USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 669 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 38 TYR OH : rot -162:sc= 0.0358 USER MOD Set 1.2: A 84 GLN : amide:sc= -0.691 K(o=-0.66,f=-1.2) USER MOD Set 2.1: A 57 MET CE :methyl 173:sc= -1.86 (180deg=-1.97!) USER MOD Set 2.2: A 65 CYS SG : rot -49:sc=0.000869 USER MOD Single : A 1 GLY N :NH3+ 129:sc= 0.0227 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0.00233 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 25 GLN : amide:sc= -0.155 K(o=-0.15,f=-0.71) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -2.17 K(o=-2.2,f=-4.1!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -4.3! C(o=-4.3!,f=-8.3!) USER MOD Single : A 42 LYS NZ :NH3+ 156:sc= -0.0538 (180deg=-0.449) USER MOD Single : A 43 ASN : amide:sc= -0.18 X(o=-0.18,f=-0.022) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 TYR OH : rot -30:sc= -0.644 USER MOD Single : A 48 SER OG : rot 65:sc= 0.671 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 CYS SG : rot 32:sc= 0.734 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot -70:sc= -0.839 USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 GLN : amide:sc= -0.296 X(o=-0.3,f=-0.3) USER MOD Single : A 82 HIS : no HD1:sc= -0.509 X(o=-0.51,f=-0.5) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0227 USER MOD Single : A 90 SER OG : rot 94:sc= 1.27 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0.0134 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 31.197 3.478 -1.074 1.00 0.00 N ATOM 2 CA GLY A 1 30.164 4.184 -0.339 1.00 0.00 C ATOM 3 C GLY A 1 28.962 3.309 -0.045 1.00 0.00 C ATOM 4 O GLY A 1 28.623 2.423 -0.830 1.00 0.00 O ATOM 0 H1 GLY A 1 31.473 4.036 -1.907 1.00 0.00 H new ATOM 0 H2 GLY A 1 32.025 3.338 -0.461 1.00 0.00 H new ATOM 0 H3 GLY A 1 30.834 2.553 -1.382 1.00 0.00 H new ATOM 0 HA2 GLY A 1 30.578 4.554 0.599 1.00 0.00 H new ATOM 0 HA3 GLY A 1 29.845 5.054 -0.912 1.00 0.00 H new ATOM 8 N SER A 2 28.315 3.557 1.089 1.00 0.00 N ATOM 9 CA SER A 2 27.146 2.781 1.488 1.00 0.00 C ATOM 10 C SER A 2 25.864 3.574 1.257 1.00 0.00 C ATOM 11 O SER A 2 25.020 3.188 0.448 1.00 0.00 O ATOM 12 CB SER A 2 27.253 2.380 2.961 1.00 0.00 C ATOM 13 OG SER A 2 27.005 0.995 3.131 1.00 0.00 O ATOM 0 H SER A 2 28.580 4.289 1.748 1.00 0.00 H new ATOM 0 HA SER A 2 27.111 1.880 0.875 1.00 0.00 H new ATOM 0 HB2 SER A 2 28.247 2.624 3.336 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.540 2.956 3.551 1.00 0.00 H new ATOM 0 HG SER A 2 27.081 0.763 4.080 1.00 0.00 H new ATOM 19 N SER A 3 25.724 4.685 1.973 1.00 0.00 N ATOM 20 CA SER A 3 24.543 5.531 1.850 1.00 0.00 C ATOM 21 C SER A 3 24.890 6.991 2.123 1.00 0.00 C ATOM 22 O SER A 3 25.727 7.294 2.973 1.00 0.00 O ATOM 23 CB SER A 3 23.452 5.065 2.816 1.00 0.00 C ATOM 24 OG SER A 3 24.006 4.674 4.060 1.00 0.00 O ATOM 0 H SER A 3 26.414 5.020 2.645 1.00 0.00 H new ATOM 0 HA SER A 3 24.173 5.448 0.828 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.732 5.868 2.971 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.907 4.229 2.378 1.00 0.00 H new ATOM 0 HG SER A 3 23.289 4.382 4.660 1.00 0.00 H new ATOM 30 N GLY A 4 24.241 7.894 1.395 1.00 0.00 N ATOM 31 CA GLY A 4 24.493 9.312 1.572 1.00 0.00 C ATOM 32 C GLY A 4 23.216 10.115 1.716 1.00 0.00 C ATOM 33 O GLY A 4 22.980 11.059 0.962 1.00 0.00 O ATOM 0 H GLY A 4 23.544 7.669 0.685 1.00 0.00 H new ATOM 0 HA2 GLY A 4 25.113 9.460 2.456 1.00 0.00 H new ATOM 0 HA3 GLY A 4 25.059 9.686 0.719 1.00 0.00 H new ATOM 37 N SER A 5 22.389 9.739 2.687 1.00 0.00 N ATOM 38 CA SER A 5 21.125 10.428 2.923 1.00 0.00 C ATOM 39 C SER A 5 21.147 11.158 4.263 1.00 0.00 C ATOM 40 O SER A 5 20.585 12.245 4.399 1.00 0.00 O ATOM 41 CB SER A 5 19.964 9.433 2.891 1.00 0.00 C ATOM 42 OG SER A 5 18.749 10.077 2.548 1.00 0.00 O ATOM 0 H SER A 5 22.571 8.962 3.322 1.00 0.00 H new ATOM 0 HA SER A 5 20.986 11.163 2.130 1.00 0.00 H new ATOM 0 HB2 SER A 5 20.177 8.644 2.170 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.863 8.955 3.866 1.00 0.00 H new ATOM 0 HG SER A 5 18.023 9.419 2.533 1.00 0.00 H new ATOM 48 N SER A 6 21.801 10.553 5.249 1.00 0.00 N ATOM 49 CA SER A 6 21.894 11.142 6.579 1.00 0.00 C ATOM 50 C SER A 6 20.506 11.389 7.163 1.00 0.00 C ATOM 51 O SER A 6 19.493 11.099 6.528 1.00 0.00 O ATOM 52 CB SER A 6 22.677 12.456 6.525 1.00 0.00 C ATOM 53 OG SER A 6 23.687 12.489 7.519 1.00 0.00 O ATOM 0 H SER A 6 22.274 9.655 5.152 1.00 0.00 H new ATOM 0 HA SER A 6 22.421 10.439 7.224 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.128 12.574 5.540 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.996 13.295 6.666 1.00 0.00 H new ATOM 0 HG SER A 6 24.174 13.338 7.463 1.00 0.00 H new ATOM 59 N GLY A 7 20.469 11.926 8.378 1.00 0.00 N ATOM 60 CA GLY A 7 19.201 12.203 9.028 1.00 0.00 C ATOM 61 C GLY A 7 18.641 10.991 9.747 1.00 0.00 C ATOM 62 O GLY A 7 18.961 9.854 9.401 1.00 0.00 O ATOM 0 H GLY A 7 21.294 12.174 8.924 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.332 13.016 9.742 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.482 12.545 8.284 1.00 0.00 H new ATOM 66 N GLN A 8 17.805 11.234 10.751 1.00 0.00 N ATOM 67 CA GLN A 8 17.202 10.153 11.521 1.00 0.00 C ATOM 68 C GLN A 8 15.917 10.618 12.199 1.00 0.00 C ATOM 69 O GLN A 8 15.585 11.803 12.173 1.00 0.00 O ATOM 70 CB GLN A 8 18.187 9.635 12.571 1.00 0.00 C ATOM 71 CG GLN A 8 18.604 10.688 13.586 1.00 0.00 C ATOM 72 CD GLN A 8 19.682 10.193 14.529 1.00 0.00 C ATOM 73 OE1 GLN A 8 19.417 9.398 15.431 1.00 0.00 O ATOM 74 NE2 GLN A 8 20.907 10.663 14.327 1.00 0.00 N ATOM 0 H GLN A 8 17.530 12.170 11.050 1.00 0.00 H new ATOM 0 HA GLN A 8 16.956 9.344 10.833 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.735 8.794 13.097 1.00 0.00 H new ATOM 0 HB3 GLN A 8 19.076 9.256 12.067 1.00 0.00 H new ATOM 0 HG2 GLN A 8 18.964 11.572 13.060 1.00 0.00 H new ATOM 0 HG3 GLN A 8 17.733 10.995 14.165 1.00 0.00 H new ATOM 0 HE21 GLN A 8 21.082 11.321 13.567 1.00 0.00 H new ATOM 0 HE22 GLN A 8 21.673 10.366 14.932 1.00 0.00 H new ATOM 83 N MET A 9 15.199 9.677 12.803 1.00 0.00 N ATOM 84 CA MET A 9 13.950 9.992 13.488 1.00 0.00 C ATOM 85 C MET A 9 14.159 10.053 14.998 1.00 0.00 C ATOM 86 O MET A 9 15.099 9.461 15.528 1.00 0.00 O ATOM 87 CB MET A 9 12.882 8.950 13.151 1.00 0.00 C ATOM 88 CG MET A 9 12.329 9.081 11.741 1.00 0.00 C ATOM 89 SD MET A 9 13.147 7.981 10.569 1.00 0.00 S ATOM 90 CE MET A 9 12.580 8.663 9.013 1.00 0.00 C ATOM 0 H MET A 9 15.460 8.691 12.832 1.00 0.00 H new ATOM 0 HA MET A 9 13.613 10.971 13.146 1.00 0.00 H new ATOM 0 HB2 MET A 9 13.306 7.954 13.275 1.00 0.00 H new ATOM 0 HB3 MET A 9 12.062 9.038 13.864 1.00 0.00 H new ATOM 0 HG2 MET A 9 11.261 8.864 11.752 1.00 0.00 H new ATOM 0 HG3 MET A 9 12.441 10.112 11.405 1.00 0.00 H new ATOM 0 HE1 MET A 9 13.002 8.088 8.189 1.00 0.00 H new ATOM 0 HE2 MET A 9 11.492 8.615 8.970 1.00 0.00 H new ATOM 0 HE3 MET A 9 12.901 9.702 8.933 1.00 0.00 H new ATOM 100 N SER A 10 13.278 10.772 15.684 1.00 0.00 N ATOM 101 CA SER A 10 13.368 10.914 17.133 1.00 0.00 C ATOM 102 C SER A 10 12.371 9.995 17.832 1.00 0.00 C ATOM 103 O SER A 10 12.603 9.547 18.956 1.00 0.00 O ATOM 104 CB SER A 10 13.114 12.366 17.542 1.00 0.00 C ATOM 105 OG SER A 10 11.960 12.882 16.901 1.00 0.00 O ATOM 0 H SER A 10 12.493 11.266 15.260 1.00 0.00 H new ATOM 0 HA SER A 10 14.375 10.629 17.439 1.00 0.00 H new ATOM 0 HB2 SER A 10 12.991 12.426 18.623 1.00 0.00 H new ATOM 0 HB3 SER A 10 13.980 12.976 17.285 1.00 0.00 H new ATOM 0 HG SER A 10 11.818 13.811 17.180 1.00 0.00 H new ATOM 111 N LEU A 11 11.260 9.718 17.159 1.00 0.00 N ATOM 112 CA LEU A 11 10.225 8.852 17.714 1.00 0.00 C ATOM 113 C LEU A 11 9.714 9.397 19.043 1.00 0.00 C ATOM 114 O LEU A 11 9.738 8.704 20.059 1.00 0.00 O ATOM 115 CB LEU A 11 10.768 7.434 17.906 1.00 0.00 C ATOM 116 CG LEU A 11 11.527 6.840 16.719 1.00 0.00 C ATOM 117 CD1 LEU A 11 13.028 6.950 16.937 1.00 0.00 C ATOM 118 CD2 LEU A 11 11.123 5.389 16.500 1.00 0.00 C ATOM 0 H LEU A 11 11.052 10.080 16.228 1.00 0.00 H new ATOM 0 HA LEU A 11 9.393 8.824 17.010 1.00 0.00 H new ATOM 0 HB2 LEU A 11 11.430 7.434 18.772 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.933 6.776 18.144 1.00 0.00 H new ATOM 0 HG LEU A 11 11.268 7.407 15.825 1.00 0.00 H new ATOM 0 HD11 LEU A 11 13.552 6.522 16.082 1.00 0.00 H new ATOM 0 HD12 LEU A 11 13.304 7.999 17.044 1.00 0.00 H new ATOM 0 HD13 LEU A 11 13.305 6.408 17.841 1.00 0.00 H new ATOM 0 HD21 LEU A 11 11.673 4.982 15.651 1.00 0.00 H new ATOM 0 HD22 LEU A 11 11.353 4.808 17.393 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.053 5.336 16.298 1.00 0.00 H new ATOM 130 N GLU A 12 9.249 10.643 19.027 1.00 0.00 N ATOM 131 CA GLU A 12 8.731 11.280 20.232 1.00 0.00 C ATOM 132 C GLU A 12 7.612 10.446 20.849 1.00 0.00 C ATOM 133 O GLU A 12 6.782 9.878 20.140 1.00 0.00 O ATOM 134 CB GLU A 12 8.217 12.685 19.911 1.00 0.00 C ATOM 135 CG GLU A 12 9.012 13.792 20.585 1.00 0.00 C ATOM 136 CD GLU A 12 8.139 14.951 21.025 1.00 0.00 C ATOM 137 OE1 GLU A 12 7.334 15.434 20.203 1.00 0.00 O ATOM 138 OE2 GLU A 12 8.262 15.374 22.194 1.00 0.00 O ATOM 0 H GLU A 12 9.221 11.230 18.194 1.00 0.00 H new ATOM 0 HA GLU A 12 9.545 11.354 20.953 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.244 12.835 18.832 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.174 12.760 20.217 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.533 13.385 21.452 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.775 14.157 19.897 1.00 0.00 H new ATOM 145 N GLY A 13 7.596 10.377 22.177 1.00 0.00 N ATOM 146 CA GLY A 13 6.576 9.611 22.868 1.00 0.00 C ATOM 147 C GLY A 13 5.311 10.411 23.105 1.00 0.00 C ATOM 148 O GLY A 13 5.307 11.636 22.975 1.00 0.00 O ATOM 0 H GLY A 13 8.272 10.838 22.786 1.00 0.00 H new ATOM 0 HA2 GLY A 13 6.336 8.722 22.285 1.00 0.00 H new ATOM 0 HA3 GLY A 13 6.970 9.268 23.825 1.00 0.00 H new ATOM 152 N THR A 14 4.231 9.719 23.453 1.00 0.00 N ATOM 153 CA THR A 14 2.952 10.372 23.706 1.00 0.00 C ATOM 154 C THR A 14 2.048 9.496 24.565 1.00 0.00 C ATOM 155 O THR A 14 1.317 8.650 24.050 1.00 0.00 O ATOM 156 CB THR A 14 2.224 10.708 22.391 1.00 0.00 C ATOM 157 OG1 THR A 14 2.626 9.798 21.361 1.00 0.00 O ATOM 158 CG2 THR A 14 2.521 12.136 21.958 1.00 0.00 C ATOM 0 H THR A 14 4.216 8.705 23.566 1.00 0.00 H new ATOM 0 HA THR A 14 3.169 11.297 24.239 1.00 0.00 H new ATOM 0 HB THR A 14 1.152 10.612 22.561 1.00 0.00 H new ATOM 0 HG1 THR A 14 2.157 10.018 20.529 1.00 0.00 H new ATOM 0 HG21 THR A 14 1.996 12.351 21.027 1.00 0.00 H new ATOM 0 HG22 THR A 14 2.186 12.828 22.731 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.594 