USER MOD reduce.3.24.130724 H: found=0, std=0, add=990, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 987 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 ASN : amide:sc= -0.234 X(o=-2.2,f=-2.3) USER MOD Set 1.2: A 100 HIS : no HD1:sc= -1.94 K(o=-2.2,f=-4.1) USER MOD Single : A 1 GLY N :NH3+ -172:sc= 0 (180deg=-0.0582) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 171:sc= 0 (180deg=-0.0959) USER MOD Single : A 4 LYS NZ :NH3+ -166:sc=-0.00343 (180deg=-0.146) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -152:sc= -0.277 (180deg=-1.24) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 177:sc=0.000254 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -117:sc= 0.00665 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.681 K(o=-0.68,f=-5.1!) USER MOD Single : A 35 CYS SG : rot 180:sc= -0.266 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 142:sc= -0.0634 (180deg=-0.6) USER MOD Single : A 41 SER OG : rot -53:sc= 0.173 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 TYR OH : rot 180:sc= -0.0611 USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.203 USER MOD Single : A 61 GLN : amide:sc= -1.5 X(o=-1.5,f=-1.9) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 66:sc= 0.577 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.132 USER MOD Single : A 93 MET CE :methyl -172:sc=-0.00347 (180deg=-0.0795) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 121:sc= 0.724 USER MOD Single : A 98 GLN : amide:sc= -0.776 K(o=-0.78,f=-2.4!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.798 USER MOD Single : A 111 TYR OH : rot -6:sc= 0.0896 USER MOD Single : A 112 SER OG : rot 180:sc= -0.0129 USER MOD Single : A 115 ASN : amide:sc= -4.73! C(o=-4.7!,f=-8.6!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.993 0.842 6.892 1.00 4.31 N ATOM 2 CA GLY A 1 -2.094 1.977 6.778 1.00 34.32 C ATOM 3 C GLY A 1 -2.637 3.057 5.865 1.00 12.02 C ATOM 4 O GLY A 1 -2.497 4.247 6.149 1.00 42.50 O ATOM 0 H1 GLY A 1 -2.644 0.195 7.628 1.00 4.31 H new ATOM 0 H2 GLY A 1 -3.944 1.177 7.148 1.00 4.31 H new ATOM 0 H3 GLY A 1 -3.036 0.340 5.982 1.00 4.31 H new ATOM 0 HA2 GLY A 1 -1.917 2.397 7.768 1.00 34.32 H new ATOM 0 HA3 GLY A 1 -1.130 1.637 6.400 1.00 34.32 H new ATOM 8 N SER A 2 -3.257 2.644 4.765 1.00 62.21 N ATOM 9 CA SER A 2 -3.818 3.586 3.804 1.00 52.14 C ATOM 10 C SER A 2 -5.284 3.872 4.115 1.00 4.34 C ATOM 11 O SER A 2 -6.053 2.963 4.427 1.00 65.01 O ATOM 12 CB SER A 2 -3.685 3.036 2.382 1.00 13.32 C ATOM 13 OG SER A 2 -3.941 4.045 1.419 1.00 24.35 O ATOM 0 H SER A 2 -3.384 1.663 4.517 1.00 62.21 H new ATOM 0 HA SER A 2 -3.260 4.519 3.879 1.00 52.14 H new ATOM 0 HB2 SER A 2 -2.682 2.635 2.236 1.00 13.32 H new ATOM 0 HB3 SER A 2 -4.382 2.210 2.242 1.00 13.32 H new ATOM 0 HG SER A 2 -3.848 3.669 0.519 1.00 24.35 H new ATOM 19 N MET A 3 -5.663 5.143 4.030 1.00 41.44 N ATOM 20 CA MET A 3 -7.036 5.550 4.302 1.00 53.53 C ATOM 21 C MET A 3 -7.877 5.509 3.029 1.00 53.21 C ATOM 22 O MET A 3 -7.393 5.128 1.964 1.00 42.33 O ATOM 23 CB MET A 3 -7.066 6.958 4.901 1.00 64.42 C ATOM 24 CG MET A 3 -8.100 7.129 6.001 1.00 3.10 C ATOM 25 SD MET A 3 -7.651 8.417 7.182 1.00 74.54 S ATOM 26 CE MET A 3 -7.514 9.836 6.098 1.00 31.34 C ATOM 0 H MET A 3 -5.039 5.908 3.775 1.00 41.44 H new ATOM 0 HA MET A 3 -7.460 4.849 5.021 1.00 53.53 H new ATOM 0 HB2 MET A 3 -6.080 7.195 5.301 1.00 64.42 H new ATOM 0 HB3 MET A 3 -7.269 7.677 4.108 1.00 64.42 H new ATOM 0 HG2 MET A 3 -9.064 7.372 5.554 1.00 3.10 H new ATOM 0 HG3 MET A 3 -8.223 6.184 6.529 1.00 3.10 H new ATOM 0 HE1 MET A 3 -7.400 10.741 6.695 1.00 31.34 H new ATOM 0 HE2 MET A 3 -6.646 9.717 5.450 1.00 31.34 H new ATOM 0 HE3 MET A 3 -8.414 9.916 5.488 1.00 31.34 H new ATOM 36 N LYS A 4 -9.141 5.904 3.147 1.00 30.31 N ATOM 37 CA LYS A 4 -10.049 5.913 2.007 1.00 14.53 C ATOM 38 C LYS A 4 -10.663 7.296 1.813 1.00 41.34 C ATOM 39 O LYS A 4 -11.328 7.823 2.705 1.00 55.32 O ATOM 40 CB LYS A 4 -11.158 4.876 2.204 1.00 43.21 C ATOM 41 CG LYS A 4 -10.687 3.442 2.028 1.00 3.53 C ATOM 42 CD LYS A 4 -11.834 2.522 1.647 1.00 25.33 C ATOM 43 CE LYS A 4 -12.788 2.309 2.813 1.00 50.44 C ATOM 44 NZ LYS A 4 -12.172 1.489 3.891 1.00 32.51 N ATOM 0 H LYS A 4 -9.559 6.222 4.021 1.00 30.31 H new ATOM 0 HA LYS A 4 -9.476 5.659 1.115 1.00 14.53 H new ATOM 0 HB2 LYS A 4 -11.579 4.992 3.203 1.00 43.21 H new ATOM 0 HB3 LYS A 4 -11.961 5.076 1.495 1.00 43.21 H new ATOM 0 HG2 LYS A 4 -9.917 3.403 1.258 1.00 3.53 H new ATOM 0 HG3 LYS A 4 -10.230 3.092 2.954 1.00 3.53 H new ATOM 0 HD2 LYS A 4 -12.378 2.947 0.803 1.00 25.33 H new ATOM 0 HD3 LYS A 4 -11.438 1.561 1.319 1.00 25.33 H new ATOM 0 HE2 LYS A 4 -13.088 3.276 3.218 1.00 50.44 H new ATOM 0 HE3 LYS A 4 -13.694 1.818 2.456 1.00 50.44 H new ATOM 0 HZ1 LYS A 4 -12.911 1.167 4.548 1.00 32.51 H new ATOM 0 HZ2 LYS A 4 -11.699 0.663 3.472 1.00 32.51 H new ATOM 0 HZ3 LYS A 4 -11.475 2.062 4.408 1.00 32.51 H new ATOM 58 N SER A 5 -10.436 7.879 0.640 1.00 62.11 N ATOM 59 CA SER A 5 -10.963 9.202 0.328 1.00 12.20 C ATOM 60 C SER A 5 -11.860 9.153 -0.906 1.00 22.22 C ATOM 61 O SER A 5 -11.822 8.194 -1.678 1.00 34.34 O ATOM 62 CB SER A 5 -9.819 10.192 0.102 1.00 12.01 C ATOM 63 OG SER A 5 -8.989 10.282 1.247 1.00 21.11 O ATOM 0 H SER A 5 -9.890 7.455 -0.110 1.00 62.11 H new ATOM 0 HA SER A 5 -11.560 9.536 1.177 1.00 12.20 H new ATOM 0 HB2 SER A 5 -9.226 9.878 -0.757 1.00 12.01 H new ATOM 0 HB3 SER A 5 -10.226 11.175 -0.134 1.00 12.01 H new ATOM 0 HG SER A 5 -8.265 10.920 1.077 1.00 21.11 H new ATOM 69 N THR A 6 -12.665 10.195 -1.086 1.00 55.34 N ATOM 70 CA THR A 6 -13.572 10.272 -2.225 1.00 71.22 C ATOM 71 C THR A 6 -12.949 11.058 -3.372 1.00 3.41 C ATOM 72 O THR A 6 -12.534 12.205 -3.200 1.00 22.42 O ATOM 73 CB THR A 6 -14.909 10.928 -1.834 1.00 11.30 C ATOM 74 OG1 THR A 6 -15.318 10.476 -0.539 1.00 63.53 O ATOM 75 CG2 THR A 6 -15.990 10.604 -2.855 1.00 74.00 C ATOM 0 H THR A 6 -12.708 10.997 -0.458 1.00 55.34 H new ATOM 0 HA THR A 6 -13.759 9.249 -2.550 1.00 71.22 H new ATOM 0 HB THR A 6 -14.764 12.008 -1.811 1.00 11.30 H new ATOM 0 HG1 THR A 6 -16.168 10.900 -0.298 1.00 63.53 H new ATOM 0 HG21 THR A 6 -16.925 11.078 -2.558 1.00 74.00 H new ATOM 0 HG22 THR A 6 -15.689 10.977 -3.834 1.00 74.00 H new ATOM 0 HG23 THR A 6 -16.131 9.524 -2.906 1.00 74.00 H new ATOM 83 N PHE A 7 -12.886 10.436 -4.545 1.00 62.10 N ATOM 84 CA PHE A 7 -12.313 11.078 -5.722 1.00 61.10 C ATOM 85 C PHE A 7 -13.369 11.270 -6.805 1.00 74.12 C ATOM 86 O PHE A 7 -14.480 10.748 -6.706 1.00 1.21 O ATOM 87 CB PHE A 7 -11.151 10.245 -6.268 1.00 44.31 C ATOM 88 CG PHE A 7 -9.831 10.564 -5.626 1.00 65.12 C ATOM 89 CD1 PHE A 7 -9.692 10.537 -4.247 1.00 44.44 C ATOM 90 CD2 PHE A 7 -8.729 10.892 -6.400 1.00 73.43 C ATOM 91 CE1 PHE A 7 -8.478 10.830 -3.654 1.00 1.44 C ATOM 92 CE2 PHE A 7 -7.514 11.185 -5.812 1.00 51.13 C ATOM 93 CZ PHE A 7 -7.388 11.155 -4.437 1.00 71.01 C ATOM 0 H PHE A 7 -13.225 9.487 -4.705 1.00 62.10 H new ATOM 0 HA PHE A 7 -11.940 12.058 -5.425 1.00 61.10 H new ATOM 0 HB2 PHE A 7 -11.372 9.188 -6.121 1.00 44.31 H new ATOM 0 HB3 PHE A 7 -11.072 10.407 -7.343 1.00 44.31 H new ATOM 0 HD1 PHE A 7 -10.541 10.284 -3.629 1.00 44.44 H new ATOM 0 HD2 PHE A 7 -8.821 10.919 -7.476 1.00 73.43 H new ATOM 0 HE1 PHE A 7 -8.382 10.805 -2.579 1.00 1.44 H new ATOM 0 HE2 PHE A 7 -6.663 11.437 -6.427 1.00 51.13 H new ATOM 0 HZ PHE A 7 -6.439 11.385 -3.975 1.00 71.01 H new ATOM 103 N LYS A 8 -13.015 12.023 -7.841 1.00 41.14 N ATOM 104 CA LYS A 8 -13.930 12.286 -8.945 1.00 72.24 C ATOM 105 C LYS A 8 -14.054 11.065 -9.852 1.00 22.22 C ATOM 106 O LYS A 8 -15.074 10.871 -10.512 1.00 72.14 O ATOM 107 CB LYS A 8 -13.450 13.490 -9.758 1.00 73.12 C ATOM 108 CG LYS A 8 -13.912 14.824 -9.199 1.00 53.42 C ATOM 109 CD LYS A 8 -12.933 15.369 -8.173 1.00 51.11 C ATOM 110 CE LYS A 8 -11.833 16.187 -8.831 1.00 73.25 C ATOM 111 NZ LYS A 8 -10.692 15.333 -9.267 1.00 34.31 N ATOM 0 H LYS A 8 -12.100 12.462 -7.939 1.00 41.14 H new ATOM 0 HA LYS A 8 -14.911 12.507 -8.525 1.00 72.24 H new ATOM 0 HB2 LYS A 8 -12.361 13.480 -9.798 1.00 73.12 H new ATOM 0 HB3 LYS A 8 -13.808 13.392 -10.783 1.00 73.12 H new ATOM 0 HG2 LYS A 8 -14.024 15.541 -10.012 1.00 53.42 H new ATOM 0 HG3 LYS A 8 -14.894 14.707 -8.740 1.00 53.42 H new ATOM 0 HD2 LYS A 8 -13.467 15.989 -7.453 1.00 51.11 H new ATOM 0 HD3 LYS A 8 -12.490 14.543 -7.617 1.00 51.11 H new ATOM 0 HE2 LYS A 8 -12.240 16.717 -9.692 1.00 73.25 H new ATOM 0 HE3 LYS A 8 -11.475 16.943 -8.132 1.00 73.25 H new ATOM 0 HZ1 LYS A 8 -9.816 15.894 -9.261 1.00 34.31 H new ATOM 0 HZ2 LYS A 8 -10.592 14.528 -8.616 1.00 34.31 H new ATOM 0 HZ3 LYS A 8 -10.870 14.980 -10.229 1.00 34.31 H new ATOM 125 N SER A 9 -13.009 10.243 -9.876 1.00 45.32 N ATOM 126 CA SER A 9 -13.000 9.043 -10.703 1.00 33.21 C ATOM 127 C SER A 9 -14.250 8.204 -10.457 1.00 1.31 C ATOM 128 O SER A 9 -14.779 7.575 -11.373 1.00 60.31 O ATOM 129 CB SER A 9 -11.749 8.210 -10.417 1.00 61.10 C ATOM 130 OG SER A 9 -10.612 8.760 -11.060 1.00 63.32 O ATOM 0 H SER A 9 -12.158 10.387 -9.332 1.00 45.32 H new ATOM 0 HA SER A 9 -12.991 9.352 -11.748 1.00 33.21 H new ATOM 0 HB2 SER A 9 -11.576 8.165 -9.342 1.00 61.10 H new ATOM 0 HB3 SER A 9 -11.904 7.186 -10.758 1.00 61.10 H new ATOM 0 HG SER A 9 -9.825 8.211 -10.860 1.00 63.32 H new ATOM 136 N GLU A 10 -14.716 8.200 -9.211 1.00 54.54 N ATOM 137 CA GLU A 10 -15.905 7.439 -8.844 1.00 21.43 C ATOM 138 C GLU A 10 -17.161 8.071 -9.434 1.00 42.31 C ATOM 139 O GLU A 10 -18.026 7.378 -9.970 1.00 11.14 O ATOM 140 CB GLU A 10 -16.031 7.352 -7.321 1.00 61.41 C ATOM 141 CG GLU A 10 -16.928 6.220 -6.848 1.00 42.44 C ATOM 142 CD GLU A 10 -16.521 4.876 -7.420 1.00 22.21 C ATOM 143 OE1 GLU A 10 -15.342 4.495 -7.259 1.00 51.15 O ATOM 144 OE2 GLU A 10 -17.382 4.204 -8.026 1.00 45.10 O ATOM 0 H GLU A 10 -14.289 8.714 -8.440 1.00 54.54 H new ATOM 0 HA GLU A 10 -15.801 6.433 -9.252 1.00 21.43 H new ATOM 0 HB2 GLU A 10 -15.038 7.222 -6.890 1.00 61.41 H new ATOM 0 HB3 GLU A 10 -16.422 8.296 -6.943 1.00 61.41 H new ATOM 0 HG2 GLU A 10 -16.901 6.171 -5.759 1.00 42.44 H new ATOM 0 HG3 GLU A 10 -17.958 6.435 -7.132 1.00 42.44 H new ATOM 151 N TYR A 11 -17.256 9.392 -9.331 1.00 2.22 N ATOM 152 CA TYR A 11 -18.407 10.120 -9.852 1.00 1.13 C ATOM 153 C TYR A 11 -17.964 11.267 -10.754 1.00 40.21 C ATOM 154 O TYR A 11 -18.041 12.441 -10.393 1.00 13.35 O ATOM 155 CB TYR A 11 -19.257 10.660 -8.701 1.00 15.40 C ATOM 156 CG TYR A 11 -20.698 10.918 -9.081 1.00 70.14 C ATOM 157 CD1 TYR A 11 -21.566 9.864 -9.343 1.00 13.32 C ATOM 158 CD2 TYR A 11 -21.191 12.213 -9.181 1.00 64.24 C ATOM 159 CE1 TYR A 11 -22.883 10.094 -9.693 1.00 14.25 C ATOM 160 CE2 TYR A 11 -22.507 12.452 -9.528 1.00 24.22 C ATOM 161 CZ TYR A 11 -23.348 11.390 -9.783 1.00 51.22 C ATOM 162 OH TYR A 11 -24.659 11.624 -10.130 1.00 32.02 O ATOM 0 H TYR A 11 -16.549 9.981 -8.891 1.00 2.22 H new ATOM 0 HA TYR A 11 -19.006 9.428 -10.444 1.00 1.13 H new ATOM 0 HB2 TYR A 11 -19.230 9.949 -7.875 1.00 15.40 H new ATOM 0 HB3 TYR A 11 -18.814 11.587 -8.338 1.00 15.40 H new ATOM 0 HD1 TYR A 11 -21.205 8.849 -9.272 1.00 13.32 H new ATOM 0 HD2 TYR A 11 -20.534 13.047 -8.984 1.00 64.24 H new ATOM 0 HE1 TYR A 11 -23.544 9.264 -9.895 1.00 14.25 H new ATOM 0 HE2 TYR A 11 -22.875 13.465 -9.599 1.00 24.22 H new ATOM 0 HH TYR A 11 -24.825 12.590 -10.147 1.00 32.02 H new ATOM 172 N PRO A 12 -17.490 10.921 -11.960 1.00 62.13 N ATOM 173 CA PRO A 12 -17.026 11.905 -12.941 1.00 1.44 C ATOM 174 C PRO A 12 -18.170 12.730 -13.520 1.00 74.34 C ATOM 175 O PRO A 12 -19.315 12.278 -13.564 1.00 33.51 O ATOM 176 CB PRO A 12 -16.382 11.045 -14.031 1.00 25.31 C ATOM 177 CG PRO A 12 -17.057 9.723 -13.918 1.00 32.31 C ATOM 178 CD PRO A 12 -17.368 9.540 -12.458 1.00 55.41 C ATOM 0 HA PRO A 12 -16.347 12.633 -12.497 1.00 1.44 H new ATOM 0 HB2 PRO A 12 -16.530 11.482 -15.019 1.00 25.31 H new ATOM 0 HB3 PRO A 12 -15.306 10.955 -13.880 1.00 25.31 H new ATOM 0 HG2 PRO A 12 -17.967 9.697 -14.517 1.00 32.31 H new ATOM 0 HG3 PRO A 12 -16.412 8.923 -14.283 1.00 32.31 H new ATOM 0 HD2 PRO A 12 -18.290 8.977 -12.311 1.00 55.41 H new ATOM 0 HD3 PRO A 12 -16.576 8.996 -11.943 1.00 55.41 H new ATOM 186 N PHE A 13 -17.855 13.942 -13.966 1.00 54.21 N ATOM 187 CA PHE A 13 -18.858 14.830 -14.543 1.00 31.40 C ATOM 188 C PHE A 13 -19.091 14.502 -16.015 1.00 3.41 C ATOM 189 O PHE A 13 -20.229 14.334 -16.450 1.00 62.24 O ATOM 190 CB PHE A 13 -18.424 16.289 -14.395 1.00 32.15 C ATOM 191 CG PHE A 13 -19.430 17.270 -14.923 1.00 13.13 C ATOM 192 CD1 PHE A 13 -20.504 17.669 -14.143 1.00 55.40 C ATOM 193 CD2 PHE A 13 -19.303 17.794 -16.198 1.00 43.32 C ATOM 194 CE1 PHE A 13 -21.433 18.571 -14.627 1.00 24.14 C ATOM 195 CE2 PHE A 13 -20.227 18.698 -16.688 1.00 55.41 C ATOM 196 CZ PHE A 13 -21.293 19.087 -15.900 1.00 42.35 C ATOM 0 H PHE A 13 -16.913 14.332 -13.939 1.00 54.21 H new ATOM 0 HA PHE A 13 -19.793 14.681 -14.003 1.00 31.40 H new ATOM 0 HB2 PHE A 13 -18.241 16.500 -13.341 1.00 32.15 H new ATOM 0 HB3 PHE A 13 -17.479 16.433 -14.918 1.00 32.15 H new ATOM 0 HD1 PHE A 13 -20.616 17.271 -13.145 1.00 55.40 H new ATOM 0 HD2 PHE A 13 -18.471 17.493 -16.818 1.00 43.32 H new ATOM 0 HE1 PHE A 13 -22.267 18.872 -14.010 1.00 24.14 H new ATOM 0 HE2 PHE A 13 -20.116 19.099 -17.685 1.00 55.41 H new ATOM 0 HZ PHE A 13 -22.016 19.794 -16.279 1.00 42.35 H new ATOM 206 N GLU A 14 -18.003 14.417 -16.775 1.00 11.11 N ATOM 207 CA GLU A 14 -18.090 14.113 -18.198 1.00 44.55 C ATOM 208 C GLU A 14 -18.762 12.763 -18.427 1.00 14.22 C ATOM 209 O GLU A 14 -19.548 12.597 -19.359 1.00 53.44 O ATOM 210 CB GLU A 14 -16.694 14.114 -18.828 1.00 35.44 C ATOM 211 CG GLU A 14 -16.035 15.481 -18.847 1.00 14.42 C ATOM 212 CD GLU A 14 -14.860 15.550 -19.803 1.00 15.21 C ATOM 213 OE1 GLU A 14 -13.770 15.062 -19.440 1.00 70.30 O ATOM 214 OE2 GLU A 14 -15.032 16.093 -20.915 1.00 34.22 O ATOM 0 H GLU A 14 -17.053 14.554 -16.429 1.00 11.11 H new ATOM 0 HA GLU A 14 -18.696 14.885 -18.672 1.00 44.55 H new ATOM 0 HB2 GLU A 14 -16.057 13.421 -18.279 1.00 35.44 H new ATOM 0 HB3 GLU A 14 -16.766 13.741 -19.850 1.00 35.44 H new ATOM 0 HG2 GLU A 14 -16.773 16.232 -19.130 1.00 14.42 H new ATOM 0 HG3 GLU A 14 -15.696 15.730 -17.842 1.00 14.42 H new ATOM 221 N LYS A 15 -18.448 11.800 -17.567 1.00 75.34 N ATOM 222 CA LYS A 15 -19.021 10.463 -17.672 1.00 54.30 C ATOM 223 C LYS A 15 -18.767 9.869 -19.054 1.00 42.32 C ATOM 224 O LYS A 15 -19.619 9.172 -19.606 1.00 44.44 O ATOM 225 CB LYS A 15 -20.526 10.507 -17.394 1.00 3.34 C ATOM 226 CG LYS A 15 -20.871 10.998 -15.999 1.00 1.43 C ATOM 227 