USER MOD reduce.3.24.130724 H: found=0, std=0, add=772, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 766 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 82 SER OG : rot 121:sc= -0.134 USER MOD Set 1.2: A 89 HIS : no HD1:sc= -1.76 X(o=-2.7,f=-3.2!) USER MOD Set 1.3: A 93 SER OG : rot -164:sc= -0.837 USER MOD Set 2.1: A 49 SER OG : rot -42:sc= 0.877 USER MOD Set 2.2: A 51 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 43 MET CE :methyl -128:sc= -6.34! (180deg=-9.68!) USER MOD Set 3.2: A 67 HIS : no HD1:sc= -0.955 K(o=-7.3,f=-8.3) USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.0625 (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 -14:sc= 0.635 USER MOD Single : A 6 SER OG : rot 9:sc= 0.413 USER MOD Single : A 10 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0348) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot -4:sc= 1 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 27:sc= -1.38 USER MOD Single : A 32 ASN : amide:sc= 0.326 K(o=0.33,f=-3!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 40 SER OG : rot 180:sc= -0.0683 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 12:sc= 0.321 USER MOD Single : A 46 HIS : no HD1:sc= -4.14! C(o=-4.1!,f=-6.8!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= 0.465 K(o=0.46,f=-0.088) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 180:sc=-0.00318 USER MOD Single : A 74 GLN : amide:sc= -0.66 K(o=-0.66,f=-0.0037) USER MOD Single : A 76 MET CE :methyl -125:sc= -0.0797 (180deg=-0.698) USER MOD Single : A 79 HIS : no HD1:sc= -11! C(o=-11!,f=-11!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc=-0.00208 K(o=-0.0021,f=-0.55) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.00616 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.005 2.840 -11.218 1.00 0.00 N ATOM 2 CA GLY A 1 12.302 2.008 -12.369 1.00 0.00 C ATOM 3 C GLY A 1 13.789 1.898 -12.637 1.00 0.00 C ATOM 4 O GLY A 1 14.569 2.748 -12.207 1.00 0.00 O ATOM 0 H1 GLY A 1 11.650 2.245 -10.442 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.870 3.330 -10.911 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.282 3.542 -11.475 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.890 1.012 -12.209 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.807 2.420 -13.248 1.00 0.00 H new ATOM 8 N SER A 2 14.185 0.847 -13.349 1.00 0.00 N ATOM 9 CA SER A 2 15.590 0.626 -13.669 1.00 0.00 C ATOM 10 C SER A 2 16.477 0.947 -12.470 1.00 0.00 C ATOM 11 O SER A 2 17.532 1.565 -12.612 1.00 0.00 O ATOM 12 CB SER A 2 16.003 1.483 -14.868 1.00 0.00 C ATOM 13 OG SER A 2 17.105 0.910 -15.549 1.00 0.00 O ATOM 0 H SER A 2 13.552 0.136 -13.715 1.00 0.00 H new ATOM 0 HA SER A 2 15.718 -0.426 -13.922 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.161 1.585 -15.553 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.262 2.486 -14.530 1.00 0.00 H new ATOM 0 HG SER A 2 17.348 1.476 -16.311 1.00 0.00 H new ATOM 19 N SER A 3 16.041 0.521 -11.289 1.00 0.00 N ATOM 20 CA SER A 3 16.793 0.766 -10.064 1.00 0.00 C ATOM 21 C SER A 3 17.747 -0.389 -9.772 1.00 0.00 C ATOM 22 O SER A 3 18.954 -0.192 -9.635 1.00 0.00 O ATOM 23 CB SER A 3 15.838 0.962 -8.885 1.00 0.00 C ATOM 24 OG SER A 3 16.550 1.249 -7.694 1.00 0.00 O ATOM 0 H SER A 3 15.172 0.005 -11.154 1.00 0.00 H new ATOM 