12.254 21.805 1.00 0.00 H new ATOM 166 N GLU A 15 2.102 9.704 25.877 1.00 0.00 N ATOM 167 CA GLU A 15 1.287 8.932 26.807 1.00 0.00 C ATOM 168 C GLU A 15 0.054 9.723 27.235 1.00 0.00 C ATOM 169 O GLU A 15 0.138 10.915 27.531 1.00 0.00 O ATOM 170 CB GLU A 15 2.108 8.542 28.038 1.00 0.00 C ATOM 171 CG GLU A 15 1.599 7.293 28.737 1.00 0.00 C ATOM 172 CD GLU A 15 2.153 6.018 28.131 1.00 0.00 C ATOM 173 OE1 GLU A 15 3.353 5.737 28.332 1.00 0.00 O ATOM 174 OE2 GLU A 15 1.385 5.300 27.456 1.00 0.00 O ATOM 0 H GLU A 15 2.702 10.401 26.319 1.00 0.00 H new ATOM 0 HA GLU A 15 0.959 8.027 26.297 1.00 0.00 H new ATOM 0 HB2 GLU A 15 3.144 8.384 27.738 1.00 0.00 H new ATOM 0 HB3 GLU A 15 2.104 9.371 28.745 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.869 7.336 29.792 1.00 0.00 H new ATOM 0 HG3 GLU A 15 0.510 7.271 28.687 1.00 0.00 H new ATOM 181 N LYS A 16 -1.092 9.050 27.265 1.00 0.00 N ATOM 182 CA LYS A 16 -2.344 9.687 27.657 1.00 0.00 C ATOM 183 C LYS A 16 -2.712 10.806 26.687 1.00 0.00 C ATOM 184 O LYS A 16 -2.083 10.965 25.641 1.00 0.00 O ATOM 185 CB LYS A 16 -2.233 10.245 29.078 1.00 0.00 C ATOM 186 CG LYS A 16 -3.291 9.709 30.026 1.00 0.00 C ATOM 187 CD LYS A 16 -4.220 10.812 30.506 1.00 0.00 C ATOM 188 CE LYS A 16 -3.885 11.245 31.925 1.00 0.00 C ATOM 189 NZ LYS A 16 -4.469 12.575 32.252 1.00 0.00 N ATOM 0 H LYS A 16 -1.179 8.063 27.022 1.00 0.00 H new ATOM 0 HA LYS A 16 -3.131 8.933 27.630 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.247 10.008 29.476 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.309 11.332 29.040 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.872 8.935 29.524 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -2.809 9.240 30.883 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.146 11.669 29.836 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.252 10.463 30.465 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -4.258 10.501 32.629 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -2.803 11.284 32.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.218 12.834 33.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.093 13.290 31.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.504 12.532 32.161 1.00 0.00 H new ATOM 203 N ALA A 17 -3.732 11.579 27.043 1.00 0.00 N ATOM 204 CA ALA A 17 -4.181 12.685 26.206 1.00 0.00 C ATOM 205 C ALA A 17 -4.578 13.889 27.053 1.00 0.00 C ATOM 206 O ALA A 17 -5.260 13.748 28.068 1.00 0.00 O ATOM 207 CB ALA A 17 -5.346 12.246 25.331 1.00 0.00 C ATOM 0 H ALA A 17 -4.263 11.460 27.905 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.351 12.983 25.565 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.671 13.082 24.711 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.030 11.422 24.692 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -6.172 11.920 25.962 1.00 0.00 H new ATOM 213 N SER A 18 -4.145 15.072 26.630 1.00 0.00 N ATOM 214 CA SER A 18 -4.451 16.301 27.353 1.00 0.00 C ATOM 215 C SER A 18 -5.957 16.539 27.407 1.00 0.00 C ATOM 216 O SER A 18 -6.447 17.303 28.239 1.00 0.00 O ATOM 217 CB SER A 18 -3.759 17.494 26.690 1.00 0.00 C ATOM 218 OG SER A 18 -2.690 17.971 27.489 1.00 0.00 O ATOM 0 H SER A 18 -3.581 15.206 25.790 1.00 0.00 H new ATOM 0 HA SER A 18 -4.080 16.195 28.372 1.00 0.00 H new ATOM 0 HB2 SER A 18 -3.382 17.202 25.710 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.482 18.294 26.528 1.00 0.00 H new ATOM 0 HG SER A 18 -2.263 18.732 27.043 1.00 0.00 H new ATOM 224 N TRP A 19 -6.686 15.879 26.514 1.00 0.00 N ATOM 225 CA TRP A 19 -8.137 16.017 26.460 1.00 0.00 C ATOM 226 C TRP A 19 -8.824 14.733 26.912 1.00 0.00 C ATOM 227 O TRP A 19 -10.005 14.519 26.636 1.00 0.00 O ATOM 228 CB TRP A 19 -8.582 16.376 25.041 1.00 0.00 C ATOM 229 CG TRP A 19 -7.903 15.562 23.981 1.00 0.00 C ATOM 230 CD1 TRP A 19 -6.760 15.883 23.308 1.00 0.00 C ATOM 231 CD2 TRP A 19 -8.327 14.292 23.473 1.00 0.00 C ATOM 232 NE1 TRP A 19 -6.447 14.890 22.412 1.00 0.00 N ATOM 233 CE2 TRP A 19 -7.392 13.902 22.494 1.00 0.00 C ATOM 234 CE3 TRP A 19 -9.404 13.446 23.751 1.00 0.00 C ATOM 235 CZ2 TRP A 19 -7.505 12.705 21.793 1.00 0.00 C ATOM 236 CZ3 TRP A 19 -9.514 12.257 23.054 1.00 0.00 C ATOM 237 CH2 TRP A 19 -8.569 11.895 22.085 1.00 0.00 C ATOM 0 H TRP A 19 -6.296 15.243 25.818 1.00 0.00 H new ATOM 0 HA TRP A 19 -8.427 16.819 27.139 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -9.660 16.238 24.960 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -8.382 17.432 24.862 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -6.186 16.785 23.458 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -5.641 14.889 21.787 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -10.137 13.716 24.497 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -6.778 12.425 21.045 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -10.343 11.596 23.260 1.00 0.00 H new ATOM 0 HH2 TRP A 19 -8.682 10.959 21.558 1.00 0.00 H new ATOM 248 N LEU A 20 -8.078 13.882 27.608 1.00 0.00 N ATOM 249 CA LEU A 20 -8.616 12.618 28.099 1.00 0.00 C ATOM 250 C LEU A 20 -8.870 12.682 29.602 1.00 0.00 C ATOM 251 O LEU A 20 -7.953 12.920 30.387 1.00 0.00 O ATOM 252 CB LEU A 20 -7.653 11.473 27.781 1.00 0.00 C ATOM 253 CG LEU A 20 -8.067 10.546 26.638 1.00 0.00 C ATOM 254 CD1 LEU A 20 -7.025 9.459 26.429 1.00 0.00 C ATOM 255 CD2 LEU A 20 -9.432 9.933 26.917 1.00 0.00 C ATOM 0 H LEU A 20 -7.099 14.044 27.845 1.00 0.00 H new ATOM 0 HA LEU A 20 -9.566 12.436 27.596 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -6.679 11.900 27.541 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -7.525 10.872 28.681 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.136 11.135 25.724 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -7.337 8.809 25.612 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -6.066 9.916 26.184 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -6.924 8.872 27.342 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -9.711 9.276 26.093 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -9.390 9.358 27.842 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -10.174 10.726 27.016 1.00 0.00 H new ATOM 267 N GLY A 21 -10.122 12.466 29.996 1.00 0.00 N ATOM 268 CA GLY A 21 -10.473 12.501 31.403 1.00 0.00 C ATOM 269 C GLY A 21 -11.413 13.642 31.738 1.00 0.00 C ATOM 270 O GLY A 21 -12.075 13.625 32.775 1.00 0.00 O ATOM 0 H GLY A 21 -10.899 12.268 29.365 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -10.940 11.556 31.681 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.565 12.596 31.999 1.00 0.00 H new ATOM 274 N GLU A 22 -11.470 14.637 30.858 1.00 0.00 N ATOM 275 CA GLU A 22 -12.334 15.793 31.067 1.00 0.00 C ATOM 276 C GLU A 22 -13.313 15.958 29.909 1.00 0.00 C ATOM 277 O GLU A 22 -12.970 15.707 28.754 1.00 0.00 O ATOM 278 CB GLU A 22 -11.495 17.063 31.225 1.00 0.00 C ATOM 279 CG GLU A 22 -12.271 18.238 31.796 1.00 0.00 C ATOM 280 CD GLU A 22 -12.638 18.041 33.255 1.00 0.00 C ATOM 281 OE1 GLU A 22 -11.790 17.528 34.015 1.00 0.00 O ATOM 282 OE2 GLU A 22 -13.771 18.400 33.635 1.00 0.00 O ATOM 0 H GLU A 22 -10.928 14.666 29.994 1.00 0.00 H new ATOM 0 HA GLU A 22 -12.904 15.627 31.981 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.646 16.849 31.874 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.090 17.344 30.253 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -11.676 19.146 31.694 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.180 18.386 31.213 1.00 0.00 H new ATOM 289 N GLN A 23 -14.532 16.381 30.227 1.00 0.00 N ATOM 290 CA GLN A 23 -15.561 16.578 29.213 1.00 0.00 C ATOM 291 C GLN A 23 -15.116 17.605 28.178 1.00 0.00 C ATOM 292 O GLN A 23 -14.212 18.408 28.413 1.00 0.00 O ATOM 293 CB GLN A 23 -16.870 17.027 29.865 1.00 0.00 C ATOM 294 CG GLN A 23 -17.755 15.874 30.309 1.00 0.00 C ATOM 295 CD GLN A 23 -18.963 16.337 31.099 1.00 0.00 C ATOM 296 OE1 GLN A 23 -18.842 17.127 32.035 1.00 0.00 O ATOM 297 NE2 GLN A 23 -20.139 15.845 30.726 1.00 0.00 N ATOM 0 H GLN A 23 -14.831 16.594 31.179 1.00 0.00 H new ATOM 0 HA GLN A 23 -15.723 15.626 28.707 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -16.641 17.651 30.728 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -17.423 17.648 29.160 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -18.090 15.319 29.432 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -17.170 15.185 30.918 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -20.194 15.192 29.944 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -20.987 16.120 31.221 1.00 0.00 H new ATOM 306 N PRO A 24 -15.763 17.582 27.004 1.00 0.00 N ATOM 307 CA PRO A 24 -15.451 18.506 25.909 1.00 0.00 C ATOM 308 C PRO A 24 -15.868 19.939 26.223 1.00 0.00 C ATOM 309 O PRO A 24 -15.539 20.866 25.484 1.00 0.00 O ATOM 310 CB PRO A 24 -16.267 17.956 24.737 1.00 0.00 C ATOM 311 CG PRO A 24 -17.396 17.221 25.373 1.00 0.00 C ATOM 312 CD PRO A 24 -16.851 16.653 26.654 1.00 0.00 C ATOM 0 HA PRO A 24 -14.380 18.558 25.713 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.629 18.759 24.095 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -15.666 17.295 24.112 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -18.235 17.888 25.568 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.763 16.429 24.720 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -17.613 16.615 27.433 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.483 15.636 26.518 1.00 0.00 H new ATOM 320 N GLN A 25 -16.594 20.112 27.323 1.00 0.00 N ATOM 321 CA GLN A 25 -17.056 21.432 27.733 1.00 0.00 C ATOM 322 C GLN A 25 -15.987 22.155 28.544 1.00 0.00 C ATOM 323 O GLN A 25 -15.967 23.385 28.609 1.00 0.00 O ATOM 324 CB GLN A 25 -18.342 21.314 28.552 1.00 0.00 C ATOM 325 CG GLN A 25 -19.370 20.376 27.940 1.00 0.00 C ATOM 326 CD GLN A 25 -20.771 20.955 27.957 1.00 0.00 C ATOM 327 OE1 GLN A 25 -20.966 22.146 27.715 1.00 0.00 O ATOM 328 NE2 GLN A 25 -21.757 20.112 28.243 1.00 0.00 N ATOM 0 H GLN A 25 -16.875 19.354 27.946 1.00 0.00 H new ATOM 0 HA GLN A 25 -17.259 22.014 26.834 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -18.094 20.964 29.554 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -18.785 22.304 28.661 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -19.086 20.153 26.912 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -19.364 19.432 28.485 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -21.550 19.132 28.437 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -22.721 20.444 28.268 1.00 0.00 H new ATOM 337 N PHE A 26 -15.098 21.385 29.163 1.00 0.00 N ATOM 338 CA PHE A 26 -14.026 21.952 29.972 1.00 0.00 C ATOM 