CD LYS A 15 -22.254 10.536 -15.571 1.00 13.11 C ATOM 228 CE LYS A 15 -22.383 10.488 -14.056 1.00 62.53 C ATOM 229 NZ LYS A 15 -22.774 11.809 -13.490 1.00 21.53 N ATOM 0 H LYS A 15 -17.799 11.921 -16.789 1.00 75.34 H new ATOM 0 HA LYS A 15 -18.538 9.829 -16.928 1.00 54.30 H new ATOM 0 HB2 LYS A 15 -21.004 11.156 -18.127 1.00 3.34 H new ATOM 0 HB3 LYS A 15 -20.942 9.509 -17.532 1.00 3.34 H new ATOM 0 HG2 LYS A 15 -20.129 10.632 -15.290 1.00 1.43 H new ATOM 0 HG3 LYS A 15 -20.826 12.087 -15.974 1.00 1.43 H new ATOM 0 HD2 LYS A 15 -23.006 11.210 -15.980 1.00 13.11 H new ATOM 0 HD3 LYS A 15 -22.453 9.548 -15.985 1.00 13.11 H new ATOM 0 HE2 LYS A 15 -23.126 9.740 -13.778 1.00 62.53 H new ATOM 0 HE3 LYS A 15 -21.435 10.173 -13.621 1.00 62.53 H new ATOM 0 HZ1 LYS A 15 -22.901 11.722 -12.461 1.00 21.53 H new ATOM 0 HZ2 LYS A 15 -22.029 12.506 -13.689 1.00 21.53 H new ATOM 0 HZ3 LYS A 15 -23.666 12.122 -13.924 1.00 21.53 H new ATOM 243 N ARG A 16 -17.591 10.147 -19.605 1.00 62.40 N ATOM 244 CA ARG A 16 -17.225 9.639 -20.922 1.00 43.41 C ATOM 245 C ARG A 16 -16.575 8.263 -20.814 1.00 4.32 C ATOM 246 O ARG A 16 -15.887 7.965 -19.837 1.00 12.03 O ATOM 247 CB ARG A 16 -16.272 10.612 -21.621 1.00 31.22 C ATOM 248 CG ARG A 16 -16.236 10.450 -23.131 1.00 53.22 C ATOM 249 CD ARG A 16 -17.348 11.241 -23.803 1.00 60.03 C ATOM 250 NE ARG A 16 -17.571 10.811 -25.180 1.00 64.21 N ATOM 251 CZ ARG A 16 -18.505 11.328 -25.970 1.00 2.33 C ATOM 252 NH1 ARG A 16 -19.299 12.291 -25.521 1.00 3.33 N ATOM 253 NH2 ARG A 16 -18.646 10.884 -27.213 1.00 22.45 N ATOM 0 H ARG A 16 -16.875 10.721 -19.160 1.00 62.40 H new ATOM 0 HA ARG A 16 -18.136 9.545 -21.513 1.00 43.41 H new ATOM 0 HB2 ARG A 16 -16.568 11.633 -21.381 1.00 31.22 H new ATOM 0 HB3 ARG A 16 -15.267 10.470 -21.225 1.00 31.22 H new ATOM 0 HG2 ARG A 16 -15.270 10.783 -23.511 1.00 53.22 H new ATOM 0 HG3 ARG A 16 -16.332 9.395 -23.387 1.00 53.22 H new ATOM 0 HD2 ARG A 16 -18.270 11.125 -23.233 1.00 60.03 H new ATOM 0 HD3 ARG A 16 -17.097 12.302 -23.791 1.00 60.03 H new ATOM 0 HE ARG A 16 -16.977 10.073 -25.556 1.00 64.21 H new ATOM 0 HH11 ARG A 16 -19.193 12.636 -24.567 1.00 3.33 H new ATOM 0 HH12 ARG A 16 -20.016 12.686 -26.130 1.00 3.33 H new ATOM 0 HH21 ARG A 16 -18.037 10.145 -27.563 1.00 22.45 H new ATOM 0 HH22 ARG A 16 -19.364 11.282 -27.818 1.00 22.45 H new ATOM 267 N LYS A 17 -16.796 7.428 -21.823 1.00 13.55 N ATOM 268 CA LYS A 17 -16.232 6.084 -21.843 1.00 23.24 C ATOM 269 C LYS A 17 -15.227 5.932 -22.980 1.00 3.53 C ATOM 270 O LYS A 17 -15.606 5.747 -24.136 1.00 31.15 O ATOM 271 CB LYS A 17 -17.344 5.044 -21.989 1.00 55.52 C ATOM 272 CG LYS A 17 -17.911 4.568 -20.663 1.00 71.40 C ATOM 273 CD LYS A 17 -16.925 3.679 -19.923 1.00 41.21 C ATOM 274 CE LYS A 17 -16.857 2.289 -20.538 1.00 42.51 C ATOM 275 NZ LYS A 17 -16.341 1.280 -19.572 1.00 50.14 N ATOM 0 H LYS A 17 -17.363 7.659 -22.639 1.00 13.55 H new ATOM 0 HA LYS A 17 -15.713 5.921 -20.899 1.00 23.24 H new ATOM 0 HB2 LYS A 17 -18.150 5.468 -22.588 1.00 55.52 H new ATOM 0 HB3 LYS A 17 -16.957 4.186 -22.538 1.00 55.52 H new ATOM 0 HG2 LYS A 17 -18.162 5.429 -20.043 1.00 71.40 H new ATOM 0 HG3 LYS A 17 -18.837 4.020 -20.838 1.00 71.40 H new ATOM 0 HD2 LYS A 17 -15.936 4.136 -19.943 1.00 41.21 H new ATOM 0 HD3 LYS A 17 -17.219 3.601 -18.876 1.00 41.21 H new ATOM 0 HE2 LYS A 17 -17.850 1.993 -20.877 1.00 42.51 H new ATOM 0 HE3 LYS A 17 -16.214 2.312 -21.418 1.00 42.51 H new ATOM 0 HZ1 LYS A 17 -15.446 0.887 -19.926 1.00 50.14 H new ATOM 0 HZ2 LYS A 17 -16.180 1.733 -18.650 1.00 50.14 H new ATOM 0 HZ3 LYS A 17 -17.037 0.515 -19.465 1.00 50.14 H new ATOM 289 N ALA A 18 -13.943 6.011 -22.644 1.00 12.04 N ATOM 290 CA ALA A 18 -12.884 5.879 -23.635 1.00 61.05 C ATOM 291 C ALA A 18 -12.838 4.465 -24.204 1.00 43.11 C ATOM 292 O ALA A 18 -12.475 4.265 -25.362 1.00 71.25 O ATOM 293 CB ALA A 18 -11.541 6.250 -23.026 1.00 63.20 C ATOM 0 H ALA A 18 -13.612 6.166 -21.692 1.00 12.04 H new ATOM 0 HA ALA A 18 -13.100 6.565 -24.454 1.00 61.05 H new ATOM 0 HB1 ALA A 18 -10.759 6.146 -23.778 1.00 63.20 H new ATOM 0 HB2 ALA A 18 -11.573 7.282 -22.675 1.00 63.20 H new ATOM 0 HB3 ALA A 18 -11.327 5.588 -22.187 1.00 63.20 H new ATOM 299 N GLU A 19 -13.207 3.489 -23.381 1.00 61.21 N ATOM 300 CA GLU A 19 -13.205 2.093 -23.802 1.00 51.32 C ATOM 301 C GLU A 19 -14.072 1.899 -25.044 1.00 63.11 C ATOM 302 O GLU A 19 -13.638 1.301 -26.029 1.00 61.14 O ATOM 303 CB GLU A 19 -13.707 1.194 -22.671 1.00 3.32 C ATOM 304 CG GLU A 19 -13.141 -0.215 -22.717 1.00 14.03 C ATOM 305 CD GLU A 19 -12.897 -0.791 -21.335 1.00 51.12 C ATOM 306 OE1 GLU A 19 -13.401 -0.207 -20.352 1.00 52.21 O ATOM 307 OE2 GLU A 19 -12.204 -1.824 -21.236 1.00 24.43 O ATOM 0 H GLU A 19 -13.511 3.639 -22.419 1.00 61.21 H new ATOM 0 HA GLU A 19 -12.180 1.816 -24.047 1.00 51.32 H new ATOM 0 HB2 GLU A 19 -13.449 1.649 -21.715 1.00 3.32 H new ATOM 0 HB3 GLU A 19 -14.795 1.141 -22.716 1.00 3.32 H new ATOM 0 HG2 GLU A 19 -13.830 -0.862 -23.260 1.00 14.03 H new ATOM 0 HG3 GLU A 19 -12.204 -0.208 -23.274 1.00 14.03 H new ATOM 314 N SER A 20 -15.298 2.408 -24.987 1.00 72.14 N ATOM 315 CA SER A 20 -16.228 2.287 -26.104 1.00 31.41 C ATOM 316 C SER A 20 -15.686 2.996 -27.341 1.00 63.03 C ATOM 317 O SER A 20 -15.954 2.588 -28.470 1.00 65.54 O ATOM 318 CB SER A 20 -17.591 2.868 -25.724 1.00 72.05 C ATOM 319 OG SER A 20 -18.268 2.024 -24.809 1.00 74.04 O ATOM 0 H SER A 20 -15.671 2.908 -24.180 1.00 72.14 H new ATOM 0 HA SER A 20 -16.344 1.228 -26.336 1.00 31.41 H new ATOM 0 HB2 SER A 20 -17.458 3.856 -25.283 1.00 72.05 H new ATOM 0 HB3 SER A 20 -18.197 2.998 -26.621 1.00 72.05 H new ATOM 0 HG SER A 20 -19.136 2.418 -24.581 1.00 74.04 H new ATOM 325 N GLU A 21 -14.923 4.062 -27.118 1.00 15.03 N ATOM 326 CA GLU A 21 -14.345 4.830 -28.215 1.00 25.55 C ATOM 327 C GLU A 21 -13.336 3.990 -28.993 1.00 12.01 C ATOM 328 O GLU A 21 -13.508 3.745 -30.187 1.00 63.33 O ATOM 329 CB GLU A 21 -13.668 6.094 -27.680 1.00 34.21 C ATOM 330 CG GLU A 21 -14.514 7.347 -27.831 1.00 54.22 C ATOM 331 CD GLU A 21 -15.566 7.475 -26.745 1.00 43.31 C ATOM 332 OE1 GLU A 21 -16.570 6.736 -26.800 1.00 54.01 O ATOM 333 OE2 GLU A 21 -15.383 8.317 -25.841 1.00 22.23 O ATOM 0 H GLU A 21 -14.691 4.413 -26.189 1.00 15.03 H new ATOM 0 HA GLU A 21 -15.152 5.116 -28.890 1.00 25.55 H new ATOM 0 HB2 GLU A 21 -13.431 5.951 -26.626 1.00 34.21 H new ATOM 0 HB3 GLU A 21 -12.723 6.239 -28.203 1.00 34.21 H new ATOM 0 HG2 GLU A 21 -13.866 8.223 -27.809 1.00 54.22 H new ATOM 0 HG3 GLU A 21 -15.002 7.336 -28.805 1.00 54.22 H new ATOM 340 N ARG A 22 -12.284 3.554 -28.308 1.00 13.34 N ATOM 341 CA ARG A 22 -11.246 2.744 -28.934 1.00 54.31 C ATOM 342 C ARG A 22 -11.840 1.477 -29.545 1.00 43.33 C ATOM 343 O ARG A 22 -11.509 1.107 -30.672 1.00 75.00 O ATOM 344 CB ARG A 22 -10.171 2.374 -27.911 1.00 41.25 C ATOM 345 CG ARG A 22 -9.556 3.576 -27.213 1.00 3.42 C ATOM 346 CD ARG A 22 -8.446 4.197 -28.046 1.00 64.33 C ATOM 347 NE ARG A 22 -7.255 3.351 -28.090 1.00 74.35 N ATOM 348 CZ ARG A 22 -6.220 3.579 -28.890 1.00 5.02 C ATOM 349 NH1 ARG A 22 -6.228 4.623 -29.708 1.00 25.23 N ATOM 350 NH2 ARG A 22 -5.173 2.765 -28.871 1.00 30.30 N ATOM 0 H ARG A 22 -12.128 3.748 -27.319 1.00 13.34 H new ATOM 0 HA ARG A 22 -10.792 3.333 -29.731 1.00 54.31 H new ATOM 0 HB2 ARG A 22 -10.606 1.713 -27.162 1.00 41.25 H new ATOM 0 HB3 ARG A 22 -9.382 1.812 -28.412 1.00 41.25 H new ATOM 0 HG2 ARG A 22 -10.328 4.321 -27.021 1.00 3.42 H new ATOM 0 HG3 ARG A 22 -9.159 3.272 -26.245 1.00 3.42 H new ATOM 0 HD2 ARG A 22 -8.807 4.368 -29.060 1.00 64.33 H new ATOM 0 HD3 ARG A 22 -8.184 5.171 -27.632 1.00 64.33 H new ATOM 0 HE ARG A 22 -7.217 2.541 -27.472 1.00 74.35 H new ATOM 0 HH11 ARG A 22 -7.030 5.253 -29.723 1.00 25.23 H new ATOM 0 HH12 ARG A 22 -5.432 4.796 -30.322 1.00 25.23 H new ATOM 0 HH21 ARG A 22 -5.162 1.963 -28.241 1.00 30.30 H new ATOM 0 HH22 ARG A 22 -4.379 2.941 -29.486 1.00 30.30 H new ATOM 364 N ILE A 23 -12.716 0.820 -28.794 1.00 32.13 N ATOM 365 CA ILE A 23 -13.355 -0.404 -29.261 1.00 73.23 C ATOM 366 C ILE A 23 -14.230 -0.135 -30.480 1.00 75.14 C ATOM 367 O ILE A 23 -14.269 -0.933 -31.417 1.00 72.12 O ATOM 368 CB ILE A 23 -14.216 -1.047 -28.158 1.00 1.32 C ATOM 369 CG1 ILE A 23 -13.345 -1.429 -26.959 1.00 30.20 C ATOM 370 CG2 ILE A 23 -14.946 -2.267 -28.698 1.00 54.11 C ATOM 371 CD1 ILE A 23 -14.133 -1.671 -25.691 1.00 52.23 C ATOM 0 H ILE A 23 -13.000 1.114 -27.860 1.00 32.13 H new ATOM 0 HA ILE A 23 -12.556 -1.093 -29.534 1.00 73.23 H new ATOM 0 HB ILE A 23 -14.959 -0.320 -27.828 1.00 1.32 H new ATOM 0 HG12 ILE A 23 -12.780 -2.329 -27.203 1.00 30.20 H new ATOM 0 HG13 ILE A 23 -12.619 -0.636 -26.780 1.00 30.20 H new ATOM 0 HG21 ILE A 23 -15.550 -2.710 -27.906 1.00 54.11 H new ATOM 0 HG22 ILE A 23 -15.592 -1.968 -29.523 1.00 54.11 H new ATOM 0 HG23 ILE A 23 -14.220 -2.998 -29.052 1.00 54.11 H new ATOM 0 HD11 ILE A 23 -13.451 -1.937 -24.884 1.00 52.23 H new ATOM 0 HD12 ILE A 23 -14.677 -0.766 -25.422 1.00 52.23 H new ATOM 0 HD13 ILE A 23 -14.840 -2.485 -25.852 1.00 52.23 H new ATOM 383 N ALA A 24 -14.930 0.994 -30.464 1.00 15.04 N ATOM 384 CA ALA A 24 -15.802 1.370 -31.569 1.00 60.31 C ATOM 385 C ALA A 24 -15.055 1.322 -32.897 1.00 54.43 C ATOM 386 O ALA A 24 -15.601 0.889 -33.912 1.00 54.11 O ATOM 387 CB ALA A 24 -16.381 2.758 -31.337 1.00 23.42 C ATOM 0 H ALA A 24 -14.910 1.665 -29.696 1.00 15.04 H new ATOM 0 HA ALA A 24 -16.620 0.651 -31.615 1.00 60.31 H new ATOM 0 HB1 ALA A 24 -17.030 3.025 -32.171 1.00 23.42 H new ATOM 0 HB2 ALA A 24 -16.958 2.762 -30.412 1.00 23.42 H new ATOM 0 HB3 ALA A 24 -15.570 3.483 -31.262 1.00 23.42 H new ATOM 393 N ASP A 25 -13.804 1.770 -32.884 1.00 53.22 N ATOM 394 CA ASP A 25 -12.983 1.778 -34.089 1.00 44.32 C ATOM 395 C ASP A 25 -12.384 0.398 -34.347 1.00 51.22 C ATOM 396 O ASP A 25 -12.041 0.063 -35.481 1.00 45.02 O ATOM 397 CB ASP A 25 -11.866 2.816 -33.963 1.00 72.22 C ATOM 398 CG ASP A 25 -12.329 4.211 -34.334 1.00 31.11 C ATOM 399 OD1 ASP A 25 -13.554 4.415 -34.462 1.00 42.11 O ATOM 400 OD2 ASP A 25 -11.465 5.100 -34.498 1.00 34.41 O ATOM 0 H ASP A 25 -13.337 2.132 -32.053 1.00 53.22 H new ATOM 0 HA ASP A 25 -13.621 2.042 -34.933 1.00 44.32 H new ATOM 0 HB2 ASP A 25 -11.492 2.821 -32.939 1.00 72.22 H new ATOM 0 HB3 ASP A 25 -11.033 2.530 -34.605 1.00 72.22 H new ATOM 405 N ARG A 26 -12.264 -0.396 -33.290 1.00 25.15 N ATOM 406 CA ARG A 26 -11.704 -1.738 -33.402 1.00 14.35 C ATOM 407 C ARG A 26 -12.805 -2.767 -33.644 1.00 0.54 C ATOM 408 O ARG A 26 -12.559 -3.973 -33.619 1.00 11.41 O ATOM 409 CB ARG A 26 -10.926 -2.097 -32.135 1.00 33.52 C ATOM 410 CG ARG A 26 -9.700 -1.230 -31.907 1.00 23.44 C ATOM 411 CD ARG A 26 -8.591 -1.563 -32.893 1.00 25.02 C ATOM 412 NE ARG A 26 -7.480 -0.619 -32.807 1.00 32.40 N ATOM 413 CZ ARG A 26 -6.550 -0.662 -31.859 1.00 34.44 C ATOM 414 NH1 ARG A 26 -6.598 -1.599 -30.922 1.00 20.33 N ATOM 415 NH2 ARG A 26 -5.570 0.231 -31.848 1.00 22.44 N ATOM 0 H ARG A 26 -12.547 -0.134 -32.346 1.00 25.15 H new ATOM 0 HA ARG A 26 -11.024 -1.751 -34.253 1.00 14.35 H new ATOM 0 HB2 ARG A 26 -11.589 -2.008 -31.274 1.00 33.52 H new ATOM 0 HB3 ARG A 26 -10.617 -3.141 -32.192 1.00 33.52 H new ATOM 0 HG2 ARG A 26 -9.973 -0.179 -32.006 1.00 23.44 H new ATOM 0 HG3 ARG A 26 -9.338 -1.371 -30.889 1.00 23.44 H new ATOM 0 HD2 ARG A 26 -8.225 -2.572 -32.700 1.00 25.02 H new ATOM 0 HD3 ARG A 26 -8.993 -1.558 -33.906 1.00 25.02 H new ATOM 0 HE ARG A 26 -7.414 0.114 -33.514 1.00 32.40 H new ATOM 0 HH11 ARG A 26 -7.350 -2.288 -30.928 1.00 20.33 H new ATOM 0 HH12 ARG A 26 -5.883 -1.630 -30.195 1.00 20.33 H new ATOM 0 HH21 ARG A 26 -5.529 0.952 -32.568 1.00 22.44 H new ATOM 0 HH22 ARG A 26 -4.857 0.197 -31.120 1.00 22.44 H new ATOM 429 N PHE A 27 -14.020 -2.281 -33.879 1.00 35.23 N ATOM 430 CA PHE A 27 -15.160 -3.158 -34.124 1.00 63.32 C ATOM 431 C PHE A 27 -16.091 -2.557 -35.172 1.00 55.24 C ATOM 432 O PHE A 27 -16.023 -1.365 -35.470 1.00 53.25 O ATOM 433 CB PHE A 27 -15.928 -3.407 -32.825 1.00 62.13 C ATOM 434 CG PHE A 27 -15.704 -4.777 -32.250 1.00 12.13 C ATOM 435 CD1 PHE A 27 -16.505 -5.841 -32.631 1.00 61.23 C ATOM 436 CD2 PHE A 27 -14.694 -4.999 -31.328 1.00 13.14 C ATOM 437 CE1 PHE A 27 -16.302 -7.103 -32.104 1.00 21.33 C ATOM 438 CE2 PHE A 27 -14.486 -6.258 -30.798 1.00 42.01 C ATOM 439 CZ PHE A 27 -15.292 -7.312 -31.185 1.00 45.31 C ATOM 0 H PHE A 27 -14.240 -1.285 -33.905 1.00 35.23 H new ATOM 0 HA PHE A 27 -14.782 -4.108 -34.501 1.00 63.32 H new ATOM 0 HB2 PHE A 27 -15.633 -2.660 -32.089 1.00 62.13 H new ATOM 0 HB3 PHE A 27 -16.993 -3.269 -33.010 1.00 62.13 H new ATOM 0 HD1 PHE A 27 -17.297 -5.683 -33.348 1.00 61.23 H new ATOM 0 HD2 PHE A 27 -14.062 -4.179 -31.020 1.00 13.14 H new ATOM 0 HE1 PHE A 27 -16.932 -7.925 -32.411 1.00 21.33 H new ATOM 0 HE2 PHE A 27 -13.694 -6.418 -30.082 1.00 42.01 H new ATOM 0 HZ PHE A 27 -15.133 -8.296 -30.770 1.00 45.31 H new ATOM 449 N LYS A 28 -16.962 -3.392 -35.729 1.00 61.44 N ATOM 450 CA LYS A 28 -17.910 -2.947 -36.744 1.00 2.12 C ATOM 451 C LYS A 28 -19.247 -3.665 -36.593 1.00 23.55 C ATOM 452 O LYS A 28 -19.372 -4.603 -35.806 1.00 11.33 O ATOM 453 CB LYS A 28 -17.342 -3.191 -38.144 1.00 70.20 C ATOM 454 CG LYS A 28 -16.791 -4.593 -38.341 1.00 4.52 C ATOM 455 CD LYS A 28 -16.763 -4.980 -39.810 1.00 12.12 C ATOM 456 CE LYS A 28 -15.593 -4.332 -40.534 1.00 60.12 C ATOM 457 NZ LYS A 28 -15.691 -4.505 -42.010 1.00 65.42 N ATOM 0 H LYS A 28 -17.031 -4.382 -35.494 1.00 61.44 H new ATOM 0 HA LYS A 28 -18.075 -1.878 -36.607 1.00 2.12 H new ATOM 0 HB2 LYS A 28 -18.124 -3.010 -38.881 1.00 70.20 H new ATOM 0 HB3 LYS A 28 -16.550 -2.468 -38.337 1.00 70.20 H new ATOM 0 HG2 LYS A 28 -15.783 -4.650 -37.930 1.00 4.52 H new ATOM 0 HG3 LYS A 28 -17.402 -5.306 -37.788 1.00 4.52 H new ATOM 0 HD2 LYS A 28 -16.693 -6.064 -39.901 1.00 12.12 H new ATOM 0 HD3 LYS A 28 -17.697 -4.680 -40.284 1.00 12.12 H new ATOM 0 HE2 LYS A 28 -15.561 -3.269 -40.294 1.00 60.12 H new ATOM 0 HE3 LYS A 28 -14.659 -4.768 -40.178 1.00 60.12 H new ATOM 0 HZ1 LYS A 28 -14.876 -4.050 -42.468 1.00 65.42 H new ATOM 0 HZ2 LYS A 28 -15.696 -5.519 -42.241 1.00 65.42 H new ATOM 0 HZ3 LYS A 28 -16.570 -4.067 -42.353 1.00 65.42 H new ATOM 471 N ASN A 29 -20.241 -3.222 -37.354 1.00 40.51 N ATOM 472 CA ASN A 29 -21.569 -3.823 -37.305 1.00 74.43 C ATOM 473 C ASN A 29 -22.198 -3.643 -35.927 1.00 23.33 C ATOM 474 O ASN A 29 -22.903 -4.524 -35.435 1.00 70.31 O ATOM 475 CB ASN A 29 -21.489 -5.312 -37.651 1.00 42.33 C ATOM 476 CG ASN A 29 -20.692 -5.569 -38.915 1.00 23.41 C ATOM 477 OD1 