.944 1.00 0.00 C ATOM 1543 C ILE A 95 -28.261 -10.360 -27.180 1.00 0.00 C ATOM 1544 O ILE A 95 -28.600 -11.544 -27.182 1.00 0.00 O ATOM 1545 CB ILE A 95 -29.889 -8.909 -25.967 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -30.923 -10.035 -25.915 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -30.092 -8.052 -27.207 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -32.329 -9.552 -25.640 1.00 0.00 C ATOM 0 H ILE A 95 -27.842 -7.491 -25.829 1.00 0.00 H new ATOM 0 HA ILE A 95 -28.340 -10.100 -25.049 1.00 0.00 H new ATOM 0 HB ILE A 95 -30.023 -8.278 -25.088 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -30.911 -10.572 -26.863 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -30.634 -10.747 -25.142 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -31.105 -7.649 -27.209 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -29.375 -7.231 -27.204 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -29.942 -8.661 -28.099 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -33.008 -10.404 -25.617 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -32.356 -9.040 -24.678 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -32.637 -8.863 -26.426 1.00 0.00 H new ATOM 1560 N LEU A 96 -27.705 -9.766 -28.231 1.00 0.00 N ATOM 1561 CA LEU A 96 -27.456 -10.487 -29.474 1.00 0.00 C ATOM 1562 C LEU A 96 -28.745 -11.092 -30.021 1.00 0.00 C ATOM 1563 O LEU A 96 -29.826 -10.869 -29.477 1.00 0.00 O ATOM 1564 CB LEU A 96 -26.417 -11.587 -29.249 1.00 0.00 C ATOM 1565 CG LEU A 96 -25.182 -11.539 -30.149 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -24.402 -10.255 -29.918 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -24.298 -12.754 -29.907 1.00 0.00 C ATOM 0 H LEU A 96 -27.418 -8.787 -28.247 1.00 0.00 H new ATOM 0 HA LEU A 96 -27.071 -9.777 -30.206 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -26.087 -11.541 -28.211 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -26.904 -12.552 -29.386 1.00 0.00 H new ATOM 0 HG LEU A 96 -25.512 -11.556 -31.188 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -23.527 -10.239 -30.567 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -25.037 -9.398 -30.144 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -24.082 -10.206 -28.877 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -23.424 -12.703 -30.556 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -23.976 -12.768 -28.866 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -24.860 -13.662 -30.126 1.00 0.00 H new ATOM 1579 N ARG A 97 -28.621 -11.861 -31.098 1.00 0.00 N ATOM 1580 CA ARG A 97 -29.776 -12.500 -31.717 1.00 0.00 C ATOM 1581 C ARG A 97 -29.565 -14.006 -31.837 1.00 0.00 C ATOM 1582 O ARG A 97 -28.695 -14.463 -32.577 1.00 0.00 O ATOM 1583 CB ARG A 97 -30.037 -11.899 -33.099 1.00 0.00 C ATOM 1584 CG ARG A 97 -31.497 -11.953 -33.521 1.00 0.00 C ATOM 1585 CD ARG A 97 -31.641 -11.925 -35.034 1.00 0.00 C ATOM 1586 NE ARG A 97 -31.877 -10.575 -35.537 1.00 0.00 N ATOM 1587 CZ ARG A 97 -33.050 -9.955 -35.456 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -34.086 -10.562 -34.895 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -33.186 -8.726 -35.936 1.00 0.00 N ATOM 0 H ARG A 97 -27.733 -12.056 -31.560 1.00 0.00 H new ATOM 0 HA ARG A 97 -30.643 -12.322 -31.081 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -29.705 -10.861 -33.103 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -29.435 -12.430 -33.836 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -31.957 -12.859 -33.127 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -32.034 -11.109 -33.088 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -30.738 -12.329 -35.491 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -32.466 -12.572 -35.331 1.00 0.00 H new ATOM 0 HE ARG A 97 -31.099 -10.081 -35.974 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -33.984 -11.507 -34.524 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -34.985 -10.084 -34.834 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -32.390 -8.256 -36.368 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -34.086 -8.251 -35.874 1.00 0.00 H new ATOM 1603 N GLU A 98 -30.367 -14.771 -31.102 1.00 0.00 N ATOM 1604 CA GLU A 98 -30.266 -16.226 -31.126 1.00 0.00 C ATOM 1605 C GLU A 98 -31.418 -16.838 -31.917 1.00 0.00 C ATOM 1606 O GLU A 98 -32.125 -17.719 -31.424 1.00 0.00 O ATOM 1607 CB GLU A 98 -30.258 -16.782 -29.701 1.00 0.00 C ATOM 1608 CG GLU A 98 -29.736 -18.206 -29.605 1.00 0.00 C ATOM 1609 