339 C PHE A 26 -12.671 21.748 29.299 1.00 0.00 C ATOM 340 O PHE A 26 -11.702 21.344 29.942 1.00 0.00 O ATOM 341 CB PHE A 26 -14.017 21.316 31.364 1.00 0.00 C ATOM 342 CG PHE A 26 -15.315 21.474 32.103 1.00 0.00 C ATOM 343 CD1 PHE A 26 -16.361 20.590 31.890 1.00 0.00 C ATOM 344 CD2 PHE A 26 -15.490 22.506 33.011 1.00 0.00 C ATOM 345 CE1 PHE A 26 -17.556 20.733 32.568 1.00 0.00 C ATOM 346 CE2 PHE A 26 -16.683 22.654 33.692 1.00 0.00 C ATOM 347 CZ PHE A 26 -17.717 21.766 33.471 1.00 0.00 C ATOM 0 H PHE A 26 -15.099 20.366 29.120 1.00 0.00 H new ATOM 0 HA PHE A 26 -14.206 23.022 30.070 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -13.789 20.254 31.268 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -13.216 21.762 31.953 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -16.240 19.780 31.186 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.684 23.203 33.188 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.364 20.038 32.392 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.807 23.463 34.396 1.00 0.00 H new ATOM 0 HZ PHE A 26 -18.650 21.879 34.003 1.00 0.00 H new ATOM 357 N TRP A 27 -12.613 22.031 28.003 1.00 0.00 N ATOM 358 CA TRP A 27 -11.378 21.879 27.242 1.00 0.00 C ATOM 359 C TRP A 27 -10.654 23.214 27.108 1.00 0.00 C ATOM 360 O TRP A 27 -11.229 24.271 27.362 1.00 0.00 O ATOM 361 CB TRP A 27 -11.676 21.304 25.857 1.00 0.00 C ATOM 362 CG TRP A 27 -11.792 19.810 25.846 1.00 0.00 C ATOM 363 CD1 TRP A 27 -11.788 18.979 26.930 1.00 0.00 C ATOM 364 CD2 TRP A 27 -11.927 18.969 24.695 1.00 0.00 C ATOM 365 NE1 TRP A 27 -11.913 17.673 26.523 1.00 0.00 N ATOM 366 CE2 TRP A 27 -12.000 17.640 25.156 1.00 0.00 C ATOM 367 CE3 TRP A 27 -11.995 19.209 23.320 1.00 0.00 C ATOM 368 CZ2 TRP A 27 -12.137 16.558 24.290 1.00 0.00 C ATOM 369 CZ3 TRP A 27 -12.130 18.135 22.462 1.00 0.00 C ATOM 370 CH2 TRP A 27 -12.201 16.823 22.949 1.00 0.00 C ATOM 0 H TRP A 27 -13.406 22.367 27.457 1.00 0.00 H new ATOM 0 HA TRP A 27 -10.730 21.189 27.782 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -12.605 21.736 25.484 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -10.886 21.605 25.169 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -11.700 19.302 27.957 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -11.937 16.860 27.138 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -11.943 20.217 22.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -12.191 15.546 24.663 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -12.182 18.309 21.397 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -12.308 16.005 22.252 1.00 0.00 H new ATOM 381 N SER A 28 -9.388 23.157 26.706 1.00 0.00 N ATOM 382 CA SER A 28 -8.584 24.362 26.541 1.00 0.00 C ATOM 383 C SER A 28 -8.262 24.604 25.069 1.00 0.00 C ATOM 384 O SER A 28 -8.489 23.739 24.222 1.00 0.00 O ATOM 385 CB SER A 28 -7.288 24.251 27.346 1.00 0.00 C ATOM 386 OG SER A 28 -7.335 25.066 28.504 1.00 0.00 O ATOM 0 H SER A 28 -8.897 22.289 26.489 1.00 0.00 H new ATOM 0 HA SER A 28 -9.163 25.208 26.912 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.123 23.213 27.635 1.00 0.00 H new ATOM 0 HB3 SER A 28 -6.443 24.547 26.724 1.00 0.00 H new ATOM 0 HG SER A 28 -6.496 24.976 29.002 1.00 0.00 H new ATOM 392 N LYS A 29 -7.733 25.785 24.771 1.00 0.00 N ATOM 393 CA LYS A 29 -7.378 26.143 23.403 1.00 0.00 C ATOM 394 C LYS A 29 -6.354 25.166 22.834 1.00 0.00 C ATOM 395 O LYS A 29 -6.270 24.975 21.620 1.00 0.00 O ATOM 396 CB LYS A 29 -6.822 27.568 23.354 1.00 0.00 C ATOM 397 CG LYS A 29 -7.846 28.633 23.707 1.00 0.00 C ATOM 398 CD LYS A 29 -7.213 29.785 24.468 1.00 0.00 C ATOM 399 CE LYS A 29 -8.251 30.817 24.882 1.00 0.00 C ATOM 400 NZ LYS A 29 -8.431 31.870 23.845 1.00 0.00 N ATOM 0 H LYS A 29 -7.540 26.512 25.460 1.00 0.00 H new ATOM 0 HA LYS A 29 -8.281 26.092 22.794 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.979 27.644 24.041 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.436 27.764 22.354 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -8.310 29.009 22.795 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.640 28.191 24.309 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.706 29.402 25.354 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.454 30.260 23.846 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -9.204 30.320 25.064 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -7.948 31.280 25.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.146 32.554 24.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.528 32.361 23.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.745 31.431 22.956 1.00 0.00 H new ATOM 414 N THR A 30 -5.576 24.549 23.718 1.00 0.00 N ATOM 415 CA THR A 30 -4.558 23.592 23.304 1.00 0.00 C ATOM 416 C THR A 30 -5.146 22.193 23.155 1.00 0.00 C ATOM 417 O THR A 30 -4.838 21.480 22.201 1.00 0.00 O ATOM 418 CB THR A 30 -3.392 23.542 24.309 1.00 0.00 C ATOM 419 OG1 THR A 30 -3.186 24.836 24.885 1.00 0.00 O ATOM 420 CG2 THR A 30 -2.113 23.073 23.632 1.00 0.00 C ATOM 0 H THR A 30 -5.632 24.695 24.726 1.00 0.00 H new ATOM 0 HA THR A 30 -4.181 23.930 22.338 1.00 0.00 H new ATOM 0 HB THR A 30 -3.649 22.832 25.095 1.00 0.00 H new ATOM 0 HG1 THR A 30 -2.444 24.795 25.524 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.304 23.046 24.362 1.00 0.00 H new ATOM 0 HG22 THR A 30 -2.264 22.075 23.220 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.853 23.762 22.828 1.00 0.00 H new ATOM 428 N GLN A 31 -5.994 21.809 24.103 1.00 0.00 N ATOM 429 CA GLN A 31 -6.625 20.495 24.076 1.00 0.00 C ATOM 430 C GLN A 31 -7.374 20.277 22.765 1.00 0.00 C ATOM 431 O GLN A 31 -7.204 19.252 22.104 1.00 0.00 O ATOM 432 CB GLN A 31 -7.586 20.342 25.257 1.00 0.00 C ATOM 433 CG GLN A 31 -6.936 20.598 26.607 1.00 0.00 C ATOM 434 CD GLN A 31 -7.912 20.465 27.759 1.00 0.00 C ATOM 435 OE1 GLN A 31 -7.961 21.316 28.647 1.00 0.00 O ATOM 436 NE2 GLN A 31 -8.695 19.393 27.751 1.00 0.00 N ATOM 0 H GLN A 31 -6.260 22.389 24.899 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.841 19.742 24.155 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.420 21.032 25.128 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.002 19.334 25.248 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.114 19.896 26.749 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -6.505 21.599 26.615 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -8.621 18.713 26.995 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.371 19.250 28.501 1.00 0.00 H new ATOM 445 N VAL A 32 -8.202 21.248 22.394 1.00 0.00 N ATOM 446 CA VAL A 32 -8.976 21.163 21.161 1.00 0.00 C ATOM 447 C VAL A 32 -8.081 20.839 19.971 1.00 0.00 C ATOM 448 O VAL A 32 -8.225 19.793 19.337 1.00 0.00 O ATOM 449 CB VAL A 32 -9.730 22.476 20.880 1.00 0.00 C ATOM 450 CG1 VAL A 32 -10.562 22.354 19.613 1.00 0.00 C ATOM 451 CG2 VAL A 32 -10.604 22.853 22.067 1.00 0.00 C ATOM 0 H VAL A 32 -8.354 22.103 22.929 1.00 0.00 H new ATOM 0 HA VAL A 32 -9.699 20.359 21.297 1.00 0.00 H new ATOM 0 HB VAL A 32 -8.998 23.270 20.730 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -11.087 23.292 19.431 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -9.909 22.134 18.769 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.287 21.549 19.730 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -11.129 23.783 21.851 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -11.330 22.061 22.251 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -9.980 22.986 22.951 1.00 0.00 H new ATOM 461 N LEU A 33 -7.154 21.743 19.672 1.00 0.00 N ATOM 462 CA LEU A 33 -6.233 21.554 18.557 1.00 0.00 C ATOM 463 C LEU A 33 -5.476 20.237 18.693 1.00 0.00 C ATOM 464 O LEU A 33 -5.074 19.634 17.698 1.00 0.00 O ATOM 465 CB LEU A 33 -5.243 22.718 18.484 1.00 0.00 C ATOM 466 CG LEU A 33 -5.852 24.103 18.262 1.00 0.00 C ATOM 467 CD1 LEU A 33 -4.894 25.189 18.727 1.00 0.00 C ATOM 468 CD2 LEU A 33 -6.211 24.299 16.796 1.00 0.00 C ATOM 0 H LEU A 33 -7.021 22.614 20.186 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.817 21.523 17.637 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.669 22.740 19.410 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.538 22.519 17.677 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.765 24.176 18.853 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.345 26.167 18.561 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -4.686 25.061 19.789 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.963 25.118 18.164 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.643 25.290 16.657 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.313 24.206 16.186 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.935 23.542 16.494 1.00 0.00 H new ATOM 480 N ASP A 34 -5.287 19.794 19.932 1.00 0.00 N ATOM 481 CA ASP A 34 -4.581 18.546 20.198 1.00 0.00 C ATOM 482 C ASP A 34 -5.469 17.344 19.893 1.00 0.00 C ATOM 483 O ASP A 34 -4.976 16.259 19.584 1.00 0.00 O ATOM 484 CB ASP A 34 -4.120 18.498 21.656 1.00 0.00 C ATOM 485 CG ASP A 34 -2.775 19.168 21.860 1.00 0.00 C ATOM 486 OD1 ASP A 34 -2.286 19.817 20.912 1.00 0.00 O ATOM 487 OD2 ASP A 34 -2.211 19.042 22.967 1.00 0.00 O ATOM 0 H ASP A 34 -5.613 20.281 20.767 1.00 0.00 H new ATOM 0 HA ASP A 34 -3.708 18.505 19.547 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -4.865 18.985 22.286 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -4.058 17.459 21.981 1.00 0.00 H new ATOM 492 N TRP A 35 -6.779 17.544 19.982 1.00 0.00 N ATOM 493 CA TRP A 35 -7.735 16.476 19.716 1.00 0.00 C ATOM 494 C TRP A 35 -7.956 16.304 18.217 1.00 0.00 C ATOM 495 O TRP A 35 -8.230 15.201 17.744 1.00 0.00 O ATOM 496 CB TRP A 35 -9.066 16.771 20.410 1.00 0.00 C ATOM 497 CG TRP A 35 -10.160 15.821 20.025 1.00 0.00 C ATOM 498 CD1 TRP A 35 -10.337 14.546 20.482 1.00 0.00 C ATOM 499 CD2 TRP A 35 -11.226 16.071 19.102 1.00 0.00 C ATOM 500 NE1 TRP A 35 -11.449 13.988 19.899 1.00 0.00 N ATOM 501 CE2 TRP A 35 -12.013 14.903 19.049 1.00 0.00 C ATOM 502 CE3 TRP A 35 -11.593 17.167 18.317 1.00 0.00 C ATOM 503 CZ2 TRP A 35 -13.142 14.804 18.241 1.00 0.00 C ATOM 504 CZ3 TRP A 35 -12.715 17.066 17.516 1.00 0.00 C ATOM 505 CH2 TRP A 35 -13.479 15.892 17.483 1.00 0.00 C ATOM 0 H TRP A 35 -7.203 18.436 20.236 1.00 0.00 H new ATOM 0 HA TRP A 35 -7.324 15.547 20.112 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -8.922 16.729 21.490 1.00 0.00 H new ATOM 0 HB3 TRP A 35 -9.376 17.788 20.169 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -9.697 14.050 21.196 1.00 0.00 H new ATOM 0 HE1 TRP A 35 -11.798 13.045 20.071 1.00 0.00 H new ATOM 0 HE3 TRP A 35 -11.011 18.076 18.