ASN A 29 -19.475 -5.747 -38.869 1.00 44.50 O ATOM 478 ND2 ASN A 29 -21.377 -5.592 -40.053 1.00 0.25 N ATOM 0 H ASN A 29 -20.153 -2.448 -38.013 1.00 40.51 H new ATOM 0 HA ASN A 29 -22.197 -3.318 -38.039 1.00 74.43 H new ATOM 0 HB2 ASN A 29 -21.033 -5.851 -36.821 1.00 42.33 H new ATOM 0 HB3 ASN A 29 -22.497 -5.709 -37.773 1.00 42.33 H new ATOM 0 HD21 ASN A 29 -20.894 -5.762 -40.935 1.00 0.25 H new ATOM 0 HD22 ASN A 29 -22.385 -5.439 -40.044 1.00 0.25 H new ATOM 485 N ARG A 30 -21.937 -2.496 -35.309 1.00 62.22 N ATOM 486 CA ARG A 30 -22.476 -2.200 -33.987 1.00 55.54 C ATOM 487 C ARG A 30 -23.286 -0.907 -34.007 1.00 42.34 C ATOM 488 O ARG A 30 -23.016 -0.006 -34.802 1.00 63.41 O ATOM 489 CB ARG A 30 -21.345 -2.090 -32.963 1.00 61.44 C ATOM 490 CG ARG A 30 -20.400 -0.929 -33.223 1.00 43.40 C ATOM 491 CD ARG A 30 -19.209 -1.356 -34.066 1.00 71.12 C ATOM 492 NE ARG A 30 -18.327 -0.235 -34.376 1.00 43.21 N ATOM 493 CZ ARG A 30 -18.649 0.746 -35.212 1.00 32.32 C ATOM 494 NH1 ARG A 30 -19.828 0.743 -35.819 1.00 54.11 N ATOM 495 NH2 ARG A 30 -17.792 1.732 -35.443 1.00 25.43 N ATOM 0 H ARG A 30 -21.355 -1.756 -35.703 1.00 62.22 H new ATOM 0 HA ARG A 30 -23.137 -3.018 -33.701 1.00 55.54 H new ATOM 0 HB2 ARG A 30 -21.776 -1.981 -31.968 1.00 61.44 H new ATOM 0 HB3 ARG A 30 -20.775 -3.019 -32.963 1.00 61.44 H new ATOM 0 HG2 ARG A 30 -20.938 -0.128 -33.731 1.00 43.40 H new ATOM 0 HG3 ARG A 30 -20.049 -0.525 -32.273 1.00 43.40 H new ATOM 0 HD2 ARG A 30 -18.646 -2.124 -33.535 1.00 71.12 H new ATOM 0 HD3 ARG A 30 -19.564 -1.805 -34.994 1.00 71.12 H new ATOM 0 HE ARG A 30 -17.412 -0.203 -33.926 1.00 43.21 H new ATOM 0 HH11 ARG A 30 -20.490 -0.013 -35.644 1.00 54.11 H new ATOM 0 HH12 ARG A 30 -20.073 1.497 -36.460 1.00 54.11 H new ATOM 0 HH21 ARG A 30 -16.884 1.738 -34.978 1.00 25.43 H new ATOM 0 HH22 ARG A 30 -18.041 2.484 -36.085 1.00 25.43 H new ATOM 509 N ILE A 31 -24.280 -0.822 -33.129 1.00 72.44 N ATOM 510 CA ILE A 31 -25.127 0.360 -33.046 1.00 54.54 C ATOM 511 C ILE A 31 -25.058 0.990 -31.659 1.00 70.35 C ATOM 512 O ILE A 31 -25.506 0.416 -30.667 1.00 14.13 O ATOM 513 CB ILE A 31 -26.594 0.025 -33.373 1.00 35.14 C ATOM 514 CG1 ILE A 31 -26.887 -1.443 -33.059 1.00 33.44 C ATOM 515 CG2 ILE A 31 -26.896 0.330 -34.833 1.00 23.13 C ATOM 516 CD1 ILE A 31 -28.322 -1.844 -33.325 1.00 30.25 C ATOM 0 H ILE A 31 -24.518 -1.559 -32.465 1.00 72.44 H new ATOM 0 HA ILE A 31 -24.752 1.069 -33.783 1.00 54.54 H new ATOM 0 HB ILE A 31 -27.239 0.646 -32.752 1.00 35.14 H new ATOM 0 HG12 ILE A 31 -26.226 -2.072 -33.655 1.00 33.44 H new ATOM 0 HG13 ILE A 31 -26.653 -1.636 -32.012 1.00 33.44 H new ATOM 0 HG21 ILE A 31 -27.937 0.088 -35.048 1.00 23.13 H new ATOM 0 HG22 ILE A 31 -26.722 1.388 -35.027 1.00 23.13 H new ATOM 0 HG23 ILE A 31 -26.245 -0.267 -35.472 1.00 23.13 H new ATOM 0 HD11 ILE A 31 -28.457 -2.898 -33.080 1.00 30.25 H new ATOM 0 HD12 ILE A 31 -28.989 -1.240 -32.709 1.00 30.25 H new ATOM 0 HD13 ILE A 31 -28.556 -1.683 -34.378 1.00 30.25 H new ATOM 528 N PRO A 32 -24.484 2.200 -31.587 1.00 41.55 N ATOM 529 CA PRO A 32 -24.345 2.936 -30.327 1.00 60.02 C ATOM 530 C PRO A 32 -25.685 3.432 -29.794 1.00 30.44 C ATOM 531 O PRO A 32 -26.241 4.409 -30.296 1.00 31.51 O ATOM 532 CB PRO A 32 -23.449 4.119 -30.705 1.00 61.30 C ATOM 533 CG PRO A 32 -23.673 4.313 -32.165 1.00 12.34 C ATOM 534 CD PRO A 32 -23.928 2.943 -32.730 1.00 1.23 C ATOM 0 HA PRO A 32 -23.937 2.311 -29.533 1.00 60.02 H new ATOM 0 HB2 PRO A 32 -23.715 5.013 -30.141 1.00 61.30 H new ATOM 0 HB3 PRO A 32 -22.402 3.907 -30.490 1.00 61.30 H new ATOM 0 HG2 PRO A 32 -24.521 4.974 -32.345 1.00 12.34 H new ATOM 0 HG3 PRO A 32 -22.804 4.774 -32.635 1.00 12.34 H new ATOM 0 HD2 PRO A 32 -24.627 2.977 -33.566 1.00 1.23 H new ATOM 0 HD3 PRO A 32 -23.011 2.484 -33.100 1.00 1.23 H new ATOM 542 N VAL A 33 -26.198 2.752 -28.773 1.00 41.23 N ATOM 543 CA VAL A 33 -27.472 3.124 -28.171 1.00 14.31 C ATOM 544 C VAL A 33 -27.266 3.766 -26.803 1.00 52.41 C ATOM 545 O VAL A 33 -26.238 3.560 -26.157 1.00 52.21 O ATOM 546 CB VAL A 33 -28.399 1.904 -28.019 1.00 32.12 C ATOM 547 CG1 VAL A 33 -28.981 1.503 -29.366 1.00 1.20 C ATOM 548 CG2 VAL A 33 -27.649 0.742 -27.386 1.00 15.04 C ATOM 0 H VAL A 33 -25.750 1.941 -28.346 1.00 41.23 H new ATOM 0 HA VAL A 33 -27.940 3.845 -28.841 1.00 14.31 H new ATOM 0 HB VAL A 33 -29.224 2.176 -27.361 1.00 32.12 H new ATOM 0 HG11 VAL A 33 -29.633 0.639 -29.238 1.00 1.20 H new ATOM 0 HG12 VAL A 33 -29.555 2.334 -29.776 1.00 1.20 H new ATOM 0 HG13 VAL A 33 -28.172 1.248 -30.051 1.00 1.20 H new ATOM 0 HG21 VAL A 33 -28.319 -0.112 -27.286 1.00 15.04 H new ATOM 0 HG22 VAL A 33 -26.803 0.468 -28.017 1.00 15.04 H new ATOM 0 HG23 VAL A 33 -27.287 1.036 -26.401 1.00 15.04 H new ATOM 558 N ILE A 34 -28.251 4.545 -26.367 1.00 42.04 N ATOM 559 CA ILE A 34 -28.178 5.216 -25.075 1.00 34.14 C ATOM 560 C ILE A 34 -29.478 5.049 -24.295 1.00 73.30 C ATOM 561 O ILE A 34 -30.472 5.720 -24.574 1.00 75.30 O ATOM 562 CB ILE A 34 -27.880 6.718 -25.237 1.00 34.03 C ATOM 563 CG1 ILE A 34 -26.526 6.920 -25.921 1.00 11.33 C ATOM 564 CG2 ILE A 34 -27.905 7.412 -23.883 1.00 23.32 C ATOM 565 CD1 ILE A 34 -26.215 8.369 -26.228 1.00 33.43 C ATOM 0 H ILE A 34 -29.108 4.727 -26.889 1.00 42.04 H new ATOM 0 HA ILE A 34 -27.362 4.749 -24.523 1.00 34.14 H new ATOM 0 HB ILE A 34 -28.653 7.162 -25.865 1.00 34.03 H new ATOM 0 HG12 ILE A 34 -25.741 6.516 -25.282 1.00 11.33 H new ATOM 0 HG13 ILE A 34 -26.508 6.348 -26.849 1.00 11.33 H new ATOM 0 HG21 ILE A 34 -27.693 8.473 -24.014 1.00 23.32 H new ATOM 0 HG22 ILE A 34 -28.890 7.292 -23.431 1.00 23.32 H new ATOM 0 HG23 ILE A 34 -27.151 6.969 -23.233 1.00 23.32 H new ATOM 0 HD11 ILE A 34 -25.241 8.437 -26.712 1.00 33.43 H new ATOM 0 HD12 ILE A 34 -26.979 8.772 -26.892 1.00 33.43 H new ATOM 0 HD13 ILE A 34 -26.201 8.942 -25.301 1.00 33.43 H new ATOM 577 N CYS A 35 -29.463 4.151 -23.316 1.00 62.55 N ATOM 578 CA CYS A 35 -30.640 3.895 -22.494 1.00 33.14 C ATOM 579 C CYS A 35 -30.539 4.625 -21.159 1.00 32.00 C ATOM 580 O CYS A 35 -29.542 4.504 -20.448 1.00 21.30 O ATOM 581 CB CYS A 35 -30.806 2.393 -22.256 1.00 24.10 C ATOM 582 SG CYS A 35 -32.362 1.715 -22.877 1.00 54.22 S ATOM 0 H CYS A 35 -28.648 3.588 -23.072 1.00 62.55 H new ATOM 0 HA CYS A 35 -31.514 4.269 -23.028 1.00 33.14 H new ATOM 0 HB2 CYS A 35 -29.978 1.867 -22.731 1.00 24.10 H new ATOM 0 HB3 CYS A 35 -30.737 2.196 -21.186 1.00 24.10 H new ATOM 0 HG CYS A 35 -32.408 0.439 -22.631 1.00 54.22 H new ATOM 588 N GLU A 36 -31.579 5.384 -20.825 1.00 1.12 N ATOM 589 CA GLU A 36 -31.605 6.137 -19.576 1.00 72.31 C ATOM 590 C GLU A 36 -32.744 5.660 -18.679 1.00 10.45 C ATOM 591 O GLU A 36 -33.571 4.843 -19.086 1.00 23.35 O ATOM 592 CB GLU A 36 -31.754 7.633 -19.859 1.00 75.20 C ATOM 593 CG GLU A 36 -30.441 8.325 -20.182 1.00 14.34 C ATOM 594 CD GLU A 36 -30.553 9.837 -20.137 1.00 34.11 C ATOM 595 OE1 GLU A 36 -31.583 10.341 -19.641 1.00 71.52 O ATOM 596 OE2 GLU A 36 -29.611 10.516 -20.596 1.00 74.15 O ATOM 0 H GLU A 36 -32.413 5.493 -21.401 1.00 1.12 H new ATOM 0 HA GLU A 36 -30.661 5.967 -19.058 1.00 72.31 H new ATOM 0 HB2 GLU A 36 -32.442 7.770 -20.693 1.00 75.20 H new ATOM 0 HB3 GLU A 36 -32.205 8.115 -18.992 1.00 75.20 H new ATOM 0 HG2 GLU A 36 -29.679 7.999 -19.474 1.00 14.34 H new ATOM 0 HG3 GLU A 36 -30.107 8.018 -21.173 1.00 14.34 H new ATOM 603 N LYS A 37 -32.782 6.178 -17.455 1.00 64.44 N ATOM 604 CA LYS A 37 -33.817 5.808 -16.499 1.00 14.10 C ATOM 605 C LYS A 37 -34.908 6.873 -16.439 1.00 51.24 C ATOM 606 O LYS A 37 -34.632 8.045 -16.185 1.00 63.30 O ATOM 607 CB LYS A 37 -33.210 5.607 -15.109 1.00 3.31 C ATOM 608 CG LYS A 37 -32.332 6.762 -14.656 1.00 53.04 C ATOM 609 CD LYS A 37 -32.542 7.077 -13.185 1.00 23.15 C ATOM 610 CE LYS A 37 -31.877 8.389 -12.797 1.00 24.45 C ATOM 611 NZ LYS A 37 -31.977 8.650 -11.333 1.00 51.25 N ATOM 0 H LYS A 37 -32.106 6.856 -17.103 1.00 64.44 H new ATOM 0 HA LYS A 37 -34.265 4.871 -16.832 1.00 14.10 H new ATOM 0 HB2 LYS A 37 -34.015 5.468 -14.387 1.00 3.31 H new ATOM 0 HB3 LYS A 37 -32.620 4.691 -15.108 1.00 3.31 H new ATOM 0 HG2 LYS A 37 -31.285 6.515 -14.830 1.00 53.04 H new ATOM 0 HG3 LYS A 37 -32.554 7.646 -15.254 1.00 53.04 H new ATOM 0 HD2 LYS A 37 -33.610 7.132 -12.972 1.00 23.15 H new ATOM 0 HD3 LYS A 37 -32.137 6.268 -12.577 1.00 23.15 H new ATOM 0 HE2 LYS A 37 -30.828 8.365 -13.091 1.00 24.45 H new ATOM 0 HE3 LYS A 37 -32.343 9.208 -13.345 1.00 24.45 H new ATOM 0 HZ1 LYS A 37 -31.512 9.553 -11.109 1.00 51.25 H new ATOM 0 HZ2 LYS A 37 -32.978 8.698 -11.057 1.00 51.25 H new ATOM 0 HZ3 LYS A 37 -31.510 7.881 -10.811 1.00 51.25 H new ATOM 625 N ALA A 38 -36.148 6.457 -16.675 1.00 40.50 N ATOM 626 CA ALA A 38 -37.280 7.375 -16.645 1.00 53.51 C ATOM 627 C ALA A 38 -37.656 7.736 -15.212 1.00 0.23 C ATOM 628 O ALA A 38 -37.414 6.965 -14.284 1.00 74.22 O ATOM 629 CB ALA A 38 -38.473 6.767 -17.368 1.00 24.43 C ATOM 0 H ALA A 38 -36.394 5.491 -16.889 1.00 40.50 H new ATOM 0 HA ALA A 38 -36.986 8.291 -17.158 1.00 53.51 H new ATOM 0 HB1 ALA A 38 -39.311 7.464 -17.337 1.00 24.43 H new ATOM 0 HB2 ALA A 38 -38.206 6.566 -18.405 1.00 24.43 H new ATOM 0 HB3 ALA A 38 -38.758 5.835 -16.880 1.00 24.43 H new ATOM 635 N GLU A 39 -38.248 8.915 -15.038 1.00 70.54 N ATOM 636 CA GLU A 39 -38.655 9.376 -13.717 1.00 42.22 C ATOM 637 C GLU A 39 -40.034 8.835 -13.352 1.00 20.13 C ATOM 638 O GLU A 39 -40.348 8.644 -12.177 1.00 72.25 O ATOM 639 CB GLU A 39 -38.667 10.906 -13.669 1.00 4.30 C ATOM 640 CG GLU A 39 -39.145 11.469 -12.341 1.00 51.42 C ATOM 641 CD GLU A 39 -38.676 12.892 -12.109 1.00 10.54 C ATOM 642 OE1 GLU A 39 -38.865 13.733 -13.012 1.00 43.52 O ATOM 643 OE2 GLU A 39 -38.121 13.165 -11.023 1.00 14.10 O ATOM 0 H GLU A 39 -38.456 9.566 -15.795 1.00 70.54 H new ATOM 0 HA GLU A 39 -37.933 9.001 -12.991 1.00 42.22 H new ATOM 0 HB2 GLU A 39 -37.661 11.275 -13.870 1.00 4.30 H new ATOM 0 HB3 GLU A 39 -39.309 11.281 -14.466 1.00 4.30 H new ATOM 0 HG2 GLU A 39 -40.234 11.439 -12.309 1.00 51.42 H new ATOM 0 HG3 GLU A 39 -38.785 10.835 -11.531 1.00 51.42 H new ATOM 650 N LYS A 40 -40.854 8.591 -14.369 1.00 34.35 N ATOM 651 CA LYS A 40 -42.200 8.070 -14.157 1.00 1.14 C ATOM 652 C LYS A 40 -42.217 6.548 -14.250 1.00 44.15 C ATOM 653 O LYS A 40 -43.126 5.962 -14.837 1.00 54.21 O ATOM 654 CB LYS A 40 -43.166 8.666 -15.184 1.00 72.24 C ATOM 655 CG LYS A 40 -44.609 8.704 -14.711 1.00 34.40 C ATOM 656 CD LYS A 40 -45.540 9.204 -15.802 1.00 54.55 C ATOM 657 CE LYS A 40 -45.582 8.245 -16.982 1.00 55.20 C ATOM 658 NZ LYS A 40 -45.931 6.861 -16.560 1.00 34.25 N ATOM 0 H LYS A 40 -40.610 8.745 -15.347 1.00 34.35 H new ATOM 0 HA LYS A 40 -42.520 8.357 -13.155 1.00 1.14 H new ATOM 0 HB2 LYS A 40 -42.845 9.679 -15.427 1.00 72.24 H new ATOM 0 HB3 LYS A 40 -43.109 8.084 -16.104 1.00 72.24 H new ATOM 0 HG2 LYS A 40 -44.917 7.706 -14.398 1.00 34.40 H new ATOM 0 HG3 LYS A 40 -44.690 9.351 -13.838 1.00 34.40 H new ATOM 0 HD2 LYS A 40 -46.544 9.328 -15.396 1.00 54.55 H new ATOM 0 HD3 LYS A 40 -45.210 10.186 -16.141 1.00 54.55 H new ATOM 0 HE2 LYS A 40 -46.312 8.597 -17.710 1.00 55.20 H new ATOM 0 HE3 LYS A 40 -44.612 8.239 -17.480 1.00 55.20 H new ATOM 0 HZ1 LYS A 40 -46.548 6.425 -17.275 1.00 34.25 H new ATOM 0 HZ2 LYS A 40 -45.062 6.298 -16.463 1.00 34.25 H new ATOM 0 HZ3 LYS A 40 -46.427 6.891 -15.647 1.00 34.25 H new ATOM 672 N SER A 41 -41.204 5.913 -13.668 1.00 52.52 N ATOM 673 CA SER A 41 -41.101 4.459 -13.688 1.00 54.22 C ATOM 674 C SER A 41 -40.665 3.927 -12.326 1.00 72.44 C ATOM 675 O SER A 41 -39.642 4.343 -11.783 1.00 3.02 O ATOM 676 CB SER A 41 -40.110 4.011 -14.765 1.00 10.41 C ATOM 677 OG SER A 41 -38.853 4.643 -14.595 1.00 42.50 O ATOM 0 H SER A 41 -40.443 6.383 -13.177 1.00 52.52 H new ATOM 0 HA SER A 41 -42.086 4.053 -13.919 1.00 54.22 H new ATOM 0 HB2 SER A 41 -39.986 2.929 -14.722 1.00 10.41 H new ATOM 0 HB3 SER A 41 -40.509 4.247 -15.752 1.00 10.41 H new ATOM 0 HG SER A 41 -38.980 5.613 -14.538 1.00 42.50 H new ATOM 683 N ASP A 42 -41.449 3.002 -11.781 1.00 13.51 N ATOM 684 CA ASP A 42 -41.145 2.411 -10.483 1.00 42.13 C ATOM 685 C ASP A 42 -39.930 1.494 -10.576 1.00 60.43 C ATOM 686 O ASP A 42 -39.398 1.047 -9.558 1.00 43.32 O ATOM 687 CB ASP A 42 -42.351 1.629 -9.960 1.00 71.22 C ATOM 688 CG ASP A 42 -43.561 2.514 -9.734 1.00 3.13 C ATOM 689 OD1 ASP A 42 -43.670 3.099 -8.635 1.00 73.31 O ATOM 690 OD2 ASP A 42 -44.397 2.622 -10.654 1.00 3.30 O ATOM 0 H ASP A 42 -42.299 2.646 -12.218 1.00 13.51 H new ATOM 0 HA ASP A 42 -40.916 3.219 -9.788 1.00 42.13 H new ATOM 0 HB2 ASP A 42 -42.607 0.843 -10.671 1.00 71.22 H new ATOM 0 HB3 ASP A 42 -42.084 1.138 -9.024 1.00 71.22 H new ATOM 695 N ILE A 43 -39.495 1.216 -11.801 1.00 14.44 N ATOM 696 CA ILE A 43 -38.343 0.353 -12.025 1.00 72.24 C ATOM 697 C ILE A 43 -37.044 1.066 -11.664 1.00 72.35 C ATOM 698 O ILE A 43 -36.801 2.205 -12.061 1.00 60.41 O ATOM 699 CB ILE A 43 -38.268 -0.117 -13.489 1.00 44.43 C ATOM 700 CG1 ILE A 43 -37.323 -1.314 -13.617 1.00 0.25 C ATOM 701 CG2 ILE A 43 -37.813 1.022 -14.389 1.00 5.11 C ATOM 702 CD1 ILE A 43 -37.363 -1.973 -14.977 1.00 63.12 C ATOM 0 H ILE A 43 -39.924 1.577 -12.653 1.00 14.44 H new ATOM 0 HA ILE A 43 -38.469 -0.516 -11.379 1.00 72.24 H new ATOM 0 HB ILE A 43 -39.263 -0.429 -13.805 1.00 44.43 H new ATOM 0 HG12 ILE A 43 -36.304 -0.986 -13.411 1.00 0.25 H new ATOM 0 HG13 ILE A 43 -37.580 -2.052 -12.857 1.00 0.25 H new ATOM 0 HG21 ILE A 43 -37.765 0.674 -15.421 1.00 5.11 H new ATOM 0 HG22 ILE A 43 -38.521 1.848 -14.317 1.00 5.11 H new ATOM 0 HG23 ILE A 43 -36.826 1.362 -14.075 1.00 5.11 H new ATOM 0 HD11 ILE A 43 -36.669 -2.813 -14.995 1.00 63.12 H new ATOM 0 HD12 ILE A 43 -38.372 -2.332 -15.178 1.00 63.12 H new ATOM 0 HD13 ILE A 43 -37.077 -1.250 -15.740 1.00 63.12 H new ATOM 714 N PRO A 44 -36.186 0.378 -10.895 1.00 0.14 N ATOM 715 CA PRO A 44 -34.895 0.924 -10.466 1.00 53.01 C ATOM 716 C PRO A 44 -33.908 1.055 -11.620 1.00 60.34 C ATOM 717 O PRO A 44 -34.122 0.499 -12.697 1.00 21.20 O ATOM 718 CB PRO A 44 -34.396 -0.104 -9.448 1.00 63.24 C ATOM 719 CG PRO A 44 -35.067 -1.377 -9.834 1.00 41.14 C ATOM 720 CD PRO A 44 -36.410 -0.985 -10.385 1.00 52.14 C ATOM 0 HA PRO A 44 -34.993 1.931 -10.062 1.00 53.01 H new ATOM 0 HB2 PRO A 44 -33.311 -0.202 -9.484 1.00 63.24 H new ATOM 0 HB3 PRO A 44 -34.656 0.188 -8.431 1.00 63.24 H new ATOM 0 HG2 PRO A 44 -34.482 -1.917 -10.579 1.00 41.14 H new ATOM 0 HG3 PRO A 44 -35.176 -2.038 -8.974 1.00 41.14 H new ATOM 0 HD2 PRO A 44 -36.733 -1.662 -11.176 1.00 52.14 H new ATOM 0 HD3 PRO A 44 -37.181 -1.004 -9.615 1.00 