CD GLU A 98 -29.101 -18.506 -28.261 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -29.171 -17.639 -27.365 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -28.536 -19.608 -28.106 1.00 0.00 O ATOM 0 H GLU A 98 -31.093 -14.408 -30.484 1.00 0.00 H new ATOM 0 HA GLU A 98 -29.330 -16.492 -31.617 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -29.645 -16.136 -29.072 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -31.271 -16.748 -29.301 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -30.557 -18.902 -29.778 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -29.003 -18.374 -30.394 1.00 0.00 H new ATOM 1618 N TYR A 99 -31.602 -16.366 -33.144 1.00 0.00 N ATOM 1619 CA TYR A 99 -32.670 -16.864 -34.003 1.00 0.00 C ATOM 1620 C TYR A 99 -32.115 -17.344 -35.341 1.00 0.00 C ATOM 1621 O TYR A 99 -31.005 -16.982 -35.730 1.00 0.00 O ATOM 1622 CB TYR A 99 -33.718 -15.774 -34.234 1.00 0.00 C ATOM 1623 CG TYR A 99 -34.684 -15.608 -33.083 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -34.297 -14.968 -31.912 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -35.983 -16.092 -33.166 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -35.176 -14.815 -30.858 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -36.870 -15.943 -32.117 1.00 0.00 C ATOM 1628 CZ TYR A 99 -36.461 -15.303 -30.965 1.00 0.00 C ATOM 1629 OH TYR A 99 -37.341 -15.153 -29.917 1.00 0.00 O ATOM 0 H TYR A 99 -31.025 -15.639 -33.567 1.00 0.00 H new ATOM 0 HA TYR A 99 -33.140 -17.710 -33.501 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -33.211 -14.826 -34.411 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -34.280 -16.008 -35.138 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -33.292 -14.584 -31.825 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -36.306 -16.594 -34.066 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -34.858 -14.316 -29.955 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -37.877 -16.325 -32.198 1.00 0.00 H new ATOM 0 HH TYR A 99 -38.204 -15.551 -30.155 1.00 0.00 H new ATOM 1639 N ARG A 100 -32.897 -18.161 -36.039 1.00 0.00 N ATOM 1640 CA ARG A 100 -32.484 -18.691 -37.333 1.00 0.00 C ATOM 1641 C ARG A 100 -33.376 -18.156 -38.449 1.00 0.00 C ATOM 1642 O ARG A 100 -34.585 -18.002 -38.272 1.00 0.00 O ATOM 1643 CB ARG A 100 -32.529 -20.221 -37.319 1.00 0.00 C ATOM 1644 CG ARG A 100 -33.902 -20.787 -36.995 1.00 0.00 C ATOM 1645 CD ARG A 100 -34.599 -21.306 -38.243 1.00 0.00 C ATOM 1646 NE ARG A 100 -36.042 -21.089 -38.195 1.00 0.00 N ATOM 1647 CZ ARG A 100 -36.883 -21.878 -37.535 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -36.426 -22.930 -36.870 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -38.183 -21.614 -37.538 1.00 0.00 N ATOM 0 H ARG A 100 -33.819 -18.470 -35.731 1.00 0.00 H new ATOM 0 HA ARG A 100 -31.461 -18.366 -37.521 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -32.212 -20.594 -38.293 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -31.811 -20.590 -36.587 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -33.802 -21.595 -36.270 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -34.514 -20.015 -36.529 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -34.187 -20.809 -39.121 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -34.396 -22.371 -38.355 1.00 0.00 H new ATOM 0 HE ARG A 100 -36.426 -20.287 -38.696 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -35.427 -23.135 -36.864 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -37.074 -23.534 -36.364 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -38.538 -20.805 -38.047 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -38.828 -22.220 -37.031 1.00 0.00 H new ATOM 1663 N ASP A 101 -32.772 -17.875 -39.598 1.00 0.00 N ATOM 1664 CA ASP A 101 -33.512 -17.357 -40.744 1.00 0.00 C ATOM 1665 C ASP A 101 -34.296 -16.105 -40.364 1.00 0.00 C ATOM 1666 O ASP A 101 -34.019 -15.012 -40.859 1.00 0.00 O ATOM 1667 CB ASP A 101 -34.462 -18.424 -41.289 1.00 0.00 C ATOM 1668 CG ASP A 101 -34.798 -18.208 -42.752 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -33.926 -18.470 -43.606 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -35.933 -17.777 -43.042 1.00 0.00 O ATOM 0 H ASP A 101 -31.773 -17.997 -39.761 1.00 0.00 H new ATOM 0 HA ASP A 101 -32.794 -17.092 -41.520 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -34.009 -19.407 -41.165 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -35.382 -18.421 -40.704 1.00 0.00 H new TER 1675 ASP A 101