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 -13.732 13.900 18.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 -13.008 17.907 16.905 1.00 0.00 H new ATOM 0 HH2 TRP A 35 -14.351 15.845 16.847 1.00 0.00 H new ATOM 516 N ILE A 36 -7.836 17.400 17.476 1.00 0.00 N ATOM 517 CA ILE A 36 -8.021 17.368 16.031 1.00 0.00 C ATOM 518 C ILE A 36 -6.996 16.456 15.365 1.00 0.00 C ATOM 519 O ILE A 36 -7.350 15.577 14.579 1.00 0.00 O ATOM 520 CB ILE A 36 -7.913 18.777 15.418 1.00 0.00 C ATOM 521 CG1 ILE A 36 -8.953 19.710 16.041 1.00 0.00 C ATOM 522 CG2 ILE A 36 -8.087 18.713 13.908 1.00 0.00 C ATOM 523 CD1 ILE A 36 -8.898 21.122 15.503 1.00 0.00 C ATOM 0 H ILE A 36 -7.612 18.321 17.852 1.00 0.00 H new ATOM 0 HA ILE A 36 -9.023 16.978 15.850 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.921 19.175 15.633 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.948 19.301 15.864 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.806 19.735 17.121 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -8.008 19.716 13.490 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.311 18.079 13.479 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -9.067 18.298 13.672 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -9.663 21.727 15.990 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.916 21.550 15.703 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -9.075 21.109 14.428 1.00 0.00 H new ATOM 535 N SER A 37 -5.725 16.670 15.686 1.00 0.00 N ATOM 536 CA SER A 37 -4.647 15.869 15.118 1.00 0.00 C ATOM 537 C SER A 37 -4.932 14.379 15.285 1.00 0.00 C ATOM 538 O SER A 37 -4.594 13.570 14.420 1.00 0.00 O ATOM 539 CB SER A 37 -3.315 16.223 15.781 1.00 0.00 C ATOM 540 OG SER A 37 -2.295 15.321 15.390 1.00 0.00 O ATOM 0 H SER A 37 -5.416 17.392 16.337 1.00 0.00 H new ATOM 0 HA SER A 37 -4.584 16.092 14.053 1.00 0.00 H new ATOM 0 HB2 SER A 37 -3.029 17.239 15.510 1.00 0.00 H new ATOM 0 HB3 SER A 37 -3.428 16.202 16.865 1.00 0.00 H new ATOM 0 HG SER A 37 -1.453 15.570 15.826 1.00 0.00 H new ATOM 546 N TYR A 38 -5.555 14.025 16.403 1.00 0.00 N ATOM 547 CA TYR A 38 -5.884 12.633 16.686 1.00 0.00 C ATOM 548 C TYR A 38 -6.856 12.080 15.648 1.00 0.00 C ATOM 549 O TYR A 38 -6.672 10.976 15.137 1.00 0.00 O ATOM 550 CB TYR A 38 -6.488 12.504 18.086 1.00 0.00 C ATOM 551 CG TYR A 38 -7.621 11.507 18.167 1.00 0.00 C ATOM 552 CD1 TYR A 38 -7.388 10.146 18.011 1.00 0.00 C ATOM 553 CD2 TYR A 38 -8.926 11.925 18.398 1.00 0.00 C ATOM 554 CE1 TYR A 38 -8.420 9.231 18.084 1.00 0.00 C ATOM 555 CE2 TYR A 38 -9.964 11.017 18.473 1.00 0.00 C ATOM 556 CZ TYR A 38 -9.707 9.671 18.315 1.00 0.00 C ATOM 557 OH TYR A 38 -10.739 8.764 18.388 1.00 0.00 O ATOM 0 H TYR A 38 -5.842 14.682 17.128 1.00 0.00 H new ATOM 0 HA TYR A 38 -4.963 12.052 16.640 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -5.705 12.209 18.785 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -6.851 13.480 18.407 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -6.382 9.798 17.829 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -9.132 12.978 18.521 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -8.221 8.177 17.961 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -10.972 11.359 18.654 1.00 0.00 H new ATOM 0 HH TYR A 38 -11.592 9.229 18.262 1.00 0.00 H new ATOM 567 N GLN A 39 -7.889 12.857 15.342 1.00 0.00 N ATOM 568 CA GLN A 39 -8.890 12.446 14.365 1.00 0.00 C ATOM 569 C GLN A 39 -8.370 12.628 12.943 1.00 0.00 C ATOM 570 O GLN A 39 -8.855 11.992 12.007 1.00 0.00 O ATOM 571 CB GLN A 39 -10.179 13.249 14.555 1.00 0.00 C ATOM 572 CG GLN A 39 -11.205 12.552 15.433 1.00 0.00 C ATOM 573 CD GLN A 39 -12.364 11.984 14.637 1.00 0.00 C ATOM 574 OE1 GLN A 39 -13.005 12.693 13.860 1.00 0.00 O ATOM 575 NE2 GLN A 39 -12.640 10.699 14.827 1.00 0.00 N ATOM 0 H GLN A 39 -8.055 13.774 15.756 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.102 11.388 14.523 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.934 14.216 14.994 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.622 13.446 13.579 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.719 11.747 15.985 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.587 13.258 16.170 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -12.083 10.149 15.481 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.409 10.262 14.319 1.00 0.00 H new ATOM 584 N VAL A 40 -7.379 13.500 12.787 1.00 0.00 N ATOM 585 CA VAL A 40 -6.791 13.765 11.479 1.00 0.00 C ATOM 586 C VAL A 40 -5.784 12.685 11.101 1.00 0.00 C ATOM 587 O VAL A 40 -5.565 12.414 9.921 1.00 0.00 O ATOM 588 CB VAL A 40 -6.093 15.137 11.445 1.00 0.00 C ATOM 589 CG1 VAL A 40 -5.445 15.373 10.089 1.00 0.00 C ATOM 590 CG2 VAL A 40 -7.083 16.246 11.772 1.00 0.00 C ATOM 0 H VAL A 40 -6.966 14.035 13.551 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.609 13.764 10.758 1.00 0.00 H new ATOM 0 HB VAL A 40 -5.309 15.146 12.202 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -4.957 16.347 10.084 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.705 14.595 9.899 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.208 15.345 9.311 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.573 17.209 11.744 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.890 16.241 11.039 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.496 16.083 12.768 1.00 0.00 H new ATOM 600 N GLU A 41 -5.174 12.072 12.110 1.00 0.00 N ATOM 601 CA GLU A 41 -4.189 11.021 11.882 1.00 0.00 C ATOM 602 C GLU A 41 -4.862 9.655 11.791 1.00 0.00 C ATOM 603 O GLU A 41 -4.331 8.728 11.179 1.00 0.00 O ATOM 604 CB GLU A 41 -3.148 11.016 13.004 1.00 0.00 C ATOM 605 CG GLU A 41 -2.058 9.974 12.817 1.00 0.00 C ATOM 606 CD GLU A 41 -1.474 9.985 11.418 1.00 0.00 C ATOM 607 OE1 GLU A 41 -0.765 10.956 11.079 1.00 0.00 O ATOM 608 OE2 GLU A 41 -1.725 9.024 10.661 1.00 0.00 O ATOM 0 H GLU A 41 -5.344 12.285 13.093 1.00 0.00 H new ATOM 0 HA GLU A 41 -3.690 11.224 10.934 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.689 12.003 13.067 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.651 10.837 13.954 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -1.262 10.152 13.540 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.465 8.985 13.029 1.00 0.00 H new ATOM 615 N LYS A 42 -6.035 9.538 12.405 1.00 0.00 N ATOM 616 CA LYS A 42 -6.783 8.286 12.394 1.00 0.00 C ATOM 617 C LYS A 42 -7.632 8.171 11.132 1.00 0.00 C ATOM 618 O LYS A 42 -7.840 7.076 10.611 1.00 0.00 O ATOM 619 CB LYS A 42 -7.676 8.191 13.632 1.00 0.00 C ATOM 620 CG LYS A 42 -7.659 6.823 14.291 1.00 0.00 C ATOM 621 CD LYS A 42 -7.464 6.929 15.794 1.00 0.00 C ATOM 622 CE LYS A 42 -6.903 5.641 16.376 1.00 0.00 C ATOM 623 NZ LYS A 42 -5.509 5.387 15.918 1.00 0.00 N ATOM 0 H LYS A 42 -6.488 10.295 12.917 1.00 0.00 H new ATOM 0 HA LYS A 42 -6.067 7.464 12.406 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -7.357 8.939 14.358 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.700 8.437 13.351 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -8.595 6.305 14.081 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -6.858 6.221 13.861 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -6.788 7.755 16.017 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -8.417 7.160 16.270 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -6.924 5.695 17.464 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -7.539 4.804 16.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.024 4.774 16.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -5.529 4.919 14.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -4.999 6.290 15.840 1.00 0.00 H new ATOM 637 N ASN A 43 -8.117 9.308 10.644 1.00 0.00 N ATOM 638 CA ASN A 43 -8.942 9.334 9.442 1.00 0.00 C ATOM 639 C ASN A 43 -8.077 9.447 8.191 1.00 0.00 C ATOM 640 O ASN A 43 -8.587 9.611 7.082 1.00 0.00 O ATOM 641 CB ASN A 43 -9.929 10.502 9.501 1.00 0.00 C ATOM 642 CG ASN A 43 -11.102 10.223 10.421 1.00 0.00 C ATOM 643 OD1 ASN A 43 -12.245 10.125 9.975 1.00 0.00 O ATOM 644 ND2 ASN A 43 -10.822 10.093 11.713 1.00 0.00 N ATOM 0 H ASN A 43 -7.953 10.224 11.063 1.00 0.00 H new ATOM 0 HA ASN A 43 -9.499 8.398 9.393 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.408 11.397 9.842 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.300 10.712 8.498 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -11.570 9.904 12.380 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -9.859 10.182 12.038 1.00 0.00 H new ATOM 651 N LYS A 44 -6.765 9.356 8.375 1.00 0.00 N ATOM 652 CA LYS A 44 -5.827 9.446 7.263 1.00 0.00 C ATOM 653 C LYS A 44 -6.094 10.692 6.425 1.00 0.00 C ATOM 654 O LYS A 44 -5.848 10.706 5.219 1.00 0.00 O ATOM 655 CB LYS A 44 -5.926 8.197 6.383 1.00 0.00 C ATOM 656 CG LYS A 44 -5.799 6.896 7.157 1.00 0.00 C ATOM 657 CD LYS A 44 -4.709 6.009 6.580 1.00 0.00 C ATOM 658 CE LYS A 44 -5.267 5.040 5.548 1.00 0.00 C ATOM 659 NZ LYS A 44 -5.144 5.574 4.164 1.00 0.00 N ATOM 0 H LYS A 44 -6.326 9.220 9.286 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.820 9.515 7.675 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.882 8.207 5.859 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.146 8.236 5.623 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.578 7.113 8.202 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.751 6.365 7.137 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.939 6.629 6.120 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.230 5.450 7.384 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.738 4.089 5.619 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -6.315 4.839 5.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.535 4.885 3.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -5.669 6.468 4.