52.14 H new ATOM 728 N GLU A 45 -32.826 1.791 -11.388 1.00 50.43 N ATOM 729 CA GLU A 45 -31.807 1.994 -12.411 1.00 61.51 C ATOM 730 C GLU A 45 -31.203 0.662 -12.848 1.00 43.42 C ATOM 731 O GLU A 45 -31.691 -0.405 -12.474 1.00 32.23 O ATOM 732 CB GLU A 45 -30.705 2.918 -11.888 1.00 51.41 C ATOM 733 CG GLU A 45 -30.212 3.921 -12.918 1.00 21.24 C ATOM 734 CD GLU A 45 -29.752 5.223 -12.291 1.00 72.11 C ATOM 735 OE1 GLU A 45 -29.515 5.239 -11.065 1.00 63.51 O ATOM 736 OE2 GLU A 45 -29.629 6.225 -13.026 1.00 11.01 O ATOM 0 H GLU A 45 -32.632 2.256 -10.501 1.00 50.43 H new ATOM 0 HA GLU A 45 -32.283 2.459 -13.274 1.00 61.51 H new ATOM 0 HB2 GLU A 45 -31.078 3.457 -11.017 1.00 51.41 H new ATOM 0 HB3 GLU A 45 -29.864 2.312 -11.552 1.00 51.41 H new ATOM 0 HG2 GLU A 45 -29.388 3.482 -13.481 1.00 21.24 H new ATOM 0 HG3 GLU A 45 -31.011 4.127 -13.630 1.00 21.24 H new ATOM 743 N ILE A 46 -30.141 0.734 -13.642 1.00 60.14 N ATOM 744 CA ILE A 46 -29.470 -0.465 -14.131 1.00 21.54 C ATOM 745 C ILE A 46 -27.955 -0.326 -14.034 1.00 1.51 C ATOM 746 O ILE A 46 -27.211 -1.071 -14.671 1.00 71.35 O ATOM 747 CB ILE A 46 -29.855 -0.770 -15.590 1.00 62.51 C ATOM 748 CG1 ILE A 46 -31.351 -0.541 -15.806 1.00 33.13 C ATOM 749 CG2 ILE A 46 -29.475 -2.199 -15.951 1.00 45.10 C ATOM 750 CD1 ILE A 46 -31.821 -0.880 -17.203 1.00 44.13 C ATOM 0 H ILE A 46 -29.726 1.610 -13.961 1.00 60.14 H new ATOM 0 HA ILE A 46 -29.797 -1.290 -13.498 1.00 21.54 H new ATOM 0 HB ILE A 46 -29.306 -0.092 -16.243 1.00 62.51 H new ATOM 0 HG12 ILE A 46 -31.909 -1.142 -15.088 1.00 33.13 H new ATOM 0 HG13 ILE A 46 -31.584 0.503 -15.597 1.00 33.13 H new ATOM 0 HG21 ILE A 46 -29.754 -2.399 -16.986 1.00 45.10 H new ATOM 0 HG22 ILE A 46 -28.399 -2.330 -15.833 1.00 45.10 H new ATOM 0 HG23 ILE A 46 -29.999 -2.892 -15.293 1.00 45.10 H new ATOM 0 HD11 ILE A 46 -32.892 -0.693 -17.282 1.00 44.13 H new ATOM 0 HD12 ILE A 46 -31.290 -0.261 -17.926 1.00 44.13 H new ATOM 0 HD13 ILE A 46 -31.620 -1.931 -17.409 1.00 44.13 H new ATOM 762 N ASP A 47 -27.504 0.632 -13.231 1.00 53.30 N ATOM 763 CA ASP A 47 -26.077 0.868 -13.048 1.00 2.33 C ATOM 764 C ASP A 47 -25.353 0.892 -14.390 1.00 53.44 C ATOM 765 O ASP A 47 -24.297 0.280 -14.549 1.00 74.03 O ATOM 766 CB ASP A 47 -25.472 -0.210 -12.147 1.00 11.24 C ATOM 767 CG ASP A 47 -25.997 -0.138 -10.726 1.00 72.41 C ATOM 768 OD1 ASP A 47 -25.453 0.656 -9.932 1.00 62.12 O ATOM 769 OD2 ASP A 47 -26.952 -0.879 -10.409 1.00 72.11 O ATOM 0 H ASP A 47 -28.107 1.258 -12.696 1.00 53.30 H new ATOM 0 HA ASP A 47 -25.953 1.841 -12.572 1.00 2.33 H new ATOM 0 HB2 ASP A 47 -25.692 -1.193 -12.563 1.00 11.24 H new ATOM 0 HB3 ASP A 47 -24.387 -0.104 -12.136 1.00 11.24 H new ATOM 774 N LYS A 48 -25.929 1.601 -15.354 1.00 54.34 N ATOM 775 CA LYS A 48 -25.341 1.706 -16.684 1.00 65.13 C ATOM 776 C LYS A 48 -25.913 2.900 -17.441 1.00 33.03 C ATOM 777 O LYS A 48 -26.990 3.398 -17.110 1.00 64.04 O ATOM 778 CB LYS A 48 -25.589 0.420 -17.477 1.00 24.44 C ATOM 779 CG LYS A 48 -24.367 -0.477 -17.576 1.00 74.55 C ATOM 780 CD LYS A 48 -23.220 0.219 -18.289 1.00 24.23 C ATOM 781 CE LYS A 48 -22.113 -0.759 -18.653 1.00 73.42 C ATOM 782 NZ LYS A 48 -21.188 -0.196 -19.674 1.00 2.11 N ATOM 0 H LYS A 48 -26.804 2.112 -15.239 1.00 54.34 H new ATOM 0 HA LYS A 48 -24.267 1.853 -16.567 1.00 65.13 H new ATOM 0 HB2 LYS A 48 -26.401 -0.136 -17.008 1.00 24.44 H new ATOM 0 HB3 LYS A 48 -25.921 0.681 -18.482 1.00 24.44 H new ATOM 0 HG2 LYS A 48 -24.049 -0.772 -16.576 1.00 74.55 H new ATOM 0 HG3 LYS A 48 -24.628 -1.391 -18.110 1.00 74.55 H new ATOM 0 HD2 LYS A 48 -23.592 0.702 -19.193 1.00 24.23 H new ATOM 0 HD3 LYS A 48 -22.817 1.005 -17.650 1.00 24.23 H new ATOM 0 HE2 LYS A 48 -21.550 -1.019 -17.757 1.00 73.42 H new ATOM 0 HE3 LYS A 48 -22.554 -1.681 -19.032 1.00 73.42 H new ATOM 0 HZ1 LYS A 48 -20.448 -0.893 -19.894 1.00 2.11 H new ATOM 0 HZ2 LYS A 48 -21.721 0.029 -20.539 1.00 2.11 H new ATOM 0 HZ3 LYS A 48 -20.748 0.670 -19.303 1.00 2.11 H new ATOM 796 N ARG A 49 -25.188 3.354 -18.458 1.00 64.23 N ATOM 797 CA ARG A 49 -25.624 4.489 -19.262 1.00 34.20 C ATOM 798 C ARG A 49 -25.599 4.145 -20.748 1.00 1.32 C ATOM 799 O ARG A 49 -26.644 4.060 -21.395 1.00 44.23 O ATOM 800 CB ARG A 49 -24.734 5.704 -18.993 1.00 74.21 C ATOM 801 CG ARG A 49 -24.914 6.294 -17.604 1.00 22.00 C ATOM 802 CD ARG A 49 -24.096 7.565 -17.430 1.00 53.00 C ATOM 803 NE ARG A 49 -24.649 8.434 -16.394 1.00 34.42 N ATOM 804 CZ ARG A 49 -25.736 9.179 -16.562 1.00 74.50 C ATOM 805 NH1 ARG A 49 -26.384 9.160 -17.718 1.00 2.30 N ATOM 806 NH2 ARG A 49 -26.178 9.943 -15.571 1.00 65.30 N ATOM 0 H ARG A 49 -24.295 2.953 -18.745 1.00 64.23 H new ATOM 0 HA ARG A 49 -26.649 4.729 -18.980 1.00 34.20 H new ATOM 0 HB2 ARG A 49 -23.691 5.416 -19.124 1.00 74.21 H new ATOM 0 HB3 ARG A 49 -24.948 6.472 -19.736 1.00 74.21 H new ATOM 0 HG2 ARG A 49 -25.968 6.512 -17.434 1.00 22.00 H new ATOM 0 HG3 ARG A 49 -24.615 5.561 -16.854 1.00 22.00 H new ATOM 0 HD2 ARG A 49 -23.069 7.303 -17.174 1.00 53.00 H new ATOM 0 HD3 ARG A 49 -24.060 8.106 -18.376 1.00 53.00 H new ATOM 0 HE ARG A 49 -24.174 8.471 -15.492 1.00 34.42 H new ATOM 0 HH11 ARG A 49 -26.048 8.572 -18.481 1.00 2.30 H new ATOM 0 HH12 ARG A 49 -27.218 9.733 -17.844 1.00 2.30 H new ATOM 0 HH21 ARG A 49 -25.683 9.959 -14.679 1.00 65.30 H new ATOM 0 HH22 ARG A 49 -27.013 10.515 -15.701 1.00 65.30 H new ATOM 820 N LYS A 50 -24.400 3.948 -21.284 1.00 44.14 N ATOM 821 CA LYS A 50 -24.236 3.613 -22.694 1.00 0.24 C ATOM 822 C LYS A 50 -24.277 2.103 -22.902 1.00 31.32 C ATOM 823 O LYS A 50 -23.808 1.337 -22.059 1.00 64.23 O ATOM 824 CB LYS A 50 -22.915 4.175 -23.223 1.00 50.41 C ATOM 825 CG LYS A 50 -22.777 5.677 -23.042 1.00 14.15 C ATOM 826 CD LYS A 50 -21.385 6.158 -23.416 1.00 44.53 C ATOM 827 CE LYS A 50 -21.123 7.564 -22.896 1.00 54.41 C ATOM 828 NZ LYS A 50 -21.890 8.588 -23.658 1.00 52.21 N ATOM 0 H LYS A 50 -23.526 4.015 -20.763 1.00 44.14 H new ATOM 0 HA LYS A 50 -25.062 4.061 -23.247 1.00 0.24 H new ATOM 0 HB2 LYS A 50 -22.089 3.679 -22.714 1.00 50.41 H new ATOM 0 HB3 LYS A 50 -22.826 3.936 -24.283 1.00 50.41 H new ATOM 0 HG2 LYS A 50 -23.517 6.188 -23.658 1.00 14.15 H new ATOM 0 HG3 LYS A 50 -22.988 5.940 -22.006 1.00 14.15 H new ATOM 0 HD2 LYS A 50 -20.641 5.474 -23.009 1.00 44.53 H new ATOM 0 HD3 LYS A 50 -21.273 6.143 -24.500 1.00 44.53 H new ATOM 0 HE2 LYS A 50 -21.394 7.618 -21.841 1.00 54.41 H new ATOM 0 HE3 LYS A 50 -20.057 7.784 -22.963 1.00 54.41 H new ATOM 0 HZ1 LYS A 50 -21.685 9.532 -23.274 1.00 52.21 H new ATOM 0 HZ2 LYS A 50 -21.614 8.554 -24.660 1.00 52.21 H new ATOM 0 HZ3 LYS A 50 -22.908 8.394 -23.573 1.00 52.21 H new ATOM 842 N TYR A 51 -24.840 1.681 -24.029 1.00 32.41 N ATOM 843 CA TYR A 51 -24.943 0.262 -24.347 1.00 33.24 C ATOM 844 C TYR A 51 -24.516 -0.006 -25.787 1.00 31.42 C ATOM 845 O TYR A 51 -24.735 0.818 -26.676 1.00 75.11 O ATOM 846 CB TYR A 51 -26.375 -0.229 -24.128 1.00 54.50 C ATOM 847 CG TYR A 51 -26.899 0.030 -22.734 1.00 22.22 C ATOM 848 CD1 TYR A 51 -27.500 1.240 -22.409 1.00 71.51 C ATOM 849 CD2 TYR A 51 -26.790 -0.935 -21.740 1.00 11.24 C ATOM 850 CE1 TYR A 51 -27.978 1.481 -21.136 1.00 32.12 C ATOM 851 CE2 TYR A 51 -27.267 -0.703 -20.463 1.00 43.15 C ATOM 852 CZ TYR A 51 -27.860 0.507 -20.167 1.00 72.32 C ATOM 853 OH TYR A 51 -28.335 0.742 -18.897 1.00 41.13 O ATOM 0 H TYR A 51 -25.232 2.302 -24.737 1.00 32.41 H new ATOM 0 HA TYR A 51 -24.274 -0.283 -23.681 1.00 33.24 H new ATOM 0 HB2 TYR A 51 -27.031 0.258 -24.850 1.00 54.50 H new ATOM 0 HB3 TYR A 51 -26.418 -1.299 -24.330 1.00 54.50 H new ATOM 0 HD1 TYR A 51 -27.595 2.005 -23.165 1.00 71.51 H new ATOM 0 HD2 TYR A 51 -26.325 -1.882 -21.969 1.00 11.24 H new ATOM 0 HE1 TYR A 51 -28.442 2.427 -20.901 1.00 32.12 H new ATOM 0 HE2 TYR A 51 -27.176 -1.464 -19.702 1.00 43.15 H new ATOM 0 HH TYR A 51 -28.174 -0.046 -18.337 1.00 41.13 H new ATOM 863 N LEU A 52 -23.906 -1.165 -26.009 1.00 61.14 N ATOM 864 CA LEU A 52 -23.447 -1.545 -27.341 1.00 50.24 C ATOM 865 C LEU A 52 -24.169 -2.797 -27.830 1.00 14.25 C ATOM 866 O LEU A 52 -24.030 -3.873 -27.249 1.00 43.33 O ATOM 867 CB LEU A 52 -21.936 -1.784 -27.333 1.00 41.53 C ATOM 868 CG LEU A 52 -21.123 -0.973 -28.342 1.00 45.54 C ATOM 869 CD1 LEU A 52 -19.861 -0.424 -27.693 1.00 12.11 C ATOM 870 CD2 LEU A 52 -20.774 -1.823 -29.554 1.00 53.14 C ATOM 0 H LEU A 52 -23.718 -1.858 -25.284 1.00 61.14 H new ATOM 0 HA LEU A 52 -23.675 -0.727 -28.024 1.00 50.24 H new ATOM 0 HB2 LEU A 52 -21.559 -1.566 -26.334 1.00 41.53 H new ATOM 0 HB3 LEU A 52 -21.755 -2.843 -27.518 1.00 41.53 H new ATOM 0 HG LEU A 52 -21.731 -0.132 -28.676 1.00 45.54 H new ATOM 0 HD11 LEU A 52 -19.295 0.150 -28.426 1.00 12.11 H new ATOM 0 HD12 LEU A 52 -20.133 0.221 -26.858 1.00 12.11 H new ATOM 0 HD13 LEU A 52 -19.250 -1.250 -27.329 1.00 12.11 H new ATOM 0 HD21 LEU A 52 -20.195 -1.228 -30.261 1.00 53.14 H new ATOM 0 HD22 LEU A 52 -20.186 -2.684 -29.237 1.00 53.14 H new ATOM 0 HD23 LEU A 52 -21.691 -2.166 -30.034 1.00 53.14 H new ATOM 882 N VAL A 53 -24.941 -2.648 -28.902 1.00 62.24 N ATOM 883 CA VAL A 53 -25.682 -3.768 -29.471 1.00 50.44 C ATOM 884 C VAL A 53 -25.302 -3.993 -30.930 1.00 72.14 C ATOM 885 O VAL A 53 -24.942 -3.065 -31.655 1.00 11.01 O ATOM 886 CB VAL A 53 -27.203 -3.539 -29.378 1.00 24.52 C ATOM 887 CG1 VAL A 53 -27.744 -4.085 -28.065 1.00 2.33 C ATOM 888 CG2 VAL A 53 -27.529 -2.060 -29.525 1.00 30.50 C ATOM 0 H VAL A 53 -25.070 -1.764 -29.394 1.00 62.24 H new ATOM 0 HA VAL A 53 -25.418 -4.651 -28.889 1.00 50.44 H new ATOM 0 HB VAL A 53 -27.686 -4.076 -30.195 1.00 24.52 H new ATOM 0 HG11 VAL A 53 -28.820 -3.915 -28.016 1.00 2.33 H new ATOM 0 HG12 VAL A 53 -27.543 -5.155 -28.005 1.00 2.33 H new ATOM 0 HG13 VAL A 53 -27.258 -3.577 -27.232 1.00 2.33 H new ATOM 0 HG21 VAL A 53 -28.607 -1.917 -29.457 1.00 30.50 H new ATOM 0 HG22 VAL A 53 -27.037 -1.498 -28.731 1.00 30.50 H new ATOM 0 HG23 VAL A 53 -27.176 -1.704 -30.493 1.00 30.50 H new ATOM 898 N PRO A 54 -25.384 -5.257 -31.374 1.00 42.52 N ATOM 899 CA PRO A 54 -25.054 -5.634 -32.752 1.00 1.12 C ATOM 900 C PRO A 54 -26.074 -5.111 -33.756 1.00 52.43 C ATOM 901 O PRO A 54 -27.230 -4.866 -33.412 1.00 10.44 O ATOM 902 CB PRO A 54 -25.075 -7.164 -32.715 1.00 75.23 C ATOM 903 CG PRO A 54 -25.987 -7.503 -31.586 1.00 4.31 C ATOM 904 CD PRO A 54 -25.805 -6.413 -30.566 1.00 4.54 C ATOM 0 HA PRO A 54 -24.100 -5.215 -33.072 1.00 1.12 H new ATOM 0 HB2 PRO A 54 -25.439 -7.578 -33.656 1.00 75.23 H new ATOM 0 HB3 PRO A 54 -24.076 -7.570 -32.553 1.00 75.23 H new ATOM 0 HG2 PRO A 54 -27.023 -7.554 -31.922 1.00 4.31 H new ATOM 0 HG3 PRO A 54 -25.741 -8.477 -31.164 1.00 4.31 H new ATOM 0 HD2 PRO A 54 -26.729 -6.210 -30.025 1.00 4.54 H new ATOM 0 HD3 PRO A 54 -25.053 -6.679 -29.823 1.00 4.54 H new ATOM 912 N ALA A 55 -25.640 -4.943 -35.001 1.00 40.04 N ATOM 913 CA ALA A 55 -26.516 -4.451 -36.057 1.00 73.13 C ATOM 914 C ALA A 55 -27.650 -5.434 -36.331 1.00 14.43 C ATOM 915 O ALA A 55 -28.628 -5.098 -36.999 1.00 1.20 O ATOM 916 CB ALA A 55 -25.720 -4.194 -37.328 1.00 32.31 C ATOM 0 H ALA A 55 -24.686 -5.141 -35.303 1.00 40.04 H new ATOM 0 HA ALA A 55 -26.956 -3.512 -35.721 1.00 73.13 H new ATOM 0 HB1 ALA A 55 -26.388 -3.827 -38.108 1.00 32.31 H new ATOM 0 HB2 ALA A 55 -24.949 -3.449 -37.130 1.00 32.31 H new ATOM 0 HB3 ALA A 55 -25.252 -5.121 -37.658 1.00 32.31 H new ATOM 922 N ASP A 56 -27.513 -6.648 -35.810 1.00 14.35 N ATOM 923 CA ASP A 56 -28.526 -7.679 -35.997 1.00 74.43 C ATOM 924 C ASP A 56 -29.320 -7.902 -34.714 1.00 25.42 C ATOM 925 O ASP A 56 -29.952 -8.944 -34.535 1.00 12.20 O ATOM 926 CB ASP A 56 -27.875 -8.989 -36.444 1.00 23.21 C ATOM 927 CG ASP A 56 -26.955 -9.567 -35.386 1.00 34.22 C ATOM 928 OD1 ASP A 56 -25.759 -9.209 -35.379 1.00 52.14 O ATOM 929 OD2 ASP A 56 -27.431 -10.378 -34.565 1.00 13.00 O ATOM 0 H ASP A 56 -26.710 -6.942 -35.255 1.00 14.35 H new ATOM 0 HA ASP A 56 -29.213 -7.341 -36.773 1.00 74.43 H new ATOM 0 HB2 ASP A 56 -28.652 -9.715 -36.682 1.00 23.21 H new ATOM 0 HB3 ASP A 56 -27.309 -8.817 -37.359 1.00 23.21 H new ATOM 934 N LEU A 57 -29.280 -6.919 -33.822 1.00 41.43 N ATOM 935 CA LEU A 57 -29.994 -7.008 -32.553 1.00 53.42 C ATOM 936 C LEU A 57 -31.466 -6.649 -32.730 1.00 41.42 C ATOM 937 O LEU A 57 -31.808 -5.737 -33.484 1.00 1.21 O ATOM 938 CB LEU A 57 -29.353 -6.082 -31.518 1.00 2.44 C ATOM 939 CG LEU A 57 -29.557 -6.468 -30.053 1.00 15.33 C ATOM 940 CD1 LEU A 57 -30.975 -6.140 -29.607 1.00 71.43 C ATOM 941 CD2 LEU A 57 -29.260 -7.946 -29.845 1.00 24.25 C ATOM 0 H LEU A 57 -28.761 -6.051 -33.954 1.00 41.43 H new ATOM 0 HA LEU A 57 -29.930 -8.037 -32.200 1.00 53.42 H new ATOM 0 HB2 LEU A 57 -28.282 -6.037 -31.715 1.00 2.44 H new ATOM 0 HB3 LEU A 57 -29.747 -5.077 -31.666 1.00 2.44 H new ATOM 0 HG LEU A 57 -28.863 -5.889 -29.444 1.00 15.33 H new ATOM 0 HD11 LEU A 57 -31.102 -6.422 -28.562 1.00 71.43 H new ATOM 0 HD12 LEU A 57 -31.153 -5.071 -29.719 1.00 71.43 H new ATOM 0 HD13 LEU A 57 -31.686 -6.693 -30.221 1.00 71.43 H new ATOM 0 HD21 LEU A 57 -29.410 -8.203 -28.797 1.00 24.25 H new ATOM 0 HD22 LEU A 57 -29.930 -8.542 -30.465 1.00 24.25 H new ATOM 0 HD23 LEU A 57 -28.227 -8.152 -30.125 1.00 24.25 H new ATOM 953 N THR A 58 -32.335 -7.370 -32.028 1.00 34.21 N ATOM 954 CA THR A 58 -33.769 -7.127 -32.107 1.00 14.32 C ATOM 955 C THR A 58 -34.323 -6.662 -30.765 1.00 15.00 C ATOM 956 O THR A 58 -33.749 -6.945 -29.714 1.00 33.43 O ATOM 957 CB THR A 58 -34.530 -8.391 -32.552 1.00 63.33 C ATOM 958 OG1 THR A 58 -34.360 -9.432 -31.583 1.00 11.23 O ATOM 959 CG2 THR A 58 -34.036 -8.869 -33.909 1.00 53.41 C ATOM 0 H THR A 58 -32.070 -8.127 -31.398 1.00 34.21 H new ATOM 0 HA THR A 58 -33.915 -6.343 -32.850 1.00 14.32 H new ATOM 0 HB THR A 58 -35.588 -8.142 -32.635 1.00 63.33 H new ATOM 0 HG1 THR A 58 -34.848 -10.231 -31.872 1.00 11.23 H new ATOM 0 HG21 THR A 58 -34.587 -9.762 -34.203 1.00 53.41 H new ATOM 0 HG22 THR A 58 -34.193 -8.085 -34.650 1.00 53.41 H new ATOM 0 HG23 THR A 58 -32.973 -9.102 -33.848 1.00 53.41 H new ATOM 967 N VAL A 59 -35.443 -5.946 -30.808 1.00 24.02 N ATOM 968 CA VAL A 59 -36.074 -5.442 -29.594 1.00 32.32 C ATOM 969 C VAL A 59 -36.256 -6.554 -28.567 1.00 11.22 C ATOM 970 O VAL A 59 -35.910 -6.395 -27.397 1.00 72.31 O ATOM 971 CB VAL A 59 -37.446 -4.810 -29.896 1.00 43.03 C ATOM 972 CG1 VAL A 59 -38.142 -4.401 -28.608 1.00 32.42 C ATOM 973 CG2 VAL A 59 -37.288 -3.617 -30.828 1.00 30.02 C ATOM 0 H VAL A 59 -35.931 -5.702 -31.670 1.00 24.02 H new ATOM 0 HA VAL A 59 -35.411 -4.679 -29.186 1.00 32.32 H new ATOM 0 HB VAL A 59 -38.067 -5.554 -30.395 1.00 43.03 H new ATOM 0 HG11 VAL A 59 -39.109 -3.957 -28.842 1.00 32.42 H new ATOM 0 HG12 VAL A 59 -38.289 -5.279 -27.979 1.00 32.42 H new ATOM 0 HG13 VAL A 59 -37.528 -3.673 -28.078 1.00 32.42 H new ATOM 0 HG21 VAL A 59 -38.267 -3.182 -31.031 1.00 30.02 H new ATOM 0 HG22 VAL A 59 -36.649 -2.870 -30.357 1.00 30.02 H new ATOM 0 HG23 VAL A 59 -36.835 -3.944 -31.764 1.00 30.02 H new ATOM 983 N GLY A 60 -36.801 -7.682 -29.013 1.00 62.53 N ATOM 984 CA GLY A 60 -37.018 -8.806 -28.120 1.00 3.43 C ATOM 985 C GLY A 60 -35.740 -9.267 -27.448 1.00 73.41 C ATOM 986 O GLY A 60 -35.717 -9.501 -26.240 1.00 43.15 O ATOM 0 H GLY A 60 -37.096 -7.838 -29.977 1.00 62.53 H new ATOM 0 HA2 GLY A 60 -37.745 -8.526 -27.358 1.00 3.43 H new ATOM 0 HA3 GLY A 60 -37.449 -9.635 -28.682 1.00 3.43 H new ATOM 990 N GLN A 61 -34.676 -9.401 -28.233 1.00 62.11 N ATOM 991 CA GLN A 61 -33.389 -9.841 -27.706 1.00 11.00 C ATOM 992 C GLN A 61 -32.912 -8.917 -26.591 1.00 1.54 C ATOM 993 O GLN A 61 -32.409 -9.372 -25.564 1.00 34.51 O ATOM 994 CB GLN A 61 -32.346 -9.891 -28.824 1.00 33.44 C ATOM 995 CG GLN A 61 -31.326 -11.005 -28.654 1.00 21.50 C ATOM 996 CD GLN A 61 -30.234 -10.961 -29.705 1.00 32.22 C ATOM 997 OE1 GLN A 61 -29.048 -10.883 -29.381 1.00 73.01 O ATOM 998 NE2 GLN A 61 -30.629 -11.012 -30.971 1.00 43.14 N ATOM 0 H GLN A 61 -34.679 -9.211 -29.235 1.00 62.11 H new ATOM 0 HA GLN A 61 -33.517 -10.842 -27.293 1.00 11.00 H new ATOM 0 HB2 GLN A 61 -32.855 -10.018 -29.779 1.00 33.44 H new ATOM 0 HB3 GLN A 61 -31.824 -8.935 -28.866 1.00 33.44 H new ATOM 0 HG2 GLN A 61 -30.876 -10.932 -27.664 1.00 21.50 H new ATOM 0 HG3 GLN A 61 -31.834 -11.968 -28.703 1.00 21.50 H new ATOM 0 HE21 GLN A 61 -31.622 -11.076 -31.193 1.00 43.14 H new ATOM 0 HE22 GLN A 61 -29.939 -10.987 -31.722 1.00 43.14 H new ATOM 1007 N PHE A 62 -33.073 -7.614 -26.800 1.00 50.53 N ATOM 1008 CA PHE A 62 -32.658 -6.624 -25.813 1.00 51.41 C ATOM 1009 C PHE A 62 -33.578 -6.650 -24.596 1.00 52.34 C ATOM 1010 O PHE A 62 -33.117 -6.644 -23.455 1.00 42.44 O ATOM 1011 CB PHE A 62 -32.654 -5.225 -26.434 1.00 44.12 C ATOM 1012 CG PHE A 62 -31.689 -4.280 -25.775 1.00 73.15 C ATOM 1013 CD1 PHE A 62 -30.325 -4.408 -25.980 1.00 0.22 C ATOM 1014 CD2 PHE A 62 -32.147 -3.264 -24.952 1.00 50.11 C ATOM 1015 CE1 PHE A 62 -29.435 -3.540 -25.375 1.00 34.40 C ATOM 1016 CE2 PHE A 62 -31.262 -2.393 -24.344 1.00 62.32 C ATOM 1017 CZ PHE A 62 -29.904 -2.531 -24.556 1.00 72.24 C ATOM 0 H PHE A 62 -33.488 -7.219 -27.644 1.00 50.53 H new ATOM 0 HA PHE A 62 -31.648 -6.873 -25.488 1.00 51.41 H new ATOM 0 HB2 PHE A 62 -32.405 -5.306 -27.492 1.00 44.12 H new ATOM 0 HB3 PHE A 62 -33.659 -4.806 -26.374 1.00 44.12 H new ATOM 0 HD1 PHE A 62 -29.953 -5.195 -26.620 1.00 0.22 H new ATOM 0 HD2 PHE A 62 -33.208 -3.151 -24.783 1.00 50.11 H new ATOM 0 HE1 PHE A 62 -28.374 -3.651 -25.543 1.00 34.40 H new ATOM 0 HE2 PHE A 62 -31.632 -1.606 -23.704 1.00 62.32 H new ATOM 0 HZ PHE A 62 -29.211 -1.852 -24.083 1.00 72.24 H new ATOM 1027 N VAL A 63 -34.883 -6.678 -24.849 1.00 71.23 N ATOM 1028 CA VAL A 63 -35.869 -6.705 -23.775 1.00 71.14 C ATOM 1029 C VAL A 63 -35.616 -7.873 -22.827 1.00 40.31 C ATOM 1030 O VAL A 63 -35.821 -7.759 -21.618 1.00 72.12 O ATOM 1031 CB VAL A 63 -37.301 -6.811 -24.331 1.00 54.02 C ATOM 1032 CG1 VAL A 63 -38.304 -6.958 -23.197 1.00 73.03 C ATOM 1033 CG2 VAL A 63 -37.629 -5.600 -25.191 1.00 25.01 C ATOM 0 H VAL A 63 -35.282 -6.683 -25.788 1.00 71.23 H new ATOM 0 HA VAL A 63 -35.768 -5.768 -23.228 1.00 71.14 H new ATOM 0 HB VAL A 63 -37.365 -7.701 -24.958 1.00 54.02 H new ATOM 0 HG11 VAL A 63 -39.311 -7.031 -23.609 1.00 73.03 H new ATOM 0 HG12 VAL A 63 -38.079 -7.859 -22.626 1.00 73.03 H new ATOM 0 HG13 VAL A 63 -38.243 -6.089 -22.542 1.00 73.03 H new ATOM 0 HG21 VAL A 63 -38.645 -5.691 -25.576 1.00 25.01 H new ATOM 0 HG22 VAL A 63 -37.549 -4.694 -24.590 1.00 25.01 H new ATOM 0 HG23 VAL A 63 -36.929 -5.545 -26.025 1.00 25.01 H new ATOM 1043 N TYR A 64 -35.170 -8.993 -23.382 1.00 44.35 N ATOM 1044 CA TYR A 64 -34.891 -10.183 -22.586 1.00 45.14 C ATOM 1045 C TYR A 64 -33.626 -9.997 -21.754 1.00 3.42 C ATOM 1046 O TYR A 64 -33.470 -10.605 -20.695 1.00 73.22 O ATOM 1047 CB TYR A 64 -34.741 -11.405 -23.494 1.00 74.01 C ATOM 1048 CG TYR A 64 -36.061 -12.012 -23.913 1.00 61.43 C ATOM 1049 CD1 TYR A 64 -37.029 -12.338 -22.971 1.00 5.02 C ATOM 1050 CD2 TYR A 64 -36.339 -12.262 -25.251 1.00 52.33 C ATOM 1051 CE1 TYR A 64 -38.236 -12.894 -23.349 1.00 62.13 C ATOM 1052 CE2 TYR A 64 -37.544 -12.816 -25.639 1.00 23.51 C ATOM 1053 CZ TYR A 64 -38.489 -13.131 -24.684 1.00 2.22 C ATOM 1054 OH TYR A 64 -39.689 -13.684 -25.066 1.00 34.11 O ATOM 0 H TYR A 64 -34.993 -9.103 -24.381 1.00 44.35 H new ATOM 0 HA TYR A 64 -35.730 -10.341 -21.909 1.00 45.14 H new ATOM 0 HB2 TYR A 64 -34.183 -11.119 -24.385 1.00 74.01 H new ATOM 0 HB3 TYR A 64 -34.150 -12.161 -22.977 1.00 74.01 H new ATOM 0 HD1 TYR A 64 -36.834 -12.154 -21.925 1.00 5.02 H new ATOM 0 HD2 TYR A 64 -35.601 -12.019 -26.001 1.00 52.33 H new ATOM 0 HE1 TYR A 64 -38.977 -13.142 -22.603 1.00 62.13 H new ATOM 0 HE2 TYR A 64 -37.745 -13.001 -26.684 1.00 23.51 H new ATOM 0 HH TYR A 64 -39.707 -13.784 -26.041 1.00 34.11 H new ATOM 1064 N VAL A 65 -32.725 -9.149 -22.239 1.00 3.52 N ATOM 1065 CA VAL A 65 -31.474 -8.879 -21.540 1.00 40.31 C ATOM 1066 C VAL A 65 -31.695 -7.932 -20.365 1.00 11.02 C ATOM 1067 O VAL A 65 -31.068 -8.073 -19.315 1.00 63.12 O ATOM 1068 CB VAL A 65 -30.423 -8.269 -22.486 1.00 22.35 C ATOM 1069 CG1 VAL A 65 -29.315 -7.594 -21.690 1.00 13.15 C ATOM 1070 CG2 VAL A 65 -29.853 -9.337 -23.406 1.00 63.04 C ATOM 0 H VAL A 65 -32.838 -8.637 -23.114 1.00 3.52 H new ATOM 0 HA VAL A 65 -31.106 -9.835 -21.168 1.00 40.31 H new ATOM 0 HB VAL A 65 -30.909 -7.512 -23.101 1.00 22.35 H new ATOM 0 HG11 VAL A 65 -28.582 -7.169 -22.375 1.00 13.15 H new ATOM 0 HG12 VAL A 65 -29.740 -6.800 -21.075 1.00 13.15 H new ATOM 0 HG13 VAL A 65 -28.829 -8.329 -21.048 1.00 13.15 H new ATOM 0 HG21 VAL A 65 -29.112 -8.889 -24.068 1.00 63.04 H new ATOM 0 HG22 VAL A 65 -29.382 -10.118 -22.809 1.00 63.04 H new ATOM 0 HG23 VAL A 65 -30.656 -9.771 -24.001 1.00 63.04 H new ATOM 1080 N ILE A 66 -32.590 -6.967 -20.550 1.00 30.00 N ATOM 1081 CA ILE A 66 -32.894 -5.998 -19.504 1.00 74.03 C ATOM 1082 C ILE A 66 -33.234 -6.694 -18.192 1.00 34.14 C ATOM 1083 O ILE A 66 -32.612 -6.438 -17.161 1.00 42.11 O ATOM 1084 CB ILE A 66 -34.066 -5.085 -19.908 1.00 14.34 C ATOM 1085 CG1 ILE A 66 -33.613 -4.070 -20.959 1.00 23.11 C ATOM 1086 CG2 ILE A 66 -34.629 -4.373 -18.686 1.00 22.32 C ATOM 1087 CD1 ILE A 66 -32.599 -3.075 -20.441 1.00 25.01 C ATOM 0 H ILE A 66 -33.117 -6.835 -21.414 1.00 30.00 H new ATOM 0 HA ILE A 66 -32.000 -5.389 -19.367 1.00 74.03 H new ATOM 0 HB ILE A 66 -34.854 -5.702 -20.341 1.00 14.34 H new ATOM 0 HG12 ILE A 66 -33.185 -4.604 -21.807 1.00 23.11 H new ATOM 0 HG13 ILE A 66 -34.484 -3.529 -21.329 1.00 23.11 H new ATOM 0 HG21 ILE A 66 -35.457 -3.731 -18.988 1.00 22.32 H new ATOM 0 HG22 ILE A 66 -34.985 -5.111 -17.967 1.00 22.32 H new ATOM 0 HG23 ILE A 66 -33.849 -3.766 -18.227 1.00 22.32 H new ATOM 0 HD11 ILE A 66 -32.324 -2.387 -21.240 1.00 25.01 H new ATOM 0 HD12 ILE A 66 -33.030 -2.514 -19.612 1.00 25.01 H new ATOM 0 HD13 ILE A 66 -31.711 -3.606 -20.097 1.00 25.01 H new ATOM 1099 N ARG A 67 -34.226 -7.578 -18.236 1.00 52.13 N ATOM 1100 CA ARG A 67 -34.650 -8.313 -17.051 1.00 23.22 C ATOM 1101 C ARG A 67 -33.459 -8.980 -16.370 1.00 4.24 C ATOM 1102 O ARG A 67 -33.418 -9.103 -15.146 1.00 0.21 O ATOM 1103 CB ARG A 67 -35.694 -9.367 -17.424 1.00 63.50 C ATOM 1104 CG ARG A 67 -35.095 -10.644 -17.991 1.00 3.14 C ATOM 1105 CD ARG A 67 -36.080 -11.368 -18.894 1.00 52.42 C ATOM 1106 NE ARG A 67 -35.591 -12.684 -19.295 1.00 30.04 N ATOM 1107 CZ ARG A 67 -36.378 -13.656 -19.744 1.00 20.04 C ATOM 1108 NH1 ARG A 67 -37.685 -13.459 -19.849 1.00 64.22 N ATOM 1109 NH2 ARG A 67 -35.857 -14.826 -20.088 1.00 30.42 N ATOM 0 H ARG A 67 -34.751 -7.802 -19.081 1.00 52.13 H new ATOM 0 HA ARG A 67 -35.094 -7.603 -16.354 1.00 23.22 H new ATOM 0 HB2 ARG A 67 -36.282 -9.613 -16.540 1.00 63.50 H new ATOM 0 HB3 ARG A 67 -36.381 -8.942 -18.155 1.00 63.50 H new ATOM 0 HG2 ARG A 67 -34.192 -10.405 -18.553 1.00 3.14 H new ATOM 0 HG3 ARG A 67 -34.797 -11.302 -17.174 1.00 3.14 H new ATOM 0 HD2 ARG A 67 -37.033 -11.478 -18.376 1.00 52.42 H new ATOM 0 HD3 ARG A 67 -36.268 -10.765 -19.782 1.00 52.42 H new ATOM 0 HE ARG A 67 -34.590 -12.867 -19.227 1.00 30.04 H new ATOM 0 HH11 ARG A 67 -38.088 -12.560 -19.585 1.00 64.22 H new ATOM 0 HH12 ARG A 67 -38.287 -14.206 -20.194 1.00 64.22 H new ATOM 0 HH21 ARG A 67 -34.852 -14.980 -20.008 1.00 30.42 H new ATOM 0 HH22 ARG A 67 -36.461 -15.572 -20.433 1.00 30.42 H new ATOM 1123 N LYS A 68 -32.490 -9.409 -17.171 1.00 71.54 N ATOM 1124 CA LYS A 68 -31.296 -10.064 -16.648 1.00 51.31 C ATOM 1125 C LYS A 68 -30.366 -9.052 -15.989 1.00 44.44 C ATOM 1126 O LYS A 68 -29.691 -9.361 -15.007 1.00 71.22 O ATOM 1127 CB LYS A 68 -30.557 -10.797 -17.771 1.00 13.40 C ATOM 1128 CG LYS A 68 -29.326 -11.549 -17.298 1.00 34.43 C ATOM 1129 CD LYS A 68 -28.893 -12.600 -18.307 1.00 41.34 C ATOM 1130 CE LYS A 68 -27.882 -13.565 -17.707 1.00 71.24 C ATOM 1131 NZ LYS A 68 -28.537 -14.589 -16.846 1.00 2.41 N ATOM 0 H LYS A 68 -32.508 -9.315 -18.186 1.00 71.54 H new ATOM 0 HA LYS A 68 -31.609 -10.788 -15.895 1.00 51.31 H new ATOM 0 HB2 LYS A 68 -31.241 -11.499 -18.247 1.00 13.40 H new ATOM 0 HB3 LYS A 68 -30.261 -10.075 -18.532 1.00 13.40 H new ATOM 0 HG2 LYS A 68 -28.510 -10.845 -17.131 1.00 34.43 H new ATOM 0 HG3 LYS A 68 -29.536 -12.027 -16.341 1.00 34.43 H new ATOM 0 HD2 LYS A 68 -29.765 -13.154 -18.654 1.00 41.34 H new ATOM 0 HD3 LYS A 68 -28.458 -12.112 -19.179 1.00 41.34 H new ATOM 0 HE2 LYS A 68 -27.333 -14.061 -18.508 1.00 71.24 H new ATOM 0 HE3 LYS A 68 -27.153 -13.008 -17.119 1.00 71.24 H new ATOM 0 HZ1 LYS A 68 -27.815 -15.228 -16.456 1.00 2.41 H new ATOM 0 HZ2 LYS A 68 -29.040 -14.118 -16.067 1.00 2.41 H new ATOM 0 HZ3 LYS A 68 -29.214 -15.138 -17.413 1.00 2.41 H new ATOM 1145 N ARG A 69 -30.334 -7.840 -16.535 1.00 54.10 N ATOM 1146 CA ARG A 69 -29.487 -6.782 -16.000 1.00 22.42 C ATOM 1147 C ARG A 69 -30.064 -6.229 -14.700 1.00 1.40 C ATOM 1148 O ARG A 69 -29.340 -6.031 -13.723 1.00 32.32 O ATOM 1149 CB ARG A 69 -29.333 -5.654 -17.022 1.00 74.51 C ATOM 1150 CG ARG A 69 -28.614 -6.079 -18.293 1.00 13.03 C ATOM 1151 CD ARG A 69 -27.108 -6.127 -18.089 1.00 65.53 C ATOM 1152 NE ARG A 69 -26.414 -6.656 -19.260 1.00 40.33 N ATOM 1153 CZ ARG A 69 -25.108 -6.523 -19.464 1.00 34.43 C ATOM 1154 NH1 ARG A 69 -24.358 -5.883 -18.577 1.00 43.22 N ATOM 1155 NH2 ARG A 69 -24.550 -7.032 -20.555 1.00 24.32 N ATOM 0 H ARG A 69 -30.886 -7.567 -17.348 1.00 54.10 H new ATOM 0 HA ARG A 69 -28.506 -7.209 -15.791 1.00 22.42 H new ATOM 0 HB2 ARG A 69 -30.321 -5.274 -17.283 1.00 74.51 H new ATOM 0 HB3 ARG A 69 -28.786 -4.831 -16.563 1.00 74.51 H new ATOM 0 HG2 ARG A 69 -28.972 -7.060 -18.604 1.00 13.03 H new ATOM 0 HG3 ARG A 69 -28.852 -5.383 -19.097 1.00 13.03 H new ATOM 0 HD2 ARG A 69 -26.739 -5.125 -17.871 1.00 65.53 H new ATOM 0 HD3 ARG A 69 -26.879 -6.746 -17.222 1.00 65.53 H new ATOM 0 HE ARG A 69 -26.962 -7.155 -19.960 1.00 40.33 H new ATOM 0 HH11 ARG A 69 -24.784 -5.492 -17.737 1.00 43.22 H new ATOM 0 HH12 ARG A 69 -23.355 -5.782 -18.735 1.00 43.22 H new ATOM 0 HH21 ARG A 69 -25.124 -7.526 -21.238 1.00 24.32 H new ATOM 0 HH22 ARG A 69 -23.547 -6.929 -20.710 1.00 24.32 H new ATOM 1169 N ILE A 70 -31.369 -5.980 -14.696 1.00 51.13 N ATOM 1170 CA ILE A 70 -32.042 -5.449 -13.517 1.00 61.22 C ATOM 1171 C ILE A 70 -32.454 -6.571 -12.569 1.00 20.35 C ATOM 1172 O ILE A 70 -33.088 -6.327 -11.543 1.00 31.42 O ATOM 1173 CB ILE A 70 -33.291 -4.633 -13.900 1.00 64.54 C ATOM 1174 CG1 ILE A 70 -32.994 -3.747 -15.112 1.00 42.41 C ATOM 1175 CG2 ILE A 70 -33.755 -3.791 -12.722 1.00 43.43 C ATOM 1176 CD1 ILE A 70 -34.150 -2.853 -15.505 1.00 21.43 C ATOM 0 H ILE A 70 -31.982 -6.137 -15.496 1.00 51.13 H new ATOM 0 HA ILE A 70 -31.330 -4.794 -13.016 1.00 61.22 H new ATOM 0 HB ILE A 70 -34.092 -5.323 -14.165 1.00 64.54 H new ATOM 0 HG12 ILE A 70 -32.124 -3.128 -14.895 1.00 42.41 H new ATOM 0 HG13 ILE A 70 -32.731 -4.380 -15.959 1.00 42.41 H new ATOM 0 HG21 ILE A 70 -34.638 -3.220 -13.008 1.00 43.43 H new ATOM 0 HG22 ILE A 70 -34.000 -4.443 -11.883 1.00 43.43 H new ATOM 0 HG23 ILE A 70 -32.960 -3.106 -12.429 1.00 43.43 H new ATOM 0 HD11 ILE A 70 -33.868 -2.254 -16.371 1.00 21.43 H new ATOM 0 HD12 ILE A 70 -35.016 -3.466 -15.754 1.00 21.43 H new ATOM 0 HD13 ILE A 70 -34.399 -2.194 -14.673 1.00 21.43 H new ATOM 1188 N MET A 71 -32.087 -7.799 -12.919 1.00 44.12 N ATOM 1189 CA MET A 71 -32.415 -8.958 -12.097 1.00 12.33 C ATOM 1190 C MET A 71 -33.913 -9.020 -11.818 1.00 53.13 C ATOM 1191 O MET A 71 -34.346 -9.586 -10.814 1.00 23.31 O ATOM 1192 CB MET A 71 -31.641 -8.910 -10.778 1.00 74.14 C ATOM 1193 CG MET A 71 -30.209 -8.425 -10.931 1.00 70.22 C ATOM 1194 SD MET A 71 -29.208 -9.524 -11.952 1.00 20.40 S ATOM 1195 CE MET A 71 -27.790 -9.777 -10.889 1.00 11.14 C ATOM 0 H MET A 71 -31.562 -8.017 -13.766 1.00 44.12 H new ATOM 0 HA MET A 71 -32.128 -9.855 -12.646 1.00 12.33 H new ATOM 0 HB2 MET A 71 -32.165 -8.255 -10.082 1.00 74.14 H new ATOM 0 HB3 MET A 71 -31.633 -9.906 -10.334 1.00 74.14 H new ATOM 0 HG2 MET A 71 -30.212 -7.428 -11.372 1.00 70.22 H new ATOM 0 HG3 MET A 71 -29.753 -8.335 -9.945 1.00 70.22 H new ATOM 0 HE1 MET A 71 -27.078 -10.438 -11.383 1.00 11.14 H new ATOM 0 HE2 MET A 71 -27.313 -8.818 -10.684 1.00 11.14 H new ATOM 0 HE3 MET A 71 -28.114 -10.229 -9.951 1.00 11.14 H new ATOM 1205 N LEU A 72 -34.701 -8.435 -12.714 1.00 14.14 N ATOM 1206 CA LEU A 72 -36.153 -8.423 -12.564 1.00 70.13 C ATOM 1207 C LEU A 72 -36.733 -9.817 -12.781 1.00 14.24 C ATOM 1208 O LEU A 72 -36.346 -10.543 -13.696 1.00 63.15 O ATOM 1209 CB LEU A 72 -36.779 -7.438 -13.552 1.00 43.23 C ATOM 1210 CG LEU A 72 -38.039 -6.717 -13.074 1.00 41.31 C ATOM 1211 CD1 LEU A 72 -37.755 -5.930 -11.804 1.00 22.41 C ATOM 1212 CD2 LEU A 72 -38.575 -5.799 -14.163 1.00 11.03 C ATOM 0 H LEU A 72 -34.360 -7.963 -13.551 1.00 14.14 H new ATOM 0 HA LEU A 72 -36.387 -8.106 -11.548 1.00 70.13 H new ATOM 0 HB2 LEU A 72 -36.031 -6.688 -13.809 1.00 43.23 H new ATOM 0 HB3 LEU A 72 -37.019 -7.977 -14.469 1.00 43.23 H new ATOM 0 HG LEU A 72 -38.799 -7.466 -12.851 1.00 41.31 H new ATOM 0 HD11 LEU A 72 -38.664 -5.424 -11.479 1.00 22.41 H new ATOM 0 HD12 LEU A 72 -37.419 -6.611 -11.022 1.00 22.41 H new ATOM 0 HD13 LEU A 72 -36.978 -5.191 -12.000 1.00 22.41 H new ATOM 0 HD21 LEU A 72 -39.472 -5.294 -13.804 1.00 11.03 H new ATOM 0 HD22 LEU A 72 -37.819 -5.057 -14.418 1.00 11.03 H new ATOM 0 HD23 LEU A 72 -38.819 -6.387 -15.048 1.00 11.03 H new ATOM 1224 N PRO A 73 -37.688 -10.201 -11.920 1.00 23.34 N ATOM 1225 CA PRO A 73 -38.345 -11.509 -11.997 1.00 42.34 C ATOM 1226 C PRO A 73 -39.256 -11.628 -13.214 1.00 14.23 C ATOM 1227 O PRO A 73 -39.651 -10.634 -13.824 1.00 22.01 O ATOM 1228 CB PRO A 73 -39.164 -11.572 -10.706 1.00 44.44 C ATOM 1229 CG PRO A 73 -39.413 -10.148 -10.345 1.00 24.32 C ATOM 1230 CD PRO A 73 -38.199 -9.387 -10.804 1.00 13.34 C ATOM 0 HA PRO A 73 -37.626 -12.321 -12.100 1.00 42.34 H new ATOM 0 HB2 PRO A 73 -40.099 -12.112 -10.856 1.00 44.44 H new ATOM 0 HB3 PRO A 73 -38.620 -12.091 -9.917 1.00 44.44 H new ATOM 0 HG2 PRO A 73 -40.315 -9.774 -10.830 1.00 24.32 H new ATOM 0 HG3 PRO A 73 -39.560 -10.038 -9.271 1.00 24.32 H new ATOM 0 HD2 PRO A 73 -38.456 -8.378 -11.127 1.00 13.34 H new ATOM 0 HD3 PRO A 73 -37.461 -9.289 -10.008 1.00 13.34 H new ATOM 1238 N PRO A 74 -39.602 -12.872 -13.576 1.00 34.32 N ATOM 1239 CA PRO A 74 -40.474 -13.150 -14.721 1.00 51.04 C ATOM 1240 C PRO A 74 -41.915 -12.716 -14.472 1.00 65.44 C ATOM 1241 O PRO A 74 -42.676 -12.496 -15.413 1.00 42.01 O ATOM 1242 CB PRO A 74 -40.391 -14.671 -14.869 1.00 71.22 C ATOM 1243 CG PRO A 74 -40.040 -15.166 -13.508 1.00 3.24 C ATOM 1244 CD PRO A 74 -39.171 -14.103 -12.894 1.00 22.42 C ATOM 0 HA PRO A 74 -40.163 -12.604 -15.612 1.00 51.04 H new ATOM 0 HB2 PRO A 74 -41.339 -15.088 -15.209 1.00 71.22 H new ATOM 0 HB3 PRO A 74 -39.636 -14.957 -15.601 1.00 71.22 H new ATOM 0 HG2 PRO A 74 -40.936 -15.332 -12.910 1.00 3.24 H new ATOM 0 HG3 PRO A 74 -39.512 -16.118 -13.563 1.00 3.24 H new ATOM 0 HD2 PRO A 74 -39.318 -14.037 -11.816 1.00 22.42 H new ATOM 0 HD3 PRO A 74 -38.113 -14.304 -13.060 1.00 22.42 H new ATOM 1252 N GLU A 75 -42.280 -12.597 -13.201 1.00 11.12 N ATOM 1253 CA GLU A 75 -43.630 -12.189 -12.830 1.00 74.23 C ATOM 1254 C GLU A 75 -44.034 -10.912 -13.561 1.00 72.24 C ATOM 1255 O GLU A 75 -45.211 -10.692 -13.847 1.00 51.13 O ATOM 1256 CB GLU A 75 -43.727 -11.976 -11.317 1.00 63.24 C ATOM 1257 CG GLU A 75 -43.372 -13.210 -10.505 1.00 1.33 C ATOM 1258 CD GLU A 75 -44.111 -13.269 -9.182 1.00 22.22 C ATOM 1259 OE1 GLU A 75 -43.863 -12.394 -8.326 1.00 21.00 O ATOM 1260 OE2 GLU A 75 -44.935 -14.189 -9.003 1.00 33.04 O ATOM 0 H GLU A 75 -41.661 -12.777 -12.411 1.00 11.12 H new ATOM 0 HA GLU A 75 -44.314 -12.986 -13.122 1.00 74.23 H new ATOM 0 HB2 GLU A 75 -43.064 -11.160 -11.030 1.00 63.24 H new ATOM 0 HB3 GLU A 75 -44.741 -11.666 -11.066 1.00 63.24 H new ATOM 0 HG2 GLU A 75 -43.604 -14.102 -11.087 1.00 1.33 H new ATOM 0 HG3 GLU A 75 -42.298 -13.221 -10.318 1.00 1.33 H new ATOM 1267 N LYS A 76 -43.048 -10.073 -13.862 1.00 34.14 N ATOM 1268 CA LYS A 76 -43.298 -8.818 -14.561 1.00 34.33 C ATOM 1269 C LYS A 76 -42.415 -8.700 -15.799 1.00 44.11 C ATOM 1270 O LYS A 76 -41.227 -9.018 -15.757 1.00 53.52 O ATOM 1271 CB LYS A 76 -43.047 -7.633 -13.627 1.00 0.32 C ATOM 1272 CG LYS A 76 -43.941 -7.625 -12.399 1.00 51.02 C ATOM 1273 CD LYS A 76 -44.187 -6.211 -11.896 1.00 64.53 C ATOM 1274 CE LYS A 76 -42.922 -5.602 -11.310 1.00 62.24 C ATOM 1275 NZ LYS A 76 -43.080 -4.144 -11.047 1.00 74.55 N ATOM 0 H LYS A 76 -42.068 -10.240 -13.633 1.00 34.14 H new ATOM 0 HA LYS A 76 -44.341 -8.808 -14.878 1.00 34.33 H new ATOM 0 HB2 LYS A 76 -42.005 -7.648 -13.307 1.00 0.32 H new ATOM 0 HB3 LYS A 76 -43.197 -6.706 -14.181 1.00 0.32 H new ATOM 0 HG2 LYS A 76 -44.894 -8.098 -12.638 1.00 51.02 H new ATOM 0 HG3 LYS A 76 -43.481 -8.218 -11.609 1.00 51.02 H new ATOM 0 HD2 LYS A 76 -44.546 -5.589 -12.716 1.00 64.53 H new ATOM 0 HD3 LYS A 76 -44.971 -6.224 -11.139 1.00 64.53 H new ATOM 0 HE2 LYS A 76 -42.669 -6.113 -10.381 1.00 62.24 H new ATOM 0 HE3 LYS A 76 -42.091 -5.759 -11.997 1.00 62.24 H new ATOM 0 HZ1 LYS A 76 -42.197 -3.766 -10.648 1.00 74.55 H new ATOM 0 HZ2 LYS A 76 -43.297 -3.652 -11.937 1.00 74.55 H new ATOM 0 HZ3 LYS A 76 -43.857 -3.995 -10.372 1.00 74.55 H new ATOM 1289 N ALA A 77 -43.004 -8.240 -16.898 1.00 22.35 N ATOM 1290 CA ALA A 77 -42.269 -8.077 -18.147 1.00 12.15 C ATOM 1291 C ALA A 77 -41.666 -6.680 -18.250 1.00 1.22 C ATOM 1292 O ALA A 77 -41.641 -5.930 -17.273 1.00 20.10 O ATOM 1293 CB ALA A 77 -43.180 -8.350 -19.334 1.00 70.30 C ATOM 0 H ALA A 77 -43.987 -7.974 -16.949 1.00 22.35 H new ATOM 0 HA ALA A 77 -41.452 -8.798 -18.157 1.00 12.15 H new ATOM 0 HB1 ALA A 77 -42.619 -8.225 -20.260 1.00 70.30 H new ATOM 0 HB2 ALA A 77 -43.559 -9.370 -19.275 1.00 70.30 H new ATOM 0 HB3 ALA A 77 -44.016 -7.651 -19.319 1.00 70.30 H new ATOM 1299 N ILE A 78 -41.182 -6.336 -19.438 1.00 11.52 N ATOM 1300 CA ILE A 78 -40.580 -5.029 -19.668 1.00 0.01 C ATOM 1301 C ILE A 78 -40.530 -4.700 -21.156 1.00 73.45 C ATOM 1302 O ILE A 78 -40.537 -5.596 -22.002 1.00 11.14 O ATOM 1303 CB ILE A 78 -39.154 -4.956 -19.091 1.00 4.10 C ATOM 1304 CG1 ILE A 78 -38.663 -3.507 -19.065 1.00 40.33 C ATOM 1305 CG2 ILE A 78 -38.208 -5.827 -19.904 1.00 10.30 C ATOM 1306 CD1 ILE A 78 -37.816 -3.177 -17.857 1.00 10.12 C ATOM 0 H ILE A 78 -41.195 -6.944 -20.257 1.00 11.52 H new ATOM 0 HA ILE A 78 -41.208 -4.299 -19.157 1.00 0.01 H new ATOM 0 HB ILE A 78 -39.173 -5.331 -18.068 1.00 4.10 H new ATOM 0 HG12 ILE A 78 -38.085 -3.312 -19.968 1.00 40.33 H new ATOM 0 HG13 ILE A 78 -39.525 -2.840 -19.088 1.00 40.33 H new ATOM 0 HG21 ILE A 78 -37.204 -5.765 -19.484 1.00 10.30 H new ATOM 0 HG22 ILE A 78 -38.550 -6.862 -19.875 1.00 10.30 H new ATOM 0 HG23 ILE A 78 -38.191 -5.480 -20.937 1.00 10.30 H new ATOM 0 HD11 ILE A 78 -37.504 -2.134 -17.906 1.00 10.12 H new ATOM 0 HD12 ILE A 78 -38.397 -3.340 -16.950 1.00 10.12 H new ATOM 0 HD13 ILE A 78 -36.935 -3.819 -17.844 1.00 10.12 H new ATOM 1318 N PHE A 79 -40.479 -3.410 -21.471 1.00 20.52 N ATOM 1319 CA PHE A 79 -40.427 -2.962 -22.857 1.00 62.32 C ATOM 1320 C PHE A 79 -39.711 -1.620 -22.969 1.00 5.41 C ATOM 1321 O PHE A 79 -40.014 -0.680 -22.233 1.00 64.12 O ATOM 1322 CB PHE A 79 -41.841 -2.848 -23.432 1.00 21.43 C ATOM 1323 CG PHE A 79 -42.887 -2.554 -22.396 1.00 4.14 C ATOM 1324 CD1 PHE A 79 -43.514 -3.583 -21.712 1.00 64.22 C ATOM 1325 CD2 PHE A 79 -43.245 -1.247 -22.105 1.00 43.12 C ATOM 1326 CE1 PHE A 79 -44.476 -3.316 -20.758 1.00 31.02 C ATOM 1327 CE2 PHE A 79 -44.206 -0.973 -21.151 1.00 31.32 C ATOM 1328 CZ PHE A 79 -44.824 -2.008 -20.477 1.00 62.42 C ATOM 0 H PHE A 79 -40.473 -2.656 -20.784 1.00 20.52 H new ATOM 0 HA PHE A 79 -39.867 -3.701 -23.430 1.00 62.32 H new ATOM 0 HB2 PHE A 79 -41.856 -2.060 -24.185 1.00 21.43 H new ATOM 0 HB3 PHE A 79 -42.095 -3.779 -23.939 1.00 21.43 H new ATOM 0 HD1 PHE A 79 -43.247 -4.607 -21.928 1.00 64.22 H new ATOM 0 HD2 PHE A 79 -42.767 -0.433 -22.630 1.00 43.12 H new ATOM 0 HE1 PHE A 79 -44.956 -4.128 -20.232 1.00 31.02 H new ATOM 0 HE2 PHE A 79 -44.474 0.050 -20.932 1.00 31.32 H new ATOM 0 HZ PHE A 79 -45.577 -1.796 -19.732 1.00 62.42 H new ATOM 1338 N ILE A 80 -38.761 -1.538 -23.894 1.00 62.33 N ATOM 1339 CA ILE A 80 -38.002 -0.311 -24.103 1.00 52.05 C ATOM 1340 C ILE A 80 -38.695 0.600 -25.111 1.00 34.15 C ATOM 1341 O ILE A 80 -39.183 0.143 -26.145 1.00 30.41 O ATOM 1342 CB ILE A 80 -36.573 -0.609 -24.596 1.00 72.23 C ATOM 1343 CG1 ILE A 80 -36.617 -1.432 -25.885 1.00 51.04 C ATOM 1344 CG2 ILE A 80 -35.784 -1.341 -23.521 1.00 43.01 C ATOM 1345 CD1 ILE A 80 -35.862 -0.798 -27.033 1.00 62.20 C ATOM 0 H ILE A 80 -38.498 -2.307 -24.511 1.00 62.33 H new ATOM 0 HA ILE A 80 -37.947 0.193 -23.138 1.00 52.05 H new ATOM 0 HB ILE A 80 -36.072 0.336 -24.807 1.00 72.23 H new ATOM 0 HG12 ILE A 80 -36.202 -2.421 -25.690 1.00 51.04 H new ATOM 0 HG13 ILE A 80 -37.657 -1.575 -26.180 1.00 51.04 H new ATOM 0 HG21 ILE A 80 -34.777 -1.545 -23.884 1.00 43.01 H new ATOM 0 HG22 ILE A 80 -35.729 -0.722 -22.625 1.00 43.01 H new ATOM 0 HG23 ILE A 80 -36.280 -2.282 -23.282 1.00 43.01 H new ATOM 0 HD11 ILE A 80 -35.936 -1.436 -27.914 1.00 62.20 H new ATOM 0 HD12 ILE A 80 -36.291 0.179 -27.255 1.00 62.20 H new ATOM 0 HD13 ILE A 80 -34.814 -0.680 -26.758 1.00 62.20 H new ATOM 1357 N PHE A 81 -38.735 1.892 -24.802 1.00 74.40 N ATOM 1358 CA PHE A 81 -39.368 2.868 -25.681 1.00 53.44 C ATOM 1359 C PHE A 81 -38.326 3.600 -26.521 1.00 4.11 C ATOM 1360 O PHE A 81 -37.140 3.605 -26.193 1.00 64.33 O ATOM 1361 CB PHE A 81 -40.178 3.875 -24.861 1.00 31.25 C ATOM 1362 CG PHE A 81 -41.298 3.248 -24.079 1.00 2.21 C ATOM 1363 CD1 PHE A 81 -41.042 2.578 -22.895 1.00 72.52 C ATOM 1364 CD2 PHE A 81 -42.605 3.332 -24.530 1.00 35.23 C ATOM 1365 CE1 PHE A 81 -42.070 2.000 -22.173 1.00 34.20 C ATOM 1366 CE2 PHE A 81 -43.638 2.757 -23.813 1.00 4.21 C ATOM 1367 CZ PHE A 81 -43.370 2.089 -22.634 1.00 2.34 C ATOM 0 H PHE A 81 -38.337 2.287 -23.950 1.00 74.40 H new ATOM 0 HA PHE A 81 -40.040 2.333 -26.353 1.00 53.44 H new ATOM 0 HB2 PHE A 81 -39.510 4.392 -24.172 1.00 31.25 H new ATOM 0 HB3 PHE A 81 -40.591 4.629 -25.531 1.00 31.25 H new ATOM 0 HD1 PHE A 81 -40.028 2.506 -22.531 1.00 72.52 H new ATOM 0 HD2 PHE A 81 -42.820 3.852 -25.452 1.00 35.23 H new ATOM 0 HE1 PHE A 81 -41.858 1.480 -21.251 1.00 34.20 H new ATOM 0 HE2 PHE A 81 -44.653 2.830 -24.174 1.00 4.21 H new ATOM 0 HZ PHE A 81 -44.175 1.637 -22.073 1.00 2.34 H new ATOM 1377 N VAL A 82 -38.779 4.219 -27.607 1.00 42.11 N ATOM 1378 CA VAL A 82 -37.886 4.956 -28.495 1.00 32.41 C ATOM 1379 C VAL A 82 -38.584 6.174 -29.087 1.00 51.55 C ATOM 1380 O VAL A 82 -39.460 6.046 -29.943 1.00 20.22 O ATOM 1381 CB VAL A 82 -37.372 4.064 -29.640 1.00 12.32 C ATOM 1382 CG1 VAL A 82 -38.533 3.378 -30.345 1.00 32.44 C ATOM 1383 CG2 VAL A 82 -36.550 4.882 -30.624 1.00 22.35 C ATOM 0 H VAL A 82 -39.758 4.225 -27.893 1.00 42.11 H new ATOM 0 HA VAL A 82 -37.039 5.284 -27.893 1.00 32.41 H new ATOM 0 HB VAL A 82 -36.729 3.293 -29.216 1.00 12.32 H new ATOM 0 HG11 VAL A 82 -38.150 2.752 -31.151 1.00 32.44 H new ATOM 0 HG12 VAL A 82 -39.077 2.759 -29.632 1.00 32.44 H new ATOM 0 HG13 VAL A 82 -39.204 4.131 -30.758 1.00 32.44 H new ATOM 0 HG21 VAL A 82 -36.195 4.236 -31.427 1.00 22.35 H new ATOM 0 HG22 VAL A 82 -37.169 5.675 -31.044 1.00 22.35 H new ATOM 0 HG23 VAL A 82 -35.697 5.322 -30.108 1.00 22.35 H new ATOM 1393 N ASN A 83 -38.190 7.358 -28.628 1.00 31.32 N ATOM 1394 CA ASN A 83 -38.779 8.600 -29.113 1.00 50.45 C ATOM 1395 C ASN A 83 -40.292 8.598 -28.921 1.00 75.04 C ATOM 1396 O ASN A 83 -41.049 8.813 -29.869 1.00 64.44 O ATOM 1397 CB ASN A 83 -38.441 8.806 -30.592 1.00 30.54 C ATOM 1398 CG ASN A 83 -37.153 9.580 -30.788 1.00 44.23 C ATOM 1399 OD1 ASN A 83 -36.191 9.407 -30.040 1.00 2.34 O ATOM 1400 ND2 ASN A 83 -37.128 10.440 -31.801 1.00 23.23 N ATOM 0 H ASN A 83 -37.465 7.483 -27.921 1.00 31.32 H new ATOM 0 HA ASN A 83 -38.359 9.422 -28.533 1.00 50.45 H new ATOM 0 HB2 ASN A 83 -38.357 7.836 -31.081 1.00 30.54 H new ATOM 0 HB3 ASN A 83 -39.259 9.338 -31.078 1.00 30.54 H new ATOM 0 HD21 ASN A 83 -36.288 10.989 -31.984 1.00 23.23 H new ATOM 0 HD22 ASN A 83 -37.949 10.551 -32.396 1.00 23.23 H new ATOM 1407 N ASP A 84 -40.727 8.353 -27.690 1.00 64.32 N ATOM 1408 CA ASP A 84 -42.150 8.324 -27.373 1.00 61.22 C ATOM 1409 C ASP A 84 -42.882 7.314 -28.253 1.00 2.44 C ATOM 1410 O ASP A 84 -44.066 7.475 -28.547 1.00 13.51 O ATOM 1411 CB ASP A 84 -42.762 9.714 -27.551 1.00 31.50 C ATOM 1412 CG ASP A 84 -41.763 10.824 -27.295 1.00 40.51 C ATOM 1413 OD1 ASP A 84 -40.998 10.719 -26.314 1.00 64.22 O ATOM 1414 OD2 ASP A 84 -41.746 11.799 -28.076 1.00 21.03 O ATOM 0 H ASP A 84 -40.114 8.172 -26.895 1.00 64.32 H new ATOM 0 HA ASP A 84 -42.260 8.018 -26.332 1.00 61.22 H new ATOM 0 HB2 ASP A 84 -43.154 9.808 -28.564 1.00 31.50 H new ATOM 0 HB3 ASP A 84 -43.607 9.826 -26.871 1.00 31.50 H new ATOM 1419 N THR A 85 -42.168 6.273 -28.670 1.00 0.41 N ATOM 1420 CA THR A 85 -42.748 5.240 -29.518 1.00 33.44 C ATOM 1421 C THR A 85 -42.400 3.847 -29.003 1.00 12.33 C ATOM 1422 O THR A 85 -41.310 3.623 -28.477 1.00 21.42 O ATOM 1423 CB THR A 85 -42.266 5.370 -30.974 1.00 42.53 C ATOM 1424 OG1 THR A 85 -42.375 6.731 -31.405 1.00 44.45 O ATOM 1425 CG2 THR A 85 -43.079 4.475 -31.896 1.00 12.11 C ATOM 0 H THR A 85 -41.187 6.123 -28.434 1.00 0.41 H new ATOM 0 HA THR A 85 -43.829 5.378 -29.488 1.00 33.44 H new ATOM 0 HB THR A 85 -41.223 5.057 -31.018 1.00 42.53 H new ATOM 0 HG1 THR A 85 -41.756 7.288 -30.889 1.00 44.45 H new ATOM 0 HG21 THR A 85 -42.720 4.584 -32.919 1.00 12.11 H new ATOM 0 HG22 THR A 85 -42.972 3.437 -31.583 1.00 12.11 H new ATOM 0 HG23 THR A 85 -44.130 4.762 -31.848 1.00 12.11 H new ATOM 1433 N LEU A 86 -43.334 2.915 -29.157 1.00 34.42 N ATOM 1434 CA LEU A 86 -43.126 1.542 -28.707 1.00 61.13 C ATOM 1435 C LEU A 86 -43.305 0.559 -29.860 1.00 2.44 C ATOM 1436 O LEU A 86 -44.385 0.010 -30.077 1.00 70.41 O ATOM 1437 CB LEU A 86 -44.097 1.202 -27.576 1.00 23.12 C ATOM 1438 CG LEU A 86 -43.753 -0.034 -26.745 1.00 30.43 C ATOM 1439 CD1 LEU A 86 -42.686 0.297 -25.713 1.00 24.52 C ATOM 1440 CD2 LEU A 86 -45.000 -0.586 -26.068 1.00 23.34 C ATOM 0 H LEU A 86 -44.242 3.084 -29.590 1.00 34.42 H new ATOM 0 HA LEU A 86 -42.104 1.458 -28.337 1.00 61.13 H new ATOM 0 HB2 LEU A 86 -44.158 2.060 -26.906 1.00 23.12 H new ATOM 0 HB3 LEU A 86 -45.089 1.062 -28.006 1.00 23.12 H new ATOM 0 HG LEU A 86 -43.358 -0.799 -27.413 1.00 30.43 H new ATOM 0 HD11 LEU A 86 -42.454 -0.595 -25.131 1.00 24.52 H new ATOM 0 HD12 LEU A 86 -41.785 0.644 -26.219 1.00 24.52 H new ATOM 0 HD13 LEU A 86 -43.053 1.079 -25.048 1.00 24.52 H new ATOM 0 HD21 LEU A 86 -44.736 -1.466 -25.481 1.00 23.34 H new ATOM 0 HD22 LEU A 86 -45.425 0.174 -25.412 1.00 23.34 H new ATOM 0 HD23 LEU A 86 -45.733 -0.862 -26.826 1.00 23.34 H new ATOM 1452 N PRO A 87 -42.221 0.330 -30.616 1.00 62.51 N ATOM 1453 CA PRO A 87 -42.233 -0.591 -31.757 1.00 44.34 C ATOM 1454 C PRO A 87 -42.362 -2.048 -31.327 1.00 5.15 C ATOM 1455 O PRO A 87 -42.231 -2.386 -30.149 1.00 45.22 O ATOM 1456 CB PRO A 87 -40.875 -0.348 -32.422 1.00 51.34 C ATOM 1457 CG PRO A 87 -40.003 0.161 -31.327 1.00 44.52 C ATOM 1458 CD PRO A 87 -40.900 0.950 -30.415 1.00 34.32 C ATOM 0 HA PRO A 87 -43.084 -0.414 -32.414 1.00 44.34 H new ATOM 0 HB2 PRO A 87 -40.475 -1.266 -32.852 1.00 51.34 H new ATOM 0 HB3 PRO A 87 -40.955 0.376 -33.233 1.00 51.34 H new ATOM 0 HG2 PRO A 87 -39.529 -0.662 -30.792 1.00 44.52 H new ATOM 0 HG3 PRO A 87 -39.203 0.786 -31.724 1.00 44.52 H new ATOM 0 HD2 PRO A 87 -40.578 0.881 -29.376 1.00 34.32 H new ATOM 0 HD3 PRO A 87 -40.909 2.008 -30.677 1.00 34.32 H new ATOM 1466 N PRO A 88 -42.624 -2.932 -32.300 1.00 22.24 N ATOM 1467 CA PRO A 88 -42.775 -4.368 -32.044 1.00 1.35 C ATOM 1468 C PRO A 88 -41.456 -5.031 -31.662 1.00 44.35 C ATOM 1469 O PRO A 88 -40.387 -4.433 -31.793 1.00 35.42 O ATOM 1470 CB PRO A 88 -43.281 -4.915 -33.381 1.00 61.04 C ATOM 1471 CG PRO A 88 -42.788 -3.944 -34.398 1.00 52.13 C ATOM 1472 CD PRO A 88 -42.792 -2.600 -33.724 1.00 72.10 C ATOM 0 HA PRO A 88 -43.444 -4.564 -31.206 1.00 1.35 H new ATOM 0 HB2 PRO A 88 -42.895 -5.917 -33.570 1.00 61.04 H new ATOM 0 HB3 PRO A 88 -44.369 -4.984 -33.394 1.00 61.04 H new ATOM 0 HG2 PRO A 88 -41.786 -4.208 -34.736 1.00 52.13 H new ATOM 0 HG3 PRO A 88 -43.431 -3.941 -35.278 1.00 52.13 H new ATOM 0 HD2 PRO A 88 -41.983 -1.966 -34.087 1.00 72.10 H new ATOM 0 HD3 PRO A 88 -43.723 -2.063 -33.904 1.00 72.10 H new ATOM 1480 N THR A 89 -41.537 -6.271 -31.190 1.00 24.24 N ATOM 1481 CA THR A 89 -40.349 -7.015 -30.788 1.00 73.24 C ATOM 1482 C THR A 89 -39.492 -7.375 -31.996 1.00 2.21 C ATOM 1483 O THR A 89 -38.267 -7.259 -31.955 1.00 70.45 O ATOM 1484 CB THR A 89 -40.723 -8.306 -30.035 1.00 52.33 C ATOM 1485 OG1 THR A 89 -42.148 -8.443 -29.974 1.00 42.15 O ATOM 1486 CG2 THR A 89 -40.149 -8.297 -28.627 1.00 11.00 C ATOM 0 H THR A 89 -42.413 -6.781 -31.077 1.00 24.24 H new ATOM 0 HA THR A 89 -39.780 -6.367 -30.122 1.00 73.24 H new ATOM 0 HB THR A 89 -40.300 -9.152 -30.577 1.00 52.33 H new ATOM 0 HG1 THR A 89 -42.377 -9.267 -29.495 1.00 42.15 H new ATOM 0 HG21 THR A 89 -40.426 -9.219 -28.115 1.00 11.00 H new ATOM 0 HG22 THR A 89 -39.063 -8.223 -28.677 1.00 11.00 H new ATOM 0 HG23 THR A 89 -40.546 -7.443 -28.078 1.00 11.00 H new ATOM 1494 N ALA A 90 -40.143 -7.810 -33.069 1.00 64.14 N ATOM 1495 CA ALA A 90 -39.438 -8.184 -34.289 1.00 75.22 C ATOM 1496 C ALA A 90 -38.647 -7.007 -34.849 1.00 43.00 C ATOM 1497 O ALA A 90 -37.732 -7.188 -35.653 1.00 31.33 O ATOM 1498 CB ALA A 90 -40.422 -8.703 -35.328 1.00 10.22 C ATOM 0 H ALA A 90 -41.157 -7.912 -33.119 1.00 64.14 H new ATOM 0 HA ALA A 90 -38.732 -8.978 -34.043 1.00 75.22 H new ATOM 0 HB1 ALA A 90 -39.883 -8.979 -36.234 1.00 10.22 H new ATOM 0 HB2 ALA A 90 -40.940 -9.577 -34.934 1.00 10.22 H new ATOM 0 HB3 ALA A 90 -41.149 -7.925 -35.561 1.00 10.22 H new ATOM 1504 N ALA A 91 -39.005 -5.801 -34.420 1.00 74.22 N ATOM 1505 CA ALA A 91 -38.328 -4.595 -34.878 1.00 43.24 C ATOM 1506 C ALA A 91 -36.815 -4.727 -34.733 1.00 2.15 C ATOM 1507 O ALA A 91 -36.309 -5.032 -33.652 1.00 41.52 O ATOM 1508 CB ALA A 91 -38.830 -3.383 -34.107 1.00 41.25 C ATOM 0 H ALA A 91 -39.761 -5.634 -33.756 1.00 74.22 H new ATOM 0 HA ALA A 91 -38.555 -4.459 -35.935 1.00 43.24 H new ATOM 0 HB1 ALA A 91 -38.316 -2.489 -34.459 1.00 41.25 H new ATOM 0 HB2 ALA A 91 -39.903 -3.270 -34.264 1.00 41.25 H new ATOM 0 HB3 ALA A 91 -38.632 -3.520 -33.044 1.00 41.25 H new ATOM 1514 N LEU A 92 -36.098 -4.496 -35.827 1.00 12.24 N ATOM 1515 CA LEU A 92 -34.642 -4.589 -35.822 1.00 34.11 C ATOM 1516 C LEU A 92 -34.016 -3.299 -35.302 1.00 33.33 C ATOM 1517 O LEU A 92 -34.381 -2.204 -35.728 1.00 14.21 O ATOM 1518 CB LEU A 92 -34.126 -4.888 -37.231 1.00 24.32 C ATOM 1519 CG LEU A 92 -32.986 -5.902 -37.326 1.00 74.42 C ATOM 1520 CD1 LEU A 92 -31.690 -5.299 -36.806 1.00 10.10 C ATOM 1521 CD2 LEU A 92 -33.333 -7.169 -36.557 1.00 74.12 C ATOM 0 H LEU A 92 -36.501 -4.243 -36.729 1.00 12.24 H new ATOM 0 HA LEU A 92 -34.356 -5.404 -35.156 1.00 34.11 H new ATOM 0 HB2 LEU A 92 -34.960 -5.251 -37.832 1.00 24.32 H new ATOM 0 HB3 LEU A 92 -33.792 -3.953 -37.680 1.00 24.32 H new ATOM 0 HG LEU A 92 -32.846 -6.164 -38.375 1.00 74.42 H new ATOM 0 HD11 LEU A 92 -30.890 -6.035 -36.882 1.00 10.10 H new ATOM 0 HD12 LEU A 92 -31.433 -4.422 -37.400 1.00 10.10 H new ATOM 0 HD13 LEU A 92 -31.817 -5.007 -35.764 1.00 10.10 H new ATOM 0 HD21 LEU A 92 -32.510 -7.879 -36.636 1.00 74.12 H new ATOM 0 HD22 LEU A 92 -33.501 -6.924 -35.508 1.00 74.12 H new ATOM 0 HD23 LEU A 92 -34.236 -7.613 -36.975 1.00 74.12 H new ATOM 1533 N MET A 93 -33.070 -3.438 -34.379 1.00 42.20 N ATOM 1534 CA MET A 93 -32.390 -2.284 -33.803 1.00 45.20 C ATOM 1535 C MET A 93 -31.743 -1.434 -34.891 1.00 44.44 C ATOM 1536 O MET A 93 -31.792 -0.205 -34.845 1.00 22.31 O ATOM 1537 CB MET A 93 -31.330 -2.738 -32.797 1.00 53.32 C ATOM 1538 CG MET A 93 -31.911 -3.418 -31.568 1.00 11.14 C ATOM 1539 SD MET A 93 -32.919 -2.306 -30.570 1.00 32.11 S ATOM 1540 CE MET A 93 -31.651 -1.326 -29.770 1.00 31.34 C ATOM 0 H MET A 93 -32.757 -4.338 -34.014 1.00 42.20 H new ATOM 0 HA MET A 93 -33.134 -1.677 -33.287 1.00 45.20 H new ATOM 0 HB2 MET A 93 -30.642 -3.424 -33.291 1.00 53.32 H new ATOM 0 HB3 MET A 93 -30.746 -1.873 -32.482 1.00 53.32 H new ATOM 0 HG2 MET A 93 -32.516 -4.269 -31.881 1.00 11.14 H new ATOM 0 HG3 MET A 93 -31.099 -3.812 -30.957 1.00 11.14 H new ATOM 0 HE1 MET A 93 -32.107 -0.688 -29.013 1.00 31.34 H new ATOM 0 HE2 MET A 93 -30.924 -1.987 -29.298 1.00 31.34 H new ATOM 0 HE3 MET A 93 -31.148 -0.706 -30.512 1.00 31.34 H new ATOM 1550 N SER A 94 -31.136 -2.097 -35.872 1.00 24.14 N ATOM 1551 CA SER A 94 -30.476 -1.402 -36.970 1.00 63.42 C ATOM 1552 C SER A 94 -31.406 -0.369 -37.597 1.00 50.41 C ATOM 1553 O SER A 94 -30.968 0.700 -38.022 1.00 11.23 O ATOM 1554 CB SER A 94 -30.018 -2.404 -38.033 1.00 1.43 C ATOM 1555 OG SER A 94 -28.798 -1.994 -38.626 1.00 20.41 O ATOM 0 H SER A 94 -31.088 -3.114 -35.928 1.00 24.14 H new ATOM 0 HA SER A 94 -29.605 -0.884 -36.568 1.00 63.42 H new ATOM 0 HB2 SER A 94 -29.894 -3.388 -37.581 1.00 1.43 H new ATOM 0 HB3 SER A 94 -30.785 -2.501 -38.801 1.00 1.43 H new ATOM 0 HG SER A 94 -28.525 -2.651 -39.300 1.00 20.41 H new ATOM 1561 N ALA A 95 -32.693 -0.697 -37.651 1.00 1.44 N ATOM 1562 CA ALA A 95 -33.687 0.203 -38.224 1.00 50.50 C ATOM 1563 C ALA A 95 -34.154 1.230 -37.197 1.00 74.11 C ATOM 1564 O ALA A 95 -34.192 2.428 -37.477 1.00 65.04 O ATOM 1565 CB ALA A 95 -34.871 -0.589 -38.757 1.00 23.11 C ATOM 0 H ALA A 95 -33.072 -1.579 -37.305 1.00 1.44 H new ATOM 0 HA ALA A 95 -33.222 0.740 -39.051 1.00 50.50 H new ATOM 0 HB1 ALA A 95 -35.605 0.096 -39.182 1.00 23.11 H new ATOM 0 HB2 ALA A 95 -34.529 -1.279 -39.528 1.00 23.11 H new ATOM 0 HB3 ALA A 95 -35.328 -1.152 -37.943 1.00 23.11 H new ATOM 1571 N ILE A 96 -34.511 0.753 -36.010 1.00 63.43 N ATOM 1572 CA ILE A 96 -34.975 1.630 -34.942 1.00 74.02 C ATOM 1573 C ILE A 96 -33.912 2.659 -34.575 1.00 11.00 C ATOM 1574 O ILE A 96 -34.227 3.749 -34.097 1.00 31.03 O ATOM 1575 CB ILE A 96 -35.356 0.830 -33.683 1.00 15.22 C ATOM 1576 CG1 ILE A 96 -36.377 -0.256 -34.030 1.00 5.43 C ATOM 1577 CG2 ILE A 96 -35.908 1.760 -32.612 1.00 25.22 C ATOM 1578 CD1 ILE A 96 -37.733 0.292 -34.416 1.00 70.44 C ATOM 0 H ILE A 96 -34.488 -0.236 -35.763 1.00 63.43 H new ATOM 0 HA ILE A 96 -35.860 2.144 -35.317 1.00 74.02 H new ATOM 0 HB ILE A 96 -34.460 0.348 -33.293 1.00 15.22 H new ATOM 0 HG12 ILE A 96 -35.990 -0.858 -34.852 1.00 5.43 H new ATOM 0 HG13 ILE A 96 -36.493 -0.921 -33.174 1.00 5.43 H new ATOM 0 HG21 ILE A 96 -36.173 1.180 -31.728 1.00 25.22 H new ATOM 0 HG22 ILE A 96 -35.152 2.500 -32.348 1.00 25.22 H new ATOM 0 HG23 ILE A 96 -36.795 2.267 -32.992 1.00 25.22 H new ATOM 0 HD11 ILE A 96 -38.406 -0.533 -34.649 1.00 70.44 H new ATOM 0 HD12 ILE A 96 -38.141 0.870 -33.587 1.00 70.44 H new ATOM 0 HD13 ILE A 96 -37.630 0.934 -35.291 1.00 70.44 H new ATOM 1590 N TYR A 97 -32.651 2.307 -34.804 1.00 55.23 N ATOM 1591 CA TYR A 97 -31.541 3.201 -34.497 1.00 61.52 C ATOM 1592 C TYR A 97 -31.470 4.346 -35.503 1.00 25.35 C ATOM 1593 O TYR A 97 -31.344 5.510 -35.124 1.00 12.31 O ATOM 1594 CB TYR A 97 -30.222 2.426 -34.494 1.00 14.23 C ATOM 1595 CG TYR A 97 -29.005 3.302 -34.685 1.00 52.24 C ATOM 1596 CD1 TYR A 97 -28.581 3.668 -35.957 1.00 41.43 C ATOM 1597 CD2 TYR A 97 -28.279 3.765 -33.595 1.00 3.23 C ATOM 1598 CE1 TYR A 97 -27.469 4.468 -36.137 1.00 10.31 C ATOM 1599 CE2 TYR A 97 -27.167 4.566 -33.765 1.00 1.02 C ATOM 1600 CZ TYR A 97 -26.766 4.914 -35.038 1.00 44.05 C ATOM 1601 OH TYR A 97 -25.659 5.712 -35.213 1.00 44.03 O ATOM 0 H TYR A 97 -32.373 1.410 -35.201 1.00 55.23 H new ATOM 0 HA TYR A 97 -31.709 3.623 -33.506 1.00 61.52 H new ATOM 0 HB2 TYR A 97 -30.128 1.889 -33.550 1.00 14.23 H new ATOM 0 HB3 TYR A 97 -30.248 1.677 -35.286 1.00 14.23 H new ATOM 0 HD1 TYR A 97 -29.130 3.321 -36.820 1.00 41.43 H new ATOM 0 HD2 TYR A 97 -28.590 3.494 -32.597 1.00 3.23 H new ATOM 0 HE1 TYR A 97 -27.152 4.742 -37.132 1.00 10.31 H new ATOM 0 HE2 TYR A 97 -26.615 4.918 -32.906 1.00 1.02 H new ATOM 0 HH TYR A 97 -25.792 6.563 -34.747 1.00 44.03 H new ATOM 1611 N GLN A 98 -31.549 4.004 -36.784 1.00 2.40 N ATOM 1612 CA GLN A 98 -31.492 5.004 -37.845 1.00 14.10 C ATOM 1613 C GLN A 98 -32.795 5.794 -37.918 1.00 41.41 C ATOM 1614 O GLN A 98 -32.800 6.967 -38.291 1.00 23.12 O ATOM 1615 CB GLN A 98 -31.212 4.334 -39.191 1.00 51.53 C ATOM 1616 CG GLN A 98 -31.012 5.319 -40.332 1.00 3.44 C ATOM 1617 CD GLN A 98 -29.553 5.671 -40.548 1.00 75.25 C ATOM 1618 OE1 GLN A 98 -29.078 6.712 -40.094 1.00 10.35 O ATOM 1619 NE2 GLN A 98 -28.833 4.801 -41.247 1.00 61.52 N ATOM 0 H GLN A 98 -31.652 3.044 -37.113 1.00 2.40 H new ATOM 0 HA GLN A 98 -30.681 5.695 -37.616 1.00 14.10 H new ATOM 0 HB2 GLN A 98 -30.322 3.712 -39.099 1.00 51.53 H new ATOM 0 HB3 GLN A 98 -32.041 3.670 -39.436 1.00 51.53 H new ATOM 0 HG2 GLN A 98 -31.419 4.894 -41.250 1.00 3.44 H new ATOM 0 HG3 GLN A 98 -31.575 6.229 -40.125 1.00 3.44 H new ATOM 0 HE21 GLN A 98 -29.267 3.950 -41.605 1.00 61.52 H new ATOM 0 HE22 GLN A 98 -27.846 4.984 -41.426 1.00 61.52 H new ATOM 1628 N GLU A 99 -33.897 5.144 -37.559 1.00 0.14 N ATOM 1629 CA GLU A 99 -35.206 5.786 -37.586 1.00 3.45 C ATOM 1630 C GLU A 99 -35.215 7.037 -36.710 1.00 22.50 C ATOM 1631 O GLU A 99 -35.659 8.103 -37.136 1.00 43.43 O ATOM 1632 CB GLU A 99 -36.287 4.812 -37.114 1.00 1.22 C ATOM 1633 CG GLU A 99 -37.692 5.387 -37.173 1.00 52.41 C ATOM 1634 CD GLU A 99 -38.763 4.333 -36.970 1.00 23.51 C ATOM 1635 OE1 GLU A 99 -39.022 3.969 -35.803 1.00 52.05 O ATOM 1636 OE2 GLU A 99 -39.341 3.872 -37.975 1.00 53.24 O ATOM 0 H GLU A 99 -33.910 4.173 -37.246 1.00 0.14 H new ATOM 0 HA GLU A 99 -35.417 6.080 -38.614 1.00 3.45 H new ATOM 0 HB2 GLU A 99 -36.246 3.912 -37.727 1.00 1.22 H new ATOM 0 HB3 GLU A 99 -36.070 4.510 -36.089 1.00 1.22 H new ATOM 0 HG2 GLU A 99 -37.797 6.158 -36.410 1.00 52.41 H new ATOM 0 HG3 GLU A 99 -37.842 5.871 -38.138 1.00 52.41 H new ATOM 1643 N HIS A 100 -34.723 6.897 -35.483 1.00 64.01 N ATOM 1644 CA HIS A 100 -34.673 8.014 -34.547 1.00 12.31 C ATOM 1645 C HIS A 100 -33.231 8.417 -34.255 1.00 60.34 C ATOM 1646 O HIS A 100 -32.947 9.061 -33.245 1.00 53.05 O ATOM 1647 CB HIS A 100 -35.386 7.647 -33.245 1.00 54.50 C ATOM 1648 CG HIS A 100 -36.778 7.131 -33.448 1.00 45.32 C ATOM 1649 ND1 HIS A 100 -37.883 7.953 -33.514 1.00 20.01 N ATOM 1650 CD2 HIS A 100 -37.239 5.869 -33.604 1.00 71.10 C ATOM 1651 CE1 HIS A 100 -38.965 7.217 -33.698 1.00 65.35 C ATOM 1652 NE2 HIS A 100 -38.601 5.949 -33.756 1.00 74.43 N ATOM 0 H HIS A 100 -34.353 6.021 -35.114 1.00 64.01 H new ATOM 0 HA HIS A 100 -35.181 8.862 -35.005 1.00 12.31 H new ATOM 0 HB2 HIS A 100 -34.801 6.892 -32.720 1.00 54.50 H new ATOM 0 HB3 HIS A 100 -35.424 8.526 -32.601 1.00 54.50 H new ATOM 0 HD2 HIS A 100 -36.646 4.966 -33.608 1.00 71.10 H new ATOM 0 HE1 HIS A 100 -39.975 7.589 -33.786 1.00 65.35 H new ATOM 0 HE2 HIS A 100 -39.230 5.157 -33.892 1.00 74.43 H new ATOM 1660 N LYS A 101 -32.323 8.032 -35.146 1.00 73.55 N ATOM 1661 CA LYS A 101 -30.910 8.351 -34.985 1.00 50.21 C ATOM 1662 C LYS A 101 -30.715 9.845 -34.741 1.00 63.14 C ATOM 1663 O LYS A 101 -30.977 10.666 -35.619 1.00 43.50 O ATOM 1664 CB LYS A 101 -30.124 7.920 -36.226 1.00 30.34 C ATOM 1665 CG LYS A 101 -28.849 8.715 -36.445 1.00 50.24 C ATOM 1666 CD LYS A 101 -28.098 8.235 -37.675 1.00 43.04 C ATOM 1667 CE LYS A 101 -26.800 9.004 -37.871 1.00 3.12 C ATOM 1668 NZ LYS A 101 -26.587 9.382 -39.296 1.00 72.13 N ATOM 0 H LYS A 101 -32.541 7.498 -35.987 1.00 73.55 H new ATOM 0 HA LYS A 101 -30.536 7.806 -34.118 1.00 50.21 H new ATOM 0 HB2 LYS A 101 -29.872 6.863 -36.137 1.00 30.34 H new ATOM 0 HB3 LYS A 101 -30.762 8.023 -37.104 1.00 30.34 H new ATOM 0 HG2 LYS A 101 -29.092 9.772 -36.555 1.00 50.24 H new ATOM 0 HG3 LYS A 101 -28.208 8.625 -35.568 1.00 50.24 H new ATOM 0 HD2 LYS A 101 -27.881 7.171 -37.578 1.00 43.04 H new ATOM 0 HD3 LYS A 101 -28.728 8.352 -38.556 1.00 43.04 H new ATOM 0 HE2 LYS A 101 -26.815 9.903 -37.255 1.00 3.12 H new ATOM 0 HE3 LYS A 101 -25.963 8.396 -37.528 1.00 3.12 H new ATOM 0 HZ1 LYS A 101 -25.692 9.904 -39.387 1.00 72.13 H new ATOM 0 HZ2 LYS A 101 -26.547 8.523 -39.881 1.00 72.13 H new ATOM 0 HZ3 LYS A 101 -27.373 9.983 -39.617 1.00 72.13 H new ATOM 1682 N ASP A 102 -30.250 10.188 -33.545 1.00 14.21 N ATOM 1683 CA ASP A 102 -30.017 11.582 -33.186 1.00 40.21 C ATOM 1684 C ASP A 102 -29.236 12.302 -34.282 1.00 34.52 C ATOM 1685 O ASP A 102 -28.630 11.667 -35.146 1.00 14.22 O ATOM 1686 CB ASP A 102 -29.258 11.670 -31.861 1.00 20.31 C ATOM 1687 CG ASP A 102 -29.152 13.092 -31.348 1.00 54.51 C ATOM 1688 OD1 ASP A 102 -30.059 13.898 -31.644 1.00 10.43 O ATOM 1689 OD2 ASP A 102 -28.162 13.400 -30.651 1.00 15.14 O ATOM 0 H ASP A 102 -30.027 9.520 -32.807 1.00 14.21 H new ATOM 0 HA ASP A 102 -30.986 12.069 -33.074 1.00 40.21 H new ATOM 0 HB2 ASP A 102 -29.762 11.055 -31.116 1.00 20.31 H new ATOM 0 HB3 ASP A 102 -28.257 11.258 -31.991 1.00 20.31 H new ATOM 1694 N LYS A 103 -29.256 13.629 -34.241 1.00 73.12 N ATOM 1695 CA LYS A 103 -28.551 14.436 -35.230 1.00 2.14 C ATOM 1696 C LYS A 103 -27.041 14.284 -35.079 1.00 45.43 C ATOM 1697 O LYS A 103 -26.274 14.730 -35.933 1.00 74.43 O ATOM 1698 CB LYS A 103 -28.943 15.909 -35.088 1.00 64.24 C ATOM 1699 CG LYS A 103 -28.941 16.404 -33.652 1.00 63.41 C ATOM 1700 CD LYS A 103 -29.083 17.915 -33.584 1.00 13.15 C ATOM 1701 CE LYS A 103 -29.561 18.369 -32.212 1.00 72.53 C ATOM 1702 NZ LYS A 103 -28.432 18.515 -31.251 1.00 74.14 N ATOM 0 H LYS A 103 -29.753 14.169 -33.533 1.00 73.12 H new ATOM 0 HA LYS A 103 -28.836 14.084 -36.221 1.00 2.14 H new ATOM 0 HB2 LYS A 103 -28.254 16.518 -35.674 1.00 64.24 H new ATOM 0 HB3 LYS A 103 -29.937 16.054 -35.512 1.00 64.24 H new ATOM 0 HG2 LYS A 103 -29.758 15.936 -33.103 1.00 63.41 H new ATOM 0 HG3 LYS A 103 -28.015 16.102 -33.163 1.00 63.41 H new ATOM 0 HD2 LYS A 103 -28.124 18.382 -33.809 1.00 13.15 H new ATOM 0 HD3 LYS A 103 -29.788 18.250 -34.345 1.00 13.15 H new ATOM 0 HE2 LYS A 103 -30.083 19.321 -32.306 1.00 72.53 H new ATOM 0 HE3 LYS A 103 -30.280 17.649 -31.821 1.00 72.53 H new ATOM 