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.141 5.742 3.945 1.00 0.00 H new ATOM 673 N TYR A 45 -6.596 11.738 7.073 1.00 0.00 N ATOM 674 CA TYR A 45 -6.897 12.989 6.387 1.00 0.00 C ATOM 675 C TYR A 45 -5.617 13.754 6.062 1.00 0.00 C ATOM 676 O TYR A 45 -4.751 13.929 6.919 1.00 0.00 O ATOM 677 CB TYR A 45 -7.819 13.857 7.246 1.00 0.00 C ATOM 678 CG TYR A 45 -8.519 14.949 6.469 1.00 0.00 C ATOM 679 CD1 TYR A 45 -9.377 14.642 5.421 1.00 0.00 C ATOM 680 CD2 TYR A 45 -8.321 16.288 6.783 1.00 0.00 C ATOM 681 CE1 TYR A 45 -10.019 15.636 4.708 1.00 0.00 C ATOM 682 CE2 TYR A 45 -8.960 17.289 6.077 1.00 0.00 C ATOM 683 CZ TYR A 45 -9.807 16.958 5.040 1.00 0.00 C ATOM 684 OH TYR A 45 -10.444 17.952 4.333 1.00 0.00 O ATOM 0 H TYR A 45 -6.803 11.744 8.072 1.00 0.00 H new ATOM 0 HA TYR A 45 -7.402 12.748 5.452 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -8.568 13.221 7.717 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -7.235 14.310 8.047 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -9.545 13.608 5.159 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -7.656 16.551 7.593 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -10.683 15.380 3.896 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -8.797 18.325 6.336 1.00 0.00 H new ATOM 0 HH TYR A 45 -10.594 17.654 3.412 1.00 0.00 H new ATOM 694 N ASP A 46 -5.506 14.207 4.818 1.00 0.00 N ATOM 695 CA ASP A 46 -4.334 14.954 4.379 1.00 0.00 C ATOM 696 C ASP A 46 -4.047 16.118 5.322 1.00 0.00 C ATOM 697 O ASP A 46 -2.897 16.521 5.495 1.00 0.00 O ATOM 698 CB ASP A 46 -4.539 15.474 2.955 1.00 0.00 C ATOM 699 CG ASP A 46 -3.393 15.105 2.034 1.00 0.00 C ATOM 700 OD1 ASP A 46 -2.294 15.676 2.197 1.00 0.00 O ATOM 701 OD2 ASP A 46 -3.595 14.247 1.149 1.00 0.00 O ATOM 0 H ASP A 46 -6.214 14.070 4.096 1.00 0.00 H new ATOM 0 HA ASP A 46 -3.478 14.280 4.392 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.468 15.070 2.554 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -4.647 16.558 2.979 1.00 0.00 H new ATOM 706 N ALA A 47 -5.100 16.655 5.929 1.00 0.00 N ATOM 707 CA ALA A 47 -4.961 17.772 6.855 1.00 0.00 C ATOM 708 C ALA A 47 -4.426 19.011 6.145 1.00 0.00 C ATOM 709 O ALA A 47 -3.815 19.880 6.767 1.00 0.00 O ATOM 710 CB ALA A 47 -4.048 17.389 8.011 1.00 0.00 C ATOM 0 H ALA A 47 -6.059 16.334 5.796 1.00 0.00 H new ATOM 0 HA ALA A 47 -5.949 18.009 7.249 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -3.953 18.233 8.695 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -4.472 16.537 8.543 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.064 17.123 7.625 1.00 0.00 H new ATOM 716 N SER A 48 -4.660 19.086 4.838 1.00 0.00 N ATOM 717 CA SER A 48 -4.197 20.217 4.042 1.00 0.00 C ATOM 718 C SER A 48 -5.366 21.111 3.639 1.00 0.00 C ATOM 719 O SER A 48 -5.337 21.752 2.589 1.00 0.00 O ATOM 720 CB SER A 48 -3.463 19.723 2.794 1.00 0.00 C ATOM 721 OG SER A 48 -4.368 19.494 1.728 1.00 0.00 O ATOM 0 H SER A 48 -5.167 18.377 4.308 1.00 0.00 H new ATOM 0 HA SER A 48 -3.508 20.802 4.651 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.718 20.459 2.491 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.927 18.802 3.024 1.00 0.00 H new ATOM 0 HG SER A 48 -4.775 20.343 1.456 1.00 0.00 H new ATOM 727 N ALA A 49 -6.393 21.147 4.481 1.00 0.00 N ATOM 728 CA ALA A 49 -7.571 21.963 4.214 1.00 0.00 C ATOM 729 C ALA A 49 -8.060 22.653 5.483 1.00 0.00 C ATOM 730 O ALA A 49 -8.431 23.827 5.459 1.00 0.00 O ATOM 731 CB ALA A 49 -8.679 21.110 3.615 1.00 0.00 C ATOM 0 H ALA A 49 -6.433 20.621 5.354 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.293 22.735 3.496 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -9.553 21.732 3.421 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -8.333 20.668 2.681 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -8.946 20.318 4.314 1.00 0.00 H new ATOM 737 N ILE A 50 -8.059 21.917 6.589 1.00 0.00 N ATOM 738 CA ILE A 50 -8.502 22.459 7.868 1.00 0.00 C ATOM 739 C ILE A 50 -7.789 23.769 8.186 1.00 0.00 C ATOM 740 O ILE A 50 -6.591 23.911 7.941 1.00 0.00 O ATOM 741 CB ILE A 50 -8.258 21.463 9.017 1.00 0.00 C ATOM 742 CG1 ILE A 50 -8.985 20.145 8.742 1.00 0.00 C ATOM 743 CG2 ILE A 50 -8.712 22.059 10.340 1.00 0.00 C ATOM 744 CD1 ILE A 50 -8.653 19.053 9.733 1.00 0.00 C ATOM 0 H ILE A 50 -7.756 20.944 6.625 1.00 0.00 H new ATOM 0 HA ILE A 50 -9.573 22.643 7.779 1.00 0.00 H new ATOM 0 HB ILE A 50 -7.189 21.260 9.081 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -10.060 20.323 8.757 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -8.732 19.803 7.739 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -8.533 21.343 11.142 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -8.153 22.973 10.538 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -9.776 22.289 10.289 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -9.204 18.149 9.476 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -7.583 18.847 9.702 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.932 19.375 10.736 1.00 0.00 H new ATOM 756 N ASP A 51 -8.533 24.723 8.735 1.00 0.00 N ATOM 757 CA ASP A 51 -7.972 26.021 9.090 1.00 0.00 C ATOM 758 C ASP A 51 -7.924 26.196 10.605 1.00 0.00 C ATOM 759 O ASP A 51 -8.824 26.787 11.201 1.00 0.00 O ATOM 760 CB ASP A 51 -8.795 27.146 8.460 1.00 0.00 C ATOM 761 CG ASP A 51 -8.183 27.660 7.172 1.00 0.00 C ATOM 762 OD1 ASP A 51 -8.061 26.867 6.216 1.00 0.00 O ATOM 763 OD2 ASP A 51 -7.825 28.856 7.121 1.00 0.00 O ATOM 0 H ASP A 51 -9.526 24.622 8.944 1.00 0.00 H new ATOM 0 HA ASP A 51 -6.954 26.067 8.704 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -9.804 26.786 8.261 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.884 27.968 9.170 1.00 0.00 H new ATOM 768 N PHE A 52 -6.867 25.677 11.222 1.00 0.00 N ATOM 769 CA PHE A 52 -6.702 25.774 12.667 1.00 0.00 C ATOM 770 C PHE A 52 -6.744 27.229 13.123 1.00 0.00 C ATOM 771 O PHE A 52 -7.106 27.524 14.262 1.00 0.00 O ATOM 772 CB PHE A 52 -5.382 25.131 13.095 1.00 0.00 C ATOM 773 CG PHE A 52 -5.273 23.680 12.725 1.00 0.00 C ATOM 774 CD1 PHE A 52 -5.732 22.695 13.585 1.00 0.00 C ATOM 775 CD2 PHE A 52 -4.712 23.300 11.516 1.00 0.00 C ATOM 776 CE1 PHE A 52 -5.634 21.359 13.247 1.00 0.00 C ATOM 777 CE2 PHE A 52 -4.612 21.965 11.172 1.00 0.00 C ATOM 778 CZ PHE A 52 -5.073 20.993 12.039 1.00 0.00 C ATOM 0 H PHE A 52 -6.112 25.185 10.743 1.00 0.00 H new ATOM 0 HA PHE A 52 -7.527 25.241 13.138 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -4.557 25.677 12.638 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -5.272 25.231 14.175 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -6.172 22.975 14.531 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.349 24.055 10.835 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -5.996 20.602 13.927 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.174 21.682 10.226 1.00 0.00 H new ATOM 0 HZ PHE A 52 -4.995 19.949 11.773 1.00 0.00 H new ATOM 788 N SER A 53 -6.370 28.135 12.226 1.00 0.00 N ATOM 789 CA SER A 53 -6.360 29.560 12.536 1.00 0.00 C ATOM 790 C SER A 53 -7.735 30.023 13.008 1.00 0.00 C ATOM 791 O SER A 53 -7.849 30.965 13.793 1.00 0.00 O ATOM 792 CB SER A 53 -5.932 30.368 11.309 1.00 0.00 C ATOM 793 OG SER A 53 -4.606 30.847 11.452 1.00 0.00 O ATOM 0 H SER A 53 -6.070 27.908 11.278 1.00 0.00 H new ATOM 0 HA SER A 53 -5.643 29.726 13.340 1.00 0.00 H new ATOM 0 HB2 SER A 53 -6.003 29.746 10.417 1.00 0.00 H new ATOM 0 HB3 SER A 53 -6.612 31.208 11.167 1.00 0.00 H new ATOM 0 HG SER A 53 -4.355 31.359 10.655 1.00 0.00 H new ATOM 799 N ARG A 54 -8.776 29.353 12.525 1.00 0.00 N ATOM 800 CA ARG A 54 -10.144 29.695 12.896 1.00 0.00 C ATOM 801 C ARG A 54 -10.559 28.970 14.173 1.00 0.00 C ATOM 802 O ARG A 54 -11.428 29.437 14.910 1.00 0.00 O ATOM 803 CB ARG A 54 -11.107 29.342 11.761 1.00 0.00 C ATOM 804 CG ARG A 54 -10.985 30.256 10.553 1.00 0.00 C ATOM 805 CD ARG A 54 -12.198 31.163 10.417 1.00 0.00 C ATOM 806 NE ARG A 54 -11.906 32.350 9.617 1.00 0.00 N ATOM 807 CZ ARG A 54 -12.763 33.350 9.446 1.00 0.00 C ATOM 808 NH1 ARG A 54 -13.959 33.307 10.017 1.00 0.00 N ATOM 809 NH2 ARG A 54 -12.425 34.396 8.704 1.00 0.00 N ATOM 0 H ARG A 54 -8.698 28.570 11.876 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.186 30.769 13.078 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -10.925 28.314 11.448 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.129 29.385 12.137 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.084 30.863 10.644 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.875 29.655 9.650 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.016 30.608 9.957 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.536 31.467 11.408 1.00 0.00 H new ATOM 0 HE ARG A 54 -10.994 32.414 9.165 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.222 32.505 10.589 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -14.615 34.076 9.884 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -11.506 34.433 8.264 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -13.084 35.163 8.574 1.00 0.00 H new ATOM 823 N CYS A 55 -9.931 27.827 14.429 1.00 0.00 N ATOM 824 CA CYS A 55 -10.236 27.037 15.616 1.00 0.00 C ATOM 825 C CYS A 55 -9.657 27.690 16.867 1.00 0.00 C ATOM 826 O CYS A 55 -8.645 27.238 17.404 1.00 0.00 O ATOM 827 CB CYS A 55 -9.684 25.618 15.465 1.00 0.00 C ATOM 828 SG CYS A 55 -10.172 24.492 16.793 1.00 0.00 S ATOM 0 H CYS A 55 -9.208 27.427 13.831 1.00 0.00 H new ATOM 0 HA CYS A 55 -11.320 26.989 15.722 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -10.021 25.208 14.513 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -8.596 25.665 15.424 1.00 0.00 H new ATOM 0 HG CYS A 55 -11.352 24.821 17.229 1.00 0.00 H new ATOM 834 N ASP A 56 -10.304 28.756 17.325 1.00 0.00 N ATOM 835 CA ASP A 56 -9.854 29.473 18.512 1.00 0.00 C ATOM 836 C ASP A 56 -10.709 29.110 19.723 1.00 0.00 C ATOM 837 O ASP A 56 -10.595 29.726 20.782 1.00 0.00 O ATOM 838 CB ASP A 56 -9.902 30.982 18.272 1.00 0.00 C ATOM 839 CG ASP A 56 -8.598 31.667 18.633 1.00 0.00 C ATOM 840 OD1 ASP A 56 -8.446 32.074 19.803 1.00 0.00 O ATOM 841 OD2 ASP A 56 -7.730 31.798 17.744 1.00 0.00 O ATOM 0 H ASP A 56 -11.142 29.143 16.892 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.824 29.179 18.715 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -10.132 31.173 17.224 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -10.711 31.415 18.860 1.00 0.00 H new ATOM 846 N MET A 57 -11.565 28.107 19.557 1.00 0.00 N ATOM 847 CA MET A 57 -12.440 27.663 20.636 1.00 0.00 C ATOM 848 C MET A 57 -11.656 26.873 21.680 1.00 0.00 C ATOM 849 O MET A 57 -10.980 25.897 21.355 1.00 0.00 O ATOM 850 CB MET A 57 -13.578 26.806 20.079 1.00 0.00 C ATOM 851 CG MET A 57 -13.102 25.663 19.197 1.00 0.00 C ATOM 852 SD MET A 57 -13.390 25.971 17.444 1.00 0.00 S ATOM 853 CE MET A 57 -14.475 24.607 17.034 1.00 0.00 C ATOM 0 H MET A 57 -11.671 27.587 18.686 1.00 0.00 H new ATOM 0 HA MET A 57 -12.862 28.546 21.115 1.00 0.00 H new ATOM 0 HB2 MET A 57 -14.154 26.398 20.909 1.00 0.00 H new ATOM 0 HB3 MET A 57 -14.252 27.441 19.504 1.00 0.00 H new ATOM 0 HG2 MET A 57 -12.037 25.500 19.363 1.00 0.00 H new ATOM 0 HG3 MET A 57 -13.614 24.746 19.490 1.00 0.00 H new ATOM 0 HE1 MET A 57 -14.842 24.727 16.015 1.00 0.00 H new ATOM 0 HE2 MET A 57 -13.926 23.669 17.114 1.00 0.00 H new ATOM 0 HE3 MET A 57 -15.319 24.593 17.724 1.00 0.00 H new ATOM 863 N ASP A 58 -11.752 27.302 22.934 1.00 0.00 N ATOM 864 CA ASP A 58 -11.053 26.634 24.025 1.00 0.00 C ATOM 865 C ASP A 58 -11.705 25.294 24.349 1.00 0.00 C ATOM 866 O ASP A 58 -11.021 24.291 24.550 1.00 0.00 O ATOM 867 CB ASP A 58 -11.039 27.523 25.270 1.00 0.00 C ATOM 868 CG ASP A 58 -12.434 27.819 25.785 1.00 0.00 C ATOM 869 OD1 ASP A 58 -13.213 28.464 25.053 1.00 0.00 O ATOM 870 OD2 ASP A 58 -12.747 27.404 26.921 1.00 0.00 O ATOM 0 H ASP A 58 -12.307 28.109 23.220 1.00 0.00 H new ATOM 0 HA ASP A 58 -10.027 26.450 23.707 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -10.461 27.035 26.055 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -10.534 28.461 25.038 1.00 0.00 H new ATOM 875 N GLY A 59 -13.034 25.285 24.399 1.00 0.00 N ATOM 876 CA GLY A 59 -13.757 24.063 24.701 1.00 0.00 C ATOM 877 C GLY A 59 -15.259 24.268 24.722 1.00 0.00 C ATOM 878 O GLY A 59 -15.986 23.657 23.940 1.00 0.00 O ATOM 0 H GLY A 59 -13.623 26.102 24.236 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -13.507 23.304 23.959 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.432 23.682 25.669 1.00 0.00 H new ATOM 882 N ALA A 60 -15.724 25.129 25.621 1.00 0.00 N ATOM 883 CA ALA A 60 -17.149 25.413 25.742 1.00 0.00 C ATOM 884 C ALA A 60 -17.735 25.853 24.405 1.00 0.00 C ATOM 885 O ALA A 60 -18.910 25.615 24.121 1.00 0.00 O ATOM 886 CB ALA A 60 -17.387 26.479 26.801 1.00 0.00 C ATOM 0 H ALA A 60 -15.135 25.642 26.276 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.653 24.496 26.047 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -18.455 26.681 26.880 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.012 26.127 27.762 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.865 27.394 26.520 1.00 0.00 H new ATOM 892 N THR A 61 -16.911 26.499 23.585 1.00 0.00 N ATOM 893 CA THR A 61 -17.348 26.974 22.279 1.00 0.00 C ATOM 894 C THR A 61 -17.385 25.837 21.264 1.00 0.00 C ATOM 895 O THR A 61 -18.200 25.841 20.341 1.00 0.00 O ATOM 896 CB THR A 61 -16.428 28.090 21.750 1.00 0.00 C ATOM 897 OG1 THR A 61 -16.445 29.206 22.648 1.00 0.00 O ATOM 898 CG2 THR A 61 -16.865 28.541 20.364 1.00 0.00 C ATOM 0 H THR A 61 -15.936 26.705 23.804 1.00 0.00 H new ATOM 0 HA THR A 61 -18.354 27.374 22.409 1.00 0.00 H new ATOM 0 HB THR A 61 -15.415 27.694 21.683 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.856 29.911 22.305 1.00 0.00 H new ATOM 0 HG21 THR A 61 -16.200 29.330 20.012 1.00 0.00 H new ATOM 0 HG22 THR A 61 -16.823 27.696 19.676 1.00 0.00 H new ATOM 0 HG23 THR A 61 -17.886 28.921 20.410 1.00 0.00 H new ATOM 906 N LEU A 62 -16.497 24.865 21.440 1.00 0.00 N ATOM 907 CA LEU A 62 -16.428 23.720 20.539 1.00 0.00 C ATOM 908 C LEU A 62 -17.745 22.950 20.534 1.00 0.00 C ATOM 909 O LEU A 62 -18.315 22.682 19.476 1.00 0.00 O ATOM 910 CB LEU A 62 -15.283 22.791 20.949 1.00 0.00 C ATOM 911 CG LEU A 62 -15.193 21.464 20.196 1.00 0.00 C ATOM 912 CD1 LEU A 62 -15.022 21.707 18.704 1.00 0.00 C ATOM 913 CD2 LEU A 62 -14.046 20.621 20.735 1.00 0.00 C ATOM 0 H LEU A 62 -15.815 24.847 22.198 1.00 0.00 H new ATOM 0 HA LEU A 62 -16.243 24.093 19.532 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -14.343 23.326 20.816 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -15.380 22.576 22.013 1.00 0.00 H new ATOM 0 HG LEU A 62 -16.123 20.917 20.350 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -14.960 20.751 18.184 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -15.876 22.270 18.327 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -14.108 22.275 18.530 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -13.997 19.680 20.187 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -13.108 21.162 20.612 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -14.211 20.417 21.793 1.00 0.00 H new ATOM 925 N CYS A 63 -18.224 22.601 21.723 1.00 0.00 N ATOM 926 CA CYS A 63 -19.476 21.863 21.856 1.00 0.00 C ATOM 927 C CYS A 63 -20.660 22.720 21.421 1.00 0.00 C ATOM 928 O CYS A 63 -21.697 22.200 21.011 1.00 0.00 O ATOM 929 CB CYS A 63 -19.668 21.401 23.301 1.00 0.00 C ATOM 930 SG CYS A 63 -19.226 19.671 23.588 1.00 0.00 S ATOM 0 H CYS A 63 -17.765 22.817 22.608 1.00 0.00 H new ATOM 0 HA CYS A 63 -19.426 20.989 21.207 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -19.067 22.032 23.956 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -20.710 21.550 23.583 1.00 0.00 H new ATOM 0 HG CYS A 63 -20.098 18.899 23.010 1.00 0.00 H new ATOM 936 N ASN A 64 -20.499 24.036 21.516 1.00 0.00 N ATOM 937 CA ASN A 64 -21.556 24.965 21.134 1.00 0.00 C ATOM 938 C ASN A 64 -21.607 25.138 19.619 1.00 0.00 C ATOM 939 O ASN A 64 -22.675 25.360 19.046 1.00 0.00 O ATOM 940 CB ASN A 64 -21.338 26.322 21.807 1.00 0.00 C ATOM 941 CG ASN A 64 -22.502 26.721 22.694 1.00 0.00 C ATOM 942 OD1 ASN A 64 -23.524 27.211 22.212 1.00 0.00 O ATOM 943 ND2 ASN A 64 -22.351 26.513 23.997 1.00 0.00 N ATOM 0 H ASN A 64 -19.647 24.483 21.854 1.00 0.00 H new ATOM 0 HA ASN A 64 -22.508 24.551 21.466 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -20.426 26.287 22.403 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -21.190 27.084 21.042 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -23.100 26.762 24.643 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -21.486 26.104 24.351 1.00 0.00 H new ATOM 950 N CYS A 65 -20.449 25.035 18.978 1.00 0.00 N ATOM 951 CA CYS A 65 -20.361 25.181 17.529 1.00 0.00 C ATOM 952 C CYS A 65 -21.360 24.265 16.830 1.00 0.00 C ATOM 953 O CYS A 65 -21.602 23.141 17.270 1.00 0.00 O ATOM 954 CB CYS A 65 -18.943 24.869 17.050 1.00 0.00 C ATOM 955 SG CYS A 65 -17.880 26.324 16.894 1.00 0.00 S ATOM 0 H CYS A 65 -19.557 24.851 19.438 1.00 0.00 H new ATOM 0 HA CYS A 65 -20.603 26.213 17.276 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -18.482 24.168 17.746 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -18.999 24.368 16.084 1.00 0.00 H new ATOM 0 HG CYS A 65 -18.501 27.245 16.219 1.00 0.00 H new ATOM 961 N ALA A 66 -21.939 24.754 15.738 1.00 0.00 N ATOM 962 CA ALA A 66 -22.912 23.980 14.977 1.00 0.00 C ATOM 963 C ALA A 66 -22.219 23.003 14.033 1.00 0.00 C ATOM 964 O ALA A 66 -21.050 23.180 13.689 1.00 0.00 O ATOM 965 CB ALA A 66 -23.832 24.908 14.197 1.00 0.00 C ATOM 0 H ALA A 66 -21.751 25.683 15.361 1.00 0.00 H new ATOM 0 HA ALA A 66 -23.510 23.402 15.681 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -24.553 24.316 13.634 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -24.362 25.562 14.890 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -23.241 25.512 13.508 1.00 0.00 H new ATOM 971 N LEU A 67 -22.946 21.971 13.619 1.00 0.00 N ATOM 972 CA LEU A 67 -22.401 20.965 12.715 1.00 0.00 C ATOM 973 C LEU A 67 -21.783 21.618 11.483 1.00 0.00 C ATOM 974 O LEU A 67 -20.590 21.469 11.222 1.00 0.00 O ATOM 975 CB LEU A 67 -23.496 19.984 12.292 1.00 0.00 C ATOM 976 CG LEU A 67 -23.188 19.121 11.067 1.00 0.00 C ATOM 977 CD1 LEU A 67 -21.851 18.416 11.234 1.00 0.00 C ATOM 978 CD2 LEU A 67 -24.301 18.111 10.833 1.00 0.00 C ATOM 0 H LEU A 67 -23.914 21.809 13.895 1.00 0.00 H new ATOM 0 HA LEU A 67 -21.620 20.421 13.245 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -23.709 19.324 13.133 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -24.406 20.550 12.093 1.00 0.00 H new ATOM 0 HG LEU A 67 -23.126 19.771 10.194 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -21.648 17.807 10.353 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -21.061 19.158 11.352 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -21.884 17.778 12.117 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -24.065 17.506 9.958 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -24.396 17.465 11.706 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -25.241 18.637 10.667 1.00 0.00 H new ATOM 990 N GLU A 68 -22.604 22.343 10.729 1.00 0.00 N ATOM 991 CA GLU A 68 -22.137 23.019 9.525 1.00 0.00 C ATOM 992 C GLU A 68 -20.904 23.868 9.821 1.00 0.00 C ATOM 993 O GLU A 68 -20.022 24.016 8.976 1.00 0.00 O ATOM 994 CB GLU A 68 -23.246 23.898 8.944 1.00 0.00 C ATOM 995 CG GLU A 68 -23.765 24.945 9.915 1.00 0.00 C ATOM 996 CD GLU A 68 -25.037 25.612 9.429 1.00 0.00 C ATOM 997 OE1 GLU A 68 -25.603 25.147 8.417 1.00 0.00 O ATOM 998 OE2 GLU A 68 -25.467 26.600 10.061 1.00 0.00 O ATOM 0 H GLU A 68 -23.595 22.477 10.931 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.866 22.257 8.794 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -22.871 24.397 8.050 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -24.075 23.263 8.631 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -23.951 24.478 10.882 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -22.998 25.704 10.070 1.00 0.00 H new ATOM 1005 N GLU A 69 -20.851 24.423 11.028 1.00 0.00 N ATOM 1006 CA GLU A 69 -19.727 25.258 11.436 1.00 0.00 C ATOM 1007 C GLU A 69 -18.430 24.454 11.452 1.00 0.00 C ATOM 1008 O GLU A 69 -17.436 24.844 10.837 1.00 0.00 O ATOM 1009 CB GLU A 69 -19.984 25.859 12.819 1.00 0.00 C ATOM 1010 CG GLU A 69 -20.141 27.370 12.806 1.00 0.00 C ATOM 1011 CD GLU A 69 -20.420 27.940 14.183 1.00 0.00 C ATOM 1012 OE1 GLU A 69 -20.619 27.145 15.125 1.00 0.00 O ATOM 1013 OE2 GLU A 69 -20.439 29.181 14.319 1.00 0.00 O ATOM 0 H GLU A 69 -21.573 24.310 11.740 1.00 0.00 H new ATOM 0 HA GLU A 69 -19.626 26.065 10.711 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -20.885 25.412 13.238 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -19.159 25.593 13.480 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -19.233 27.822 12.407 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -20.955 27.641 12.133 1.00 0.00 H new ATOM 1020 N LEU A 70 -18.446 23.330 12.160 1.00 0.00 N ATOM 1021 CA LEU A 70 -17.271 22.471 12.258 1.00 0.00 C ATOM 1022 C LEU A 70 -16.801 22.032 10.875 1.00 0.00 C ATOM 1023 O LEU A 70 -15.625 21.728 10.676 1.00 0.00 O ATOM 1024 CB LEU A 70 -17.584 21.243 13.116 1.00 0.00 C ATOM 1025 CG LEU A 70 -18.227 21.520 14.475 1.00 0.00 C ATOM 1026 CD1 LEU A 70 -18.672 20.222 15.130 1.00 0.00 C ATOM 1027 CD2 LEU A 70 -17.261 22.272 15.379 1.00 0.00 C ATOM 0 H LEU A 70 -19.259 22.992 12.675 1.00 0.00 H new ATOM 0 HA LEU A 70 -16.471 23.042 12.729 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -18.246 20.588 12.550 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -16.657 20.694 13.280 1.00 0.00 H new ATOM 0 HG LEU A 70 -19.107 22.144 14.318 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -19.127 20.439 16.096 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -19.400 19.722 14.490 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -17.809 19.572 15.274 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -17.736 22.461 16.342 