0 HZ1 LYS A 103 -28.799 18.826 -30.329 1.00 74.14 H new ATOM 0 HZ2 LYS A 103 -27.949 17.601 -31.141 1.00 74.14 H new ATOM 0 HZ3 LYS A 103 -27.759 19.221 -31.611 1.00 74.14 H new ATOM 1716 N ASP A 104 -26.621 13.653 -33.989 1.00 63.43 N ATOM 1717 CA ASP A 104 -25.202 13.439 -33.728 1.00 45.12 C ATOM 1718 C ASP A 104 -24.826 11.975 -33.936 1.00 22.43 C ATOM 1719 O ASP A 104 -23.676 11.585 -33.732 1.00 74.54 O ATOM 1720 CB ASP A 104 -24.853 13.871 -32.304 1.00 4.14 C ATOM 1721 CG ASP A 104 -25.192 12.809 -31.276 1.00 52.01 C ATOM 1722 OD1 ASP A 104 -26.154 12.046 -31.507 1.00 45.52 O ATOM 1723 OD2 ASP A 104 -24.496 12.741 -30.241 1.00 62.31 O ATOM 0 H ASP A 104 -27.243 13.280 -33.271 1.00 63.43 H new ATOM 0 HA ASP A 104 -24.633 14.045 -34.433 1.00 45.12 H new ATOM 0 HB2 ASP A 104 -23.789 14.100 -32.248 1.00 4.14 H new ATOM 0 HB3 ASP A 104 -25.390 14.789 -32.064 1.00 4.14 H new ATOM 1728 N GLY A 105 -25.803 11.169 -34.340 1.00 1.51 N ATOM 1729 CA GLY A 105 -25.554 9.757 -34.566 1.00 4.21 C ATOM 1730 C GLY A 105 -26.066 8.889 -33.434 1.00 40.33 C ATOM 1731 O GLY A 105 -26.717 7.872 -33.668 1.00 74.05 O ATOM 0 H GLY A 105 -26.762 11.468 -34.515 1.00 1.51 H new ATOM 0 HA2 GLY A 105 -26.031 9.452 -35.498 1.00 4.21 H new ATOM 0 HA3 GLY A 105 -24.483 9.595 -34.688 1.00 4.21 H new ATOM 1735 N PHE A 106 -25.771 9.292 -32.202 1.00 62.23 N ATOM 1736 CA PHE A 106 -26.204 8.542 -31.029 1.00 71.00 C ATOM 1737 C PHE A 106 -27.693 8.218 -31.109 1.00 72.33 C ATOM 1738 O PHE A 106 -28.444 8.872 -31.834 1.00 72.11 O ATOM 1739 CB PHE A 106 -25.912 9.335 -29.754 1.00 3.10 C ATOM 1740 CG PHE A 106 -24.634 8.930 -29.076 1.00 70.03 C ATOM 1741 CD1 PHE A 106 -24.400 7.605 -28.744 1.00 11.52 C ATOM 1742 CD2 PHE A 106 -23.667 9.874 -28.771 1.00 32.34 C ATOM 1743 CE1 PHE A 106 -23.225 7.229 -28.120 1.00 15.23 C ATOM 1744 CE2 PHE A 106 -22.490 9.503 -28.147 1.00 42.44 C ATOM 1745 CZ PHE A 106 -22.269 8.180 -27.821 1.00 31.34 C ATOM 0 H PHE A 106 -25.234 10.133 -31.991 1.00 62.23 H new ATOM 0 HA PHE A 106 -25.647 7.605 -31.002 1.00 71.00 H new ATOM 0 HB2 PHE A 106 -25.864 10.396 -29.999 1.00 3.10 H new ATOM 0 HB3 PHE A 106 -26.740 9.206 -29.057 1.00 3.10 H new ATOM 0 HD1 PHE A 106 -25.144 6.857 -28.975 1.00 11.52 H new ATOM 0 HD2 PHE A 106 -23.834 10.911 -29.023 1.00 32.34 H new ATOM 0 HE1 PHE A 106 -23.055 6.193 -27.867 1.00 15.23 H new ATOM 0 HE2 PHE A 106 -21.744 10.248 -27.915 1.00 42.44 H new ATOM 0 HZ PHE A 106 -21.350 7.889 -27.333 1.00 31.34 H new ATOM 1755 N LEU A 107 -28.113 7.204 -30.361 1.00 63.00 N ATOM 1756 CA LEU A 107 -29.512 6.792 -30.347 1.00 33.12 C ATOM 1757 C LEU A 107 -30.125 6.990 -28.964 1.00 20.12 C ATOM 1758 O LEU A 107 -29.476 6.747 -27.946 1.00 21.13 O ATOM 1759 CB LEU A 107 -29.637 5.326 -30.767 1.00 24.21 C ATOM 1760 CG LEU A 107 -31.021 4.878 -31.238 1.00 32.25 C ATOM 1761 CD1 LEU A 107 -31.967 4.737 -30.054 1.00 42.04 C ATOM 1762 CD2 LEU A 107 -31.581 5.859 -32.257 1.00 14.24 C ATOM 0 H LEU A 107 -27.505 6.652 -29.756 1.00 63.00 H new ATOM 0 HA LEU A 107 -30.055 7.415 -31.058 1.00 33.12 H new ATOM 0 HB2 LEU A 107 -28.924 5.137 -31.569 1.00 24.21 H new ATOM 0 HB3 LEU A 107 -29.342 4.701 -29.924 1.00 24.21 H new ATOM 0 HG LEU A 107 -30.924 3.904 -31.718 1.00 32.25 H new ATOM 0 HD11 LEU A 107 -32.947 4.418 -30.408 1.00 42.04 H new ATOM 0 HD12 LEU A 107 -31.572 3.996 -29.359 1.00 42.04 H new ATOM 0 HD13 LEU A 107 -32.060 5.697 -29.546 1.00 42.04 H new ATOM 0 HD21 LEU A 107 -32.566 5.524 -32.581 1.00 14.24 H new ATOM 0 HD22 LEU A 107 -31.664 6.847 -31.804 1.00 14.24 H new ATOM 0 HD23 LEU A 107 -30.914 5.910 -33.118 1.00 14.24 H new ATOM 1774 N TYR A 108 -31.377 7.431 -28.935 1.00 31.41 N ATOM 1775 CA TYR A 108 -32.077 7.662 -27.677 1.00 15.04 C ATOM 1776 C TYR A 108 -33.090 6.554 -27.405 1.00 74.33 C ATOM 1777 O TYR A 108 -34.037 6.360 -28.168 1.00 43.33 O ATOM 1778 CB TYR A 108 -32.784 9.018 -27.703 1.00 54.11 C ATOM 1779 CG TYR A 108 -31.849 10.191 -27.519 1.00 11.43 C ATOM 1780 CD1 TYR A 108 -31.327 10.499 -26.269 1.00 13.41 C ATOM 1781 CD2 TYR A 108 -31.487 10.992 -28.596 1.00 4.32 C ATOM 1782 CE1 TYR A 108 -30.474 11.572 -26.096 1.00 65.25 C ATOM 1783 CE2 TYR A 108 -30.632 12.065 -28.433 1.00 2.03 C ATOM 1784 CZ TYR A 108 -30.128 12.351 -27.181 1.00 34.15 C ATOM 1785 OH TYR A 108 -29.277 13.419 -27.013 1.00 32.04 O ATOM 0 H TYR A 108 -31.928 7.636 -29.768 1.00 31.41 H new ATOM 0 HA TYR A 108 -31.339 7.660 -26.875 1.00 15.04 H new ATOM 0 HB2 TYR A 108 -33.308 9.127 -28.653 1.00 54.11 H new ATOM 0 HB3 TYR A 108 -33.540 9.040 -26.918 1.00 54.11 H new ATOM 0 HD1 TYR A 108 -31.592 9.889 -25.418 1.00 13.41 H new ATOM 0 HD2 TYR A 108 -31.881 10.772 -29.577 1.00 4.32 H new ATOM 0 HE1 TYR A 108 -30.080 11.800 -25.117 1.00 65.25 H new ATOM 0 HE2 TYR A 108 -30.360 12.676 -29.281 1.00 2.03 H new ATOM 0 HH TYR A 108 -29.134 13.862 -27.875 1.00 32.04 H new ATOM 1795 N VAL A 109 -32.883 5.827 -26.311 1.00 73.41 N ATOM 1796 CA VAL A 109 -33.778 4.738 -25.936 1.00 70.21 C ATOM 1797 C VAL A 109 -34.093 4.774 -24.446 1.00 4.53 C ATOM 1798 O VAL A 109 -33.374 5.396 -23.662 1.00 15.22 O ATOM 1799 CB VAL A 109 -33.171 3.366 -26.288 1.00 5.42 C ATOM 1800 CG1 VAL A 109 -33.392 3.045 -27.758 1.00 4.13 C ATOM 1801 CG2 VAL A 109 -31.690 3.335 -25.943 1.00 4.32 C ATOM 0 H VAL A 109 -32.104 5.972 -25.669 1.00 73.41 H new ATOM 0 HA VAL A 109 -34.699 4.876 -26.503 1.00 70.21 H new ATOM 0 HB VAL A 109 -33.675 2.602 -25.695 1.00 5.42 H new ATOM 0 HG11 VAL A 109 -32.956 2.073 -27.988 1.00 4.13 H new ATOM 0 HG12 VAL A 109 -34.461 3.023 -27.969 1.00 4.13 H new ATOM 0 HG13 VAL A 109 -32.917 3.809 -28.373 1.00 4.13 H new ATOM 0 HG21 VAL A 109 -31.277 2.359 -26.198 1.00 4.32 H new ATOM 0 HG22 VAL A 109 -31.169 4.108 -26.507 1.00 4.32 H new ATOM 0 HG23 VAL A 109 -31.561 3.516 -24.876 1.00 4.32 H new ATOM 1811 N THR A 110 -35.175 4.105 -24.058 1.00 24.25 N ATOM 1812 CA THR A 110 -35.586 4.062 -22.661 1.00 35.42 C ATOM 1813 C THR A 110 -36.149 2.693 -22.296 1.00 73.22 C ATOM 1814 O THR A 110 -36.517 1.909 -23.171 1.00 13.11 O ATOM 1815 CB THR A 110 -36.644 5.138 -22.353 1.00 33.43 C ATOM 1816 OG1 THR A 110 -37.959 4.596 -22.526 1.00 63.11 O ATOM 1817 CG2 THR A 110 -36.465 6.347 -23.258 1.00 72.44 C ATOM 0 H THR A 110 -35.782 3.586 -24.692 1.00 24.25 H new ATOM 0 HA THR A 110 -34.696 4.257 -22.063 1.00 35.42 H new ATOM 0 HB THR A 110 -36.516 5.456 -21.318 1.00 33.43 H new ATOM 0 HG1 THR A 110 -38.626 5.286 -22.327 1.00 63.11 H new ATOM 0 HG21 THR A 110 -37.223 7.094 -23.022 1.00 72.44 H new ATOM 0 HG22 THR A 110 -35.474 6.774 -23.103 1.00 72.44 H new ATOM 0 HG23 THR A 110 -36.569 6.041 -24.299 1.00 72.44 H new ATOM 1825 N TYR A 111 -36.214 2.411 -21.000 1.00 4.13 N ATOM 1826 CA TYR A 111 -36.731 1.135 -20.519 1.00 11.22 C ATOM 1827 C TYR A 111 -37.731 1.344 -19.385 1.00 53.15 C ATOM 1828 O TYR A 111 -37.559 2.229 -18.547 1.00 33.11 O ATOM 1829 CB TYR A 111 -35.583 0.242 -20.044 1.00 12.42 C ATOM 1830 CG TYR A 111 -35.044 0.623 -18.684 1.00 44.41 C ATOM 1831 CD1 TYR A 111 -35.609 0.112 -17.522 1.00 43.24 C ATOM 1832 CD2 TYR A 111 -33.968 1.494 -18.560 1.00 42.35 C ATOM 1833 CE1 TYR A 111 -35.119 0.459 -16.277 1.00 73.41 C ATOM 1834 CE2 TYR A 111 -33.471 1.845 -17.321 1.00 41.02 C ATOM 1835 CZ TYR A 111 -34.050 1.325 -16.182 1.00 64.53 C ATOM 1836 OH TYR A 111 -33.558 1.672 -14.945 1.00 0.01 O ATOM 0 H TYR A 111 -35.915 3.049 -20.263 1.00 4.13 H new ATOM 0 HA TYR A 111 -37.245 0.645 -21.346 1.00 11.22 H new ATOM 0 HB2 TYR A 111 -35.927 -0.792 -20.013 1.00 12.42 H new ATOM 0 HB3 TYR A 111 -34.773 0.287 -20.772 1.00 12.42 H new ATOM 0 HD1 TYR A 111 -36.445 -0.568 -17.593 1.00 43.24 H new ATOM 0 HD2 TYR A 111 -33.512 1.904 -19.449 1.00 42.35 H new ATOM 0 HE1 TYR A 111 -35.571 0.054 -15.384 1.00 73.41 H new ATOM 0 HE2 TYR A 111 -32.634 2.523 -17.244 1.00 41.02 H new ATOM 0 HH TYR A 111 -34.134 1.297 -14.247 1.00 0.01 H new ATOM 1846 N SER A 112 -38.776 0.522 -19.368 1.00 45.03 N ATOM 1847 CA SER A 112 -39.806 0.618 -18.340 1.00 41.22 C ATOM 1848 C SER A 112 -40.646 -0.655 -18.293 1.00 50.25 C ATOM 1849 O SER A 112 -40.995 -1.220 -19.329 1.00 41.10 O ATOM 1850 CB SER A 112 -40.706 1.827 -18.602 1.00 0.41 C ATOM 1851 OG SER A 112 -41.138 2.413 -17.385 1.00 41.55 O ATOM 0 H SER A 112 -38.931 -0.217 -20.054 1.00 45.03 H new ATOM 0 HA SER A 112 -39.313 0.743 -17.376 1.00 41.22 H new ATOM 0 HB2 SER A 112 -40.165 2.566 -19.194 1.00 0.41 H new ATOM 0 HB3 SER A 112 -41.571 1.520 -19.189 1.00 0.41 H new ATOM 0 HG SER A 112 -41.710 3.185 -17.579 1.00 41.55 H new ATOM 1857 N GLY A 113 -40.966 -1.100 -17.083 1.00 14.13 N ATOM 1858 CA GLY A 113 -41.763 -2.303 -16.921 1.00 65.42 C ATOM 1859 C GLY A 113 -43.251 -2.017 -16.916 1.00 54.43 C ATOM 1860 O GLY A 113 -44.039 -2.806 -16.396 1.00 53.45 O ATOM 0 H GLY A 113 -40.688 -0.650 -16.211 1.00 14.13 H new ATOM 0 HA2 GLY A 113 -41.533 -2.999 -17.728 1.00 65.42 H new ATOM 0 HA3 GLY A 113 -41.488 -2.794 -15.988 1.00 65.42 H new ATOM 1864 N GLU A 114 -43.636 -0.883 -17.496 1.00 71.44 N ATOM 1865 CA GLU A 114 -45.040 -0.495 -17.554 1.00 51.14 C ATOM 1866 C GLU A 114 -45.269 0.560 -18.632 1.00 50.52 C ATOM 1867 O GLU A 114 -44.420 1.422 -18.862 1.00 72.34 O ATOM 1868 CB GLU A 114 -45.501 0.039 -16.197 1.00 14.44 C ATOM 1869 CG GLU A 114 -44.477 0.928 -15.512 1.00 65.25 C ATOM 1870 CD GLU A 114 -45.053 1.681 -14.330 1.00 10.52 C ATOM 1871 OE1 GLU A 114 -46.164 2.235 -14.463 1.00 73.02 O ATOM 1872 OE2 GLU A 114 -44.393 1.717 -13.270 1.00 33.51 O ATOM 0 H GLU A 114 -42.996 -0.219 -17.931 1.00 71.44 H new ATOM 0 HA GLU A 114 -45.624 -1.380 -17.806 1.00 51.14 H new ATOM 0 HB2 GLU A 114 -46.425 0.601 -16.332 1.00 14.44 H new ATOM 0 HB3 GLU A 114 -45.733 -0.803 -15.545 1.00 14.44 H new ATOM 0 HG2 GLU A 114 -43.639 0.317 -15.175 1.00 65.25 H new ATOM 0 HG3 GLU A 114 -44.081 1.642 -16.234 1.00 65.25 H new ATOM 1879 N ASN A 115 -46.421 0.486 -19.291 1.00 11.12 N ATOM 1880 CA ASN A 115 -46.762 1.434 -20.346 1.00 23.34 C ATOM 1881 C ASN A 115 -47.949 2.300 -19.936 1.00 24.05 C ATOM 1882 O ASN A 115 -48.554 2.977 -20.768 1.00 1.44 O ATOM 1883 CB ASN A 115 -47.083 0.691 -21.644 1.00 22.52 C ATOM 1884 CG ASN A 115 -46.524 1.393 -22.865 1.00 65.22 C ATOM 1885 OD1 ASN A 115 -45.776 0.804 -23.647 1.00 15.05 O ATOM 1886 ND2 ASN A 115 -46.885 2.660 -23.036 1.00 63.21 N ATOM 0 H ASN A 115 -47.134 -0.221 -19.113 1.00 11.12 H new ATOM 0 HA ASN A 115 -45.901 2.082 -20.510 1.00 23.34 H new ATOM 0 HB2 ASN A 115 -46.677 -0.319 -21.591 1.00 22.52 H new ATOM 0 HB3 ASN A 115 -48.164 0.595 -21.747 1.00 22.52 H new ATOM 0 HD21 ASN A 115 -46.540 3.184 -23.840 1.00 63.21 H new ATOM 0 HD22 ASN A 115 -47.507 3.108 -22.363 1.00 63.21 H new ATOM 1893 N THR A 116 -48.276 2.276 -18.648 1.00 11.22 N ATOM 1894 CA THR A 116 -49.390 3.059 -18.126 1.00 72.55 C ATOM 1895 C THR A 116 -49.011 3.754 -16.825 1.00 11.44 C ATOM 1896 O THR A 116 -47.860 3.701 -16.392 1.00 63.03 O ATOM 1897 CB THR A 116 -50.629 2.178 -17.884 1.00 34.45 C ATOM 1898 OG1 THR A 116 -50.338 1.182 -16.896 1.00 44.11 O ATOM 1899 CG2 THR A 116 -51.076 1.504 -19.173 1.00 12.04 C ATOM 0 H THR A 116 -47.785 1.722 -17.946 1.00 11.22 H new ATOM 0 HA THR A 116 -49.629 3.811 -18.878 1.00 72.55 H new ATOM 0 HB THR A 116 -51.437 2.818 -17.528 1.00 34.45 H new ATOM 0 HG1 THR A 116 -51.132 0.627 -16.747 1.00 44.11 H new ATOM 0 HG21 THR A 116 -51.953 0.887 -18.976 1.00 12.04 H new ATOM 0 HG22 THR A 116 -51.326 2.264 -19.913 1.00 12.04 H new ATOM 0 HG23 THR A 116 -50.270 0.877 -19.554 1.00 12.04 H new ATOM 1907 N PHE A 117 -49.988 4.406 -16.202 1.00 61.22 N ATOM 1908 CA PHE A 117 -49.758 5.113 -14.948 1.00 44.23 C ATOM 1909 C PHE A 117 -50.044 4.209 -13.752 1.00 64.15 C ATOM 1910 O PHE A 117 -50.999 3.434 -13.761 1.00 70.55 O ATOM 1911 CB PHE A 117 -50.633 6.366 -14.875 1.00 70.11 C ATOM 1912 CG PHE A 117 -50.724 7.110 -16.177 1.00 31.20 C ATOM 1913 CD1 PHE A 117 -49.592 7.332 -16.944 1.00 10.43 C ATOM 1914 CD2 PHE A 117 -51.942 7.587 -16.633 1.00 52.32 C ATOM 1915 CE1 PHE A 117 -49.672 8.016 -18.143 1.00 12.23 C ATOM 1916 CE2 PHE A 117 -52.029 8.271 -17.831 1.00 52.11 C ATOM 1917 CZ PHE A 117 -50.892 8.487 -18.586 1.00 54.41 C ATOM 0 H PHE A 117 -50.947 4.459 -16.546 1.00 61.22 H new ATOM 0 HA PHE A 117 -48.709 5.408 -14.915 1.00 44.23 H new ATOM 0 HB2 PHE A 117 -51.636 6.081 -14.558 1.00 70.11 H new ATOM 0 HB3 PHE A 117 -50.235 7.034 -14.111 1.00 70.11 H new ATOM 0 HD1 PHE A 117 -48.635 6.966 -16.601 1.00 10.43 H new ATOM 0 HD2 PHE A 117 -52.833 7.423 -16.046 1.00 52.32 H new ATOM 0 HE1 PHE A 117 -48.782 8.182 -18.732 1.00 12.23 H new ATOM 0 HE2 PHE A 117 -52.985 8.636 -18.177 1.00 52.11 H new ATOM 0 HZ PHE A 117 -50.958 9.023 -19.521 1.00 54.41 H new ATOM 1927 N GLY A 118 -49.207 4.315 -12.724 1.00 11.10 N ATOM 1928 CA GLY A 118 -49.386 3.502 -11.536 1.00 73.54 C ATOM 1929 C GLY A 118 -48.069 3.127 -10.885 1.00 52.14 C ATOM 1930 O GLY A 118 -47.041 3.039 -11.557 1.00 33.31 O ATOM 0 H GLY A 118 -48.409 4.949 -12.693 1.00 11.10 H new ATOM 0 HA2 GLY A 118 -50.001 4.044 -10.818 1.00 73.54 H new ATOM 0 HA3 GLY A 118 -49.929 2.594 -11.799 1.00 73.54 H new ATOM 1934 N ARG A 119 -48.099 2.908 -9.576 1.00 35.51 N ATOM 1935 CA ARG A 119 -46.898 2.544 -8.834 1.00 24.22 C ATOM 1936 C ARG A 119 -46.430 1.141 -9.211 1.00 5.23 C ATOM 1937 O ARG A 119 -47.153 0.390 -9.865 1.00 3.11 O ATOM 1938 CB ARG A 119 -47.160 2.618 -7.328 1.00 45.34 C ATOM 1939 CG ARG A 119 -48.319 1.750 -6.868 1.00 43.12 C ATOM 1940 CD ARG A 119 -47.843 0.378 -6.420 1.00 71.04 C ATOM 1941 NE ARG A 119 -47.520 0.348 -4.996 1.00 72.05 N ATOM 1942 CZ ARG A 119 -47.251 -0.767 -4.326 1.00 51.31 C ATOM 1943 NH1 ARG A 119 -47.265 -1.937 -4.949 1.00 60.21 N ATOM 1944 NH2 ARG A 119 -46.966 -0.713 -3.032 1.00 51.51 N ATOM 0 H ARG A 119 -48.942 2.976 -9.006 1.00 35.51 H new ATOM 0 HA ARG A 119 -46.112 3.253 -9.094 1.00 24.22 H new ATOM 0 HB2 ARG A 119 -46.258 2.317 -6.796 1.00 45.34 H new ATOM 0 HB3 ARG A 119 -47.361 3.653 -7.053 1.00 45.34 H new ATOM 0 HG2 ARG A 119 -48.840 2.242 -6.046 1.00 43.12 H new ATOM 0 HG3 ARG A 119 -49.037 1.640 -7.680 1.00 43.12 H new ATOM 0 HD2 ARG A 119 -48.616 -0.361 -6.632 1.00 71.04 H new ATOM 0 HD3 ARG A 119 -46.963 0.093 -6.997 1.00 71.04 H new ATOM 0 HE ARG A 119 -47.500 1.232 -4.488 1.00 72.05 H new ATOM 0 HH11 ARG A 119 -47.483 -1.982 -5.945 1.00 60.21 H new ATOM 0 HH12 ARG A 119 -47.058 -2.792 -4.433 1.00 60.21 H new ATOM 0 HH21 ARG A 119 -46.953 0.186 -2.550 1.00 51.51 H new ATOM 0 HH22 ARG A 119 -46.760 -1.570 -2.519 1.00 51.51 H new TER 1958 ARG A 119