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -16.362 21.674 15.528 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -16.992 23.221 14.915 1.00 0.00 H new ATOM 1039 N ARG A 71 -17.727 22.005 9.922 1.00 0.00 N ATOM 1040 CA ARG A 71 -17.406 21.605 8.557 1.00 0.00 C ATOM 1041 C ARG A 71 -16.745 22.750 7.795 1.00 0.00 C ATOM 1042 O ARG A 71 -16.054 22.531 6.800 1.00 0.00 O ATOM 1043 CB ARG A 71 -18.671 21.154 7.824 1.00 0.00 C ATOM 1044 CG ARG A 71 -19.312 19.912 8.422 1.00 0.00 C ATOM 1045 CD ARG A 71 -20.759 19.763 7.979 1.00 0.00 C ATOM 1046 NE ARG A 71 -21.048 18.415 7.497 1.00 0.00 N ATOM 1047 CZ ARG A 71 -22.139 18.099 6.810 1.00 0.00 C ATOM 1048 NH1 ARG A 71 -23.040 19.029 6.524 1.00 0.00 N ATOM 1049 NH2 ARG A 71 -22.332 16.850 6.406 1.00 0.00 N ATOM 0 H ARG A 71 -18.705 22.255 10.070 1.00 0.00 H new ATOM 0 HA ARG A 71 -16.705 20.772 8.605 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -19.396 21.968 7.834 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -18.426 20.959 6.780 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -18.746 19.030 8.123 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -19.267 19.966 9.510 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -21.420 19.999 8.813 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -20.972 20.484 7.190 1.00 0.00 H new ATOM 0 HE ARG A 71 -20.375 17.676 7.699 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -22.896 19.991 6.832 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -23.877 18.783 5.996 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -21.642 16.131 6.623 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -23.171 16.609 5.878 1.00 0.00 H new ATOM 1063 N LEU A 72 -16.962 23.972 8.270 1.00 0.00 N ATOM 1064 CA LEU A 72 -16.388 25.153 7.634 1.00 0.00 C ATOM 1065 C LEU A 72 -15.050 25.516 8.268 1.00 0.00 C ATOM 1066 O LEU A 72 -14.268 26.278 7.699 1.00 0.00 O ATOM 1067 CB LEU A 72 -17.354 26.334 7.742 1.00 0.00 C ATOM 1068 CG LEU A 72 -18.203 26.622 6.502 1.00 0.00 C ATOM 1069 CD1 LEU A 72 -19.510 25.846 6.558 1.00 0.00 C ATOM 1070 CD2 LEU A 72 -18.471 28.114 6.375 1.00 0.00 C ATOM 0 H LEU A 72 -17.531 24.171 9.093 1.00 0.00 H new ATOM 0 HA LEU A 72 -16.220 24.924 6.582 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -18.024 26.154 8.583 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -16.778 27.228 7.979 1.00 0.00 H new ATOM 0 HG LEU A 72 -17.649 26.296 5.622 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -20.101 26.063 5.668 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -19.297 24.778 6.600 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -20.070 26.140 7.446 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -19.076 28.301 5.488 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -19.005 28.464 7.259 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -17.525 28.648 6.288 1.00 0.00 H new ATOM 1082 N VAL A 73 -14.791 24.965 9.450 1.00 0.00 N ATOM 1083 CA VAL A 73 -13.545 25.228 10.160 1.00 0.00 C ATOM 1084 C VAL A 73 -12.564 24.073 9.996 1.00 0.00 C ATOM 1085 O VAL A 73 -11.349 24.266 10.039 1.00 0.00 O ATOM 1086 CB VAL A 73 -13.795 25.466 11.661 1.00 0.00 C ATOM 1087 CG1 VAL A 73 -12.482 25.719 12.387 1.00 0.00 C ATOM 1088 CG2 VAL A 73 -14.758 26.625 11.864 1.00 0.00 C ATOM 0 H VAL A 73 -15.428 24.334 9.936 1.00 0.00 H new ATOM 0 HA VAL A 73 -13.116 26.129 9.723 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.249 24.569 12.083 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -12.678 25.885 13.446 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -11.829 24.854 12.270 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -11.997 26.599 11.965 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -14.923 26.779 12.930 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.335 27.530 11.428 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.708 26.398 11.379 1.00 0.00 H new ATOM 1098 N PHE A 74 -13.099 22.872 9.806 1.00 0.00 N ATOM 1099 CA PHE A 74 -12.271 21.684 9.635 1.00 0.00 C ATOM 1100 C PHE A 74 -12.560 21.007 8.299 1.00 0.00 C ATOM 1101 O PHE A 74 -12.325 19.810 8.133 1.00 0.00 O ATOM 1102 CB PHE A 74 -12.512 20.699 10.781 1.00 0.00 C ATOM 1103 CG PHE A 74 -12.624 21.360 12.126 1.00 0.00 C ATOM 1104 CD1 PHE A 74 -11.566 22.087 12.645 1.00 0.00 C ATOM 1105 CD2 PHE A 74 -13.788 21.253 12.869 1.00 0.00 C ATOM 1106 CE1 PHE A 74 -11.666 22.695 13.882 1.00 0.00 C ATOM 1107 CE2 PHE A 74 -13.895 21.860 14.107 1.00 0.00 C ATOM 1108 CZ PHE A 74 -12.833 22.582 14.613 1.00 0.00 C ATOM 0 H PHE A 74 -14.103 22.695 9.767 1.00 0.00 H new ATOM 0 HA PHE A 74 -11.227 21.995 9.646 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -13.426 20.140 10.583 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -11.696 19.977 10.807 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -10.652 22.180 12.077 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -14.622 20.689 12.477 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -10.833 23.258 14.277 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -14.808 21.769 14.677 1.00 0.00 H new ATOM 0 HZ PHE A 74 -12.914 23.058 15.579 1.00 0.00 H new ATOM 1118 N GLY A 75 -13.072 21.782 7.348 1.00 0.00 N ATOM 1119 CA GLY A 75 -13.386 21.241 6.038 1.00 0.00 C ATOM 1120 C GLY A 75 -14.400 20.116 6.104 1.00 0.00 C ATOM 1121 O GLY A 75 -15.258 20.076 6.986 1.00 0.00 O ATOM 0 H GLY A 75 -13.275 22.775 7.461 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -13.772 22.038 5.402 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -12.472 20.875 5.571 1.00 0.00 H new ATOM 1125 N PRO A 76 -14.309 19.176 5.151 1.00 0.00 N ATOM 1126 CA PRO A 76 -15.219 18.028 5.082 1.00 0.00 C ATOM 1127 C PRO A 76 -14.990 17.038 6.219 1.00 0.00 C ATOM 1128 O PRO A 76 -15.749 16.082 6.386 1.00 0.00 O ATOM 1129 CB PRO A 76 -14.877 17.385 3.736 1.00 0.00 C ATOM 1130 CG PRO A 76 -13.468 17.790 3.469 1.00 0.00 C ATOM 1131 CD PRO A 76 -13.311 19.160 4.069 1.00 0.00 C ATOM 0 HA PRO A 76 -16.263 18.329 5.173 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -14.976 16.300 3.779 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -15.545 17.735 2.949 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -12.768 17.085 3.917 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -13.263 17.807 2.399 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -12.302 19.318 4.451 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -13.501 19.944 3.336 1.00 0.00 H new ATOM 1139 N LEU A 77 -13.940 17.272 6.999 1.00 0.00 N ATOM 1140 CA LEU A 77 -13.612 16.401 8.122 1.00 0.00 C ATOM 1141 C LEU A 77 -14.566 16.633 9.289 1.00 0.00 C ATOM 1142 O LEU A 77 -14.776 15.749 10.118 1.00 0.00 O ATOM 1143 CB LEU A 77 -12.169 16.638 8.572 1.00 0.00 C ATOM 1144 CG LEU A 77 -11.653 15.720 9.681 1.00 0.00 C ATOM 1145 CD1 LEU A 77 -11.883 14.262 9.317 1.00 0.00 C ATOM 1146 CD2 LEU A 77 -10.177 15.980 9.943 1.00 0.00 C ATOM 0 H LEU A 77 -13.301 18.058 6.874 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.718 15.368 7.791 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -11.517 16.530 7.705 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -12.080 17.670 8.911 1.00 0.00 H new ATOM 0 HG LEU A 77 -12.208 15.936 10.594 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.510 13.624 10.118 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -12.950 14.085 9.180 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -11.355 14.030 8.392 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -9.826 15.318 10.735 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -9.607 15.791 9.033 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -10.039 17.017 10.249 1.00 0.00 H new ATOM 1158 N GLY A 78 -15.143 17.830 9.346 1.00 0.00 N ATOM 1159 CA GLY A 78 -16.070 18.156 10.414 1.00 0.00 C ATOM 1160 C GLY A 78 -17.170 17.124 10.563 1.00 0.00 C ATOM 1161 O GLY A 78 -17.558 16.778 11.679 1.00 0.00 O ATOM 0 H GLY A 78 -14.985 18.579 8.672 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -15.523 18.237 11.353 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -16.515 19.132 10.219 1.00 0.00 H new ATOM 1165 N ASP A 79 -17.675 16.633 9.436 1.00 0.00 N ATOM 1166 CA ASP A 79 -18.738 15.635 9.446 1.00 0.00 C ATOM 1167 C ASP A 79 -18.367 14.455 10.339 1.00 0.00 C ATOM 1168 O ASP A 79 -19.237 13.810 10.924 1.00 0.00 O ATOM 1169 CB ASP A 79 -19.020 15.146 8.025 1.00 0.00 C ATOM 1170 CG ASP A 79 -20.335 14.397 7.921 1.00 0.00 C ATOM 1171 OD1 ASP A 79 -21.224 14.640 8.764 1.00 0.00 O ATOM 1172 OD2 ASP A 79 -20.474 13.570 6.996 1.00 0.00 O ATOM 0 H ASP A 79 -17.365 16.910 8.504 1.00 0.00 H new ATOM 0 HA ASP A 79 -19.638 16.102 9.847 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -19.036 15.999 7.347 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -18.208 14.496 7.700 1.00 0.00 H new ATOM 1177 N GLN A 80 -17.071 14.179 10.439 1.00 0.00 N ATOM 1178 CA GLN A 80 -16.586 13.075 11.259 1.00 0.00 C ATOM 1179 C GLN A 80 -16.334 13.532 12.692 1.00 0.00 C ATOM 1180 O GLN A 80 -16.718 12.856 13.647 1.00 0.00 O ATOM 1181 CB GLN A 80 -15.302 12.495 10.663 1.00 0.00 C ATOM 1182 CG GLN A 80 -15.528 11.706 9.383 1.00 0.00 C ATOM 1183 CD GLN A 80 -16.624 10.668 9.524 1.00 0.00 C ATOM 1184 OE1 GLN A 80 -16.535 9.762 10.354 1.00 0.00 O ATOM 1185 NE2 GLN A 80 -17.667 10.794 8.711 1.00 0.00 N ATOM 0 H GLN A 80 -16.338 14.704 9.963 1.00 0.00 H new ATOM 0 HA GLN A 80 -17.353 12.301 11.273 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -14.605 13.309 10.460 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -14.829 11.847 11.401 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.785 12.394 8.577 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -14.600 11.212 9.096 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -17.700 11.560 8.038 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -18.435 10.125 8.760 1.00 0.00 H new ATOM 1194 N LEU A 81 -15.685 14.683 12.836 1.00 0.00 N ATOM 1195 CA LEU A 81 -15.382 15.230 14.153 1.00 0.00 C ATOM 1196 C LEU A 81 -16.656 15.432 14.966 1.00 0.00 C ATOM 1197 O LEU A 81 -16.689 15.159 16.167 1.00 0.00 O ATOM 1198 CB LEU A 81 -14.636 16.559 14.015 1.00 0.00 C ATOM 1199 CG LEU A 81 -13.321 16.513 13.235 1.00 0.00 C ATOM 1200 CD1 LEU A 81 -12.814 17.920 12.961 1.00 0.00 C ATOM 1201 CD2 LEU A 81 -12.278 15.706 13.995 1.00 0.00 C ATOM 0 H LEU A 81 -15.359 15.255 12.057 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.748 14.516 14.678 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.298 17.276 13.529 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -14.429 16.942 15.014 1.00 0.00 H new ATOM 0 HG LEU A 81 -13.504 16.023 12.279 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.878 17.868 12.405 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.554 18.466 12.375 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.647 18.437 13.906 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -11.349 15.684 13.425 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -12.097 16.167 14.966 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -12.640 14.688 14.139 1.00 0.00 H new ATOM 1213 N HIS A 82 -17.705 15.910 14.304 1.00 0.00 N ATOM 1214 CA HIS A 82 -18.984 16.145 14.965 1.00 0.00 C ATOM 1215 C HIS A 82 -19.505 14.865 15.611 1.00 0.00 C ATOM 1216 O HIS A 82 -19.847 14.850 16.793 1.00 0.00 O ATOM 1217 CB HIS A 82 -20.009 16.680 13.964 1.00 0.00 C ATOM 1218 CG HIS A 82 -21.364 16.909 14.559 1.00 0.00 C ATOM 1219 ND1 HIS A 82 -22.433 16.066 14.343 1.00 0.00 N ATOM 1220 CD2 HIS A 82 -21.820 17.893 15.368 1.00 0.00 C ATOM 1221 CE1 HIS A 82 -23.489 16.522 14.992 1.00 0.00 C ATOM 1222 NE2 HIS A 82 -23.144 17.630 15.623 1.00 0.00 N ATOM 0 H HIS A 82 -17.695 16.142 13.311 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.830 16.888 15.747 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -19.642 17.617 13.546 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -20.099 15.976 13.137 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -21.249 18.730 15.743 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -24.468 16.066 15.005 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -23.760 18.198 16.205 1.00 0.00 H new ATOM 1230 N ALA A 83 -19.565 13.794 14.826 1.00 0.00 N ATOM 1231 CA ALA A 83 -20.043 12.510 15.322 1.00 0.00 C ATOM 1232 C ALA A 83 -19.300 12.099 16.589 1.00 0.00 C ATOM 1233 O ALA A 83 -19.865 11.446 17.465 1.00 0.00 O ATOM 1234 CB ALA A 83 -19.893 11.441 14.250 1.00 0.00 C ATOM 0 H ALA A 83 -19.288 13.791 13.844 1.00 0.00 H new ATOM 0 HA ALA A 83 -21.099 12.615 15.570 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -20.254 10.487 14.634 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -20.475 11.722 13.372 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -18.843 11.347 13.974 1.00 0.00 H new ATOM 1240 N GLN A 84 -18.032 12.486 16.677 1.00 0.00 N ATOM 1241 CA GLN A 84 -17.212 12.155 17.836 1.00 0.00 C ATOM 1242 C GLN A 84 -17.607 13.002 19.042 1.00 0.00 C ATOM 1243 O GLN A 84 -17.920 12.474 20.109 1.00 0.00 O ATOM 1244 CB GLN A 84 -15.730 12.363 17.516 1.00 0.00 C ATOM 1245 CG GLN A 84 -15.131 11.255 16.665 1.00 0.00 C ATOM 1246 CD GLN A 84 -14.128 10.412 17.428 1.00 0.00 C ATOM 1247 OE1 GLN A 84 -13.109 10.916 17.901 1.00 0.00 O ATOM 1248 NE2 GLN A 84 -14.412 9.121 17.551 1.00 0.00 N ATOM 0 H GLN A 84 -17.550 13.029 15.960 1.00 0.00 H new ATOM 0 HA GLN A 84 -17.380 11.106 18.080 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.609 13.314 16.998 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -15.172 12.435 18.449 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -15.931 10.614 16.294 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -14.644 11.694 15.794 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -15.268 8.746 17.143 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.774 8.504 18.054 1.00 0.00 H new ATOM 1257 N LEU A 85 -17.591 14.319 18.864 1.00 0.00 N ATOM 1258 CA LEU A 85 -17.947 15.240 19.938 1.00 0.00 C ATOM 1259 C LEU A 85 -19.326 14.911 20.501 1.00 0.00 C ATOM 1260 O LEU A 85 -19.603 15.158 21.675 1.00 0.00 O ATOM 1261 CB LEU A 85 -17.922 16.682 19.428 1.00 0.00 C ATOM 1262 CG LEU A 85 -16.559 17.375 19.443 1.00 0.00 C ATOM 1263 CD1 LEU A 85 -16.560 18.573 18.506 1.00 0.00 C ATOM 1264 CD2 LEU A 85 -16.192 17.801 20.857 1.00 0.00 C ATOM 0 H LEU A 85 -17.336 14.772 17.987 1.00 0.00 H new ATOM 0 HA LEU A 85 -17.213 15.131 20.737 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -18.301 16.692 18.406 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -18.614 17.271 20.030 1.00 0.00 H new ATOM 0 HG LEU A 85 -15.808 16.666 19.093 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -15.582 19.054 18.529 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -16.777 18.241 17.491 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -17.322 19.284 18.825 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -15.219 18.292 20.848 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -16.944 18.493 21.235 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -16.149 16.923 21.502 1.00 0.00 H new ATOM 1276 N ARG A 86 -20.187 14.351 19.657 1.00 0.00 N ATOM 1277 CA ARG A 86 -21.536 13.988 20.071 1.00 0.00 C ATOM 1278 C ARG A 86 -21.508 12.828 21.062 1.00 0.00 C ATOM 1279 O ARG A 86 -22.377 12.715 21.926 1.00 0.00 O ATOM 1280 CB ARG A 86 -22.382 13.612 18.853 1.00 0.00 C ATOM 1281 CG ARG A 86 -23.104 14.792 18.225 1.00 0.00 C ATOM 1282 CD ARG A 86 -24.540 14.441 17.867 1.00 0.00 C ATOM 1283 NE ARG A 86 -25.478 14.841 18.912 1.00 0.00 N ATOM 1284 CZ ARG A 86 -26.781 14.998 18.708 1.00 0.00 C ATOM 1285 NH1 ARG A 86 -27.298 14.791 17.505 1.00 0.00 N ATOM 1286 NH2 ARG A 86 -27.571 15.363 19.710 1.00 0.00 N ATOM 0 H ARG A 86 -19.974 14.139 18.682 1.00 0.00 H new ATOM 0 HA ARG A 86 -21.983 14.852 20.563 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -21.739 13.150 18.104 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -23.117 12.863 19.149 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -23.096 15.635 18.916 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -22.572 15.110 17.329 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -24.810 14.930 16.931 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -24.620 13.367 17.700 1.00 0.00 H new ATOM 0 HE ARG A 86 -25.113 15.009 19.849 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -26.695 14.510 16.732 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -28.299 14.913 17.352 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -27.178 15.523 20.637 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -28.572 15.483 19.553 1.00 0.00 H new ATOM 1300 N ASP A 87 -20.503 11.968 20.929 1.00 0.00 N ATOM 1301 CA ASP A 87 -20.361 10.817 21.812 1.00 0.00 C ATOM 1302 C ASP A 87 -19.669 11.212 23.113 1.00 0.00 C ATOM 1303 O ASP A 87 -19.950 10.652 24.174 1.00 0.00 O ATOM 1304 CB ASP A 87 -19.569 9.708 21.117 1.00 0.00 C ATOM 1305 CG ASP A 87 -20.399 8.460 20.888 1.00 0.00 C ATOM 1306 OD1 ASP A 87 -21.433 8.555 20.195 1.00 0.00 O ATOM 1307 OD2 ASP A 87 -20.015 7.389 21.403 1.00 0.00 O ATOM 0 H ASP A 87 -19.776 12.047 20.218 1.00 0.00 H new ATOM 0 HA ASP A 87 -21.359 10.448 22.049 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -19.199 10.075 20.160 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -18.697 9.455 21.720 1.00 0.00 H new ATOM 1312 N LEU A 88 -18.764 12.180 23.026 1.00 0.00 N ATOM 1313 CA LEU A 88 -18.031 12.651 24.196 1.00 0.00 C ATOM 1314 C LEU A 88 -18.982 13.234 25.236 1.00 0.00 C ATOM 1315 O LEU A 88 -18.804 13.034 26.438 1.00 0.00 O ATOM 1316 CB LEU A 88 -16.998 13.702 23.786 1.00 0.00 C ATOM 1317 CG LEU A 88 -15.718 13.170 23.142 1.00 0.00 C ATOM 1318 CD1 LEU A 88 -15.046 14.254 22.314 1.00 0.00 C ATOM 1319 CD2 LEU A 88 -14.766 12.640 24.205 1.00 0.00 C ATOM 0 H LEU A 88 -18.520 12.655 22.157 1.00 0.00 H new ATOM 0 HA LEU A 88 -17.516 11.799 24.639 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.471 14.394 23.089 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -16.724 14.277 24.670 1.00 0.00 H new ATOM 0 HG LEU A 88 -15.983 12.347 22.478 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.137 13.856 21.863 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.725 14.585 21.529 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.794 15.098 22.956 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.860 12.265 23.728 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.507 13.443 24.895 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.248 11.831 24.754 1.00 0.00 H new ATOM 1331 N THR A 89 -19.995 13.955 24.766 1.00 0.00 N ATOM 1332 CA THR A 89 -20.975 14.566 25.654 1.00 0.00 C ATOM 1333 C THR A 89 -22.103 13.594 25.981 1.00 0.00 C ATOM 1334 O THR A 89 -22.649 13.610 27.084 1.00 0.00 O ATOM 1335 CB THR A 89 -21.576 15.842 25.035 1.00 0.00 C ATOM 1336 OG1 THR A 89 -21.854 15.629 23.646 1.00 0.00 O ATOM 1337 CG2 THR A 89 -20.626 17.020 25.192 1.00 0.00 C ATOM 0 H THR A 89 -20.158 14.130 23.774 1.00 0.00 H new ATOM 0 HA THR A 89 -20.448 14.829 26.571 1.00 0.00 H new ATOM 0 HB THR A 89 -22.503 16.071 25.560 1.00 0.00 H new ATOM 0 HG1 THR A 89 -22.237 16.444 23.260 1.00 0.00 H new ATOM 0 HG21 THR A 89 -21.073 17.909 24.747 1.00 0.00 H new ATOM 0 HG22 THR A 89 -20.440 17.199 26.251 1.00 0.00 H new ATOM 0 HG23 THR A 89 -19.684 16.797 24.690 1.00 0.00 H new ATOM 1345 N SER A 90 -22.446 12.747 25.016 1.00 0.00 N ATOM 1346 CA SER A 90 -23.512 11.769 25.201 1.00 0.00 C ATOM 1347 C SER A 90 -23.148 10.770 26.294 1.00 0.00 C ATOM 1348 O SER A 90 -23.869 10.622 27.281 1.00 0.00 O ATOM 1349 CB SER A 90 -23.787 11.030 23.890 1.00 0.00 C ATOM 1350 OG SER A 90 -24.588 11.813 23.021 1.00 0.00 O ATOM 0 H SER A 90 -22.002 12.718 24.098 1.00 0.00 H new ATOM 0 HA SER A 90 -24.413 12.302 25.505 1.00 0.00 H new ATOM 0 HB2 SER A 90 -22.844 10.788 23.401 1.00 0.00 H new ATOM 0 HB3 SER A 90 -24.289 10.085 24.100 1.00 0.00 H new ATOM 0 HG SER A 90 -24.011 12.316 22.409 1.00 0.00 H new ATOM 1356 N SER A 91 -22.023 10.085 26.111 1.00 0.00 N ATOM 1357 CA SER A 91 -21.564 9.096 27.079 1.00 0.00 C ATOM 1358 C SER A 91 -20.151 8.625 26.747 1.00 0.00 C ATOM 1359 O SER A 91 -19.827 8.370 25.587 1.00 0.00 O ATOM 1360 CB SER A 91 -22.518 7.900 27.110 1.00 0.00 C ATOM 1361 OG SER A 91 -22.739 7.458 28.438 1.00 0.00 O ATOM 0 H SER A 91 -21.413 10.197 25.301 1.00 0.00 H new ATOM 0 HA SER A 91 -21.550 9.566 28.062 1.00 0.00 H new ATOM 0 HB2 SER A 91 -23.468 8.177 26.653 1.00 0.00 H new ATOM 0 HB3 SER A 91 -22.104 7.085 26.516 1.00 0.00 H new ATOM 0 HG SER A 91 -23.353 6.694 28.431 1.00 0.00 H new ATOM 1367 N SER A 92 -19.315 8.512 27.774 1.00 0.00 N ATOM 1368 CA SER A 92 -17.936 8.076 27.591 1.00 0.00 C ATOM 1369 C SER A 92 -17.877 6.596 27.227 1.00 0.00 C ATOM 1370 O SER A 92 -17.095 6.187 26.371 1.00 0.00 O ATOM 1371 CB SER A 92 -17.125 8.332 28.863 1.00 0.00 C ATOM 1372 OG SER A 92 -17.835 7.909 30.014 1.00 0.00 O ATOM 0 H SER A 92 -19.568 8.716 28.741 1.00 0.00 H new ATOM 0 HA SER A 92 -17.505 8.651 26.771 1.00 0.00 H new ATOM 0 HB2 SER A 92 -16.174 7.803 28.804 1.00 0.00 H new ATOM 0 HB3 SER A 92 -16.895 9.394 28.944 1.00 0.00 H new ATOM 0 HG SER A 92 -17.295 8.082 30.813 1.00 0.00 H new TER 1378 SER A 92