0 HA SER A 3 17.380 1.674 -10.203 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.147 1.776 -9.104 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.238 0.063 -8.746 1.00 0.00 H new ATOM 0 HG SER A 3 15.917 1.372 -6.956 1.00 0.00 H new ATOM 30 N GLY A 4 17.196 -1.595 -9.680 1.00 0.00 N ATOM 31 CA GLY A 4 18.011 -2.764 -9.406 1.00 0.00 C ATOM 32 C GLY A 4 18.256 -2.965 -7.923 1.00 0.00 C ATOM 33 O GLY A 4 17.484 -2.492 -7.090 1.00 0.00 O ATOM 0 H GLY A 4 16.200 -1.784 -9.790 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.521 -3.648 -9.813 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.968 -2.665 -9.919 1.00 0.00 H new ATOM 37 N SER A 5 19.334 -3.670 -7.593 1.00 0.00 N ATOM 38 CA SER A 5 19.675 -3.938 -6.201 1.00 0.00 C ATOM 39 C SER A 5 21.164 -4.239 -6.055 1.00 0.00 C ATOM 40 O SER A 5 21.721 -5.046 -6.800 1.00 0.00 O ATOM 41 CB SER A 5 18.851 -5.111 -5.668 1.00 0.00 C ATOM 42 OG SER A 5 17.463 -4.848 -5.772 1.00 0.00 O ATOM 0 H SER A 5 19.986 -4.066 -8.271 1.00 0.00 H new ATOM 0 HA SER A 5 19.443 -3.047 -5.618 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.096 -6.015 -6.226 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.112 -5.299 -4.626 1.00 0.00 H new ATOM 0 HG SER A 5 17.323 -3.895 -5.954 1.00 0.00 H new ATOM 48 N SER A 6 21.802 -3.585 -5.090 1.00 0.00 N ATOM 49 CA SER A 6 23.227 -3.779 -4.848 1.00 0.00 C ATOM 50 C SER A 6 23.570 -3.514 -3.385 1.00 0.00 C ATOM 51 O SER A 6 23.534 -2.374 -2.924 1.00 0.00 O ATOM 52 CB SER A 6 24.049 -2.858 -5.751 1.00 0.00 C ATOM 53 OG SER A 6 24.040 -3.318 -7.091 1.00 0.00 O ATOM 0 H SER A 6 21.355 -2.916 -4.463 1.00 0.00 H new ATOM 0 HA SER A 6 23.472 -4.816 -5.079 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.646 -1.846 -5.708 1.00 0.00 H new ATOM 0 HB3 SER A 6 25.075 -2.808 -5.387 1.00 0.00 H new ATOM 0 HG SER A 6 23.394 -4.050 -7.181 1.00 0.00 H new ATOM 59 N GLY A 7 23.903 -4.578 -2.660 1.00 0.00 N ATOM 60 CA GLY A 7 24.247 -4.441 -1.257 1.00 0.00 C ATOM 61 C GLY A 7 23.028 -4.263 -0.374 1.00 0.00 C ATOM 62 O GLY A 7 22.165 -5.139 -0.313 1.00 0.00 O ATOM 0 H GLY A 7 23.941 -5.532 -3.019 1.00 0.00 H new ATOM 0 HA2 GLY A 7 24.800 -5.323 -0.934 1.00 0.00 H new ATOM 0 HA3 GLY A 7 24.911 -3.586 -1.131 1.00 0.00 H new ATOM 66 N ARG A 8 22.956 -3.126 0.311 1.00 0.00 N ATOM 67 CA ARG A 8 21.834 -2.838 1.197 1.00 0.00 C ATOM 68 C ARG A 8 21.663 -1.333 1.385 1.00 0.00 C ATOM 69 O ARG A 8 22.503 -0.674 1.997 1.00 0.00 O ATOM 70 CB ARG A 8 22.042 -3.512 2.554 1.00 0.00 C ATOM 71 CG ARG A 8 21.636 -4.977 2.575 1.00 0.00 C ATOM 72 CD ARG A 8 21.842 -5.592 3.950 1.00 0.00 C ATOM 73 NE ARG A 8 23.229 -5.485 4.396 1.00 0.00 N ATOM 74 CZ ARG A 8 23.645 -5.859 5.600 1.00 0.00 C ATOM 75 NH1 ARG A 8 22.786 -6.362 6.475 1.00 0.00 N ATOM 76 NH2 ARG A 8 24.924 -5.730 5.932 1.00 0.00 N ATOM 0 H ARG A 8 23.661 -2.390 0.270 1.00 0.00 H new ATOM 0 HA ARG A 8 20.929 -3.235 0.737 1.00 0.00 H new ATOM 0 HB2 ARG A 8 23.092 -3.431 2.833 1.00 0.00 H new ATOM 0 HB3 ARG A 8 21.469 -2.974 3.309 1.00 0.00 H new ATOM 0 HG2 ARG A 8 20.589 -5.070 2.287 1.00 0.00 H new ATOM 0 HG3 ARG A 8 22.220 -5.528 1.838 1.00 0.00 H new ATOM 0 HD2 ARG A 8 21.191 -5.096 4.670 1.00 0.00 H new ATOM 0 HD3 ARG A 8 21.549 -6.642 3.925 1.00 0.00 H new ATOM 0 HE ARG A 8 23.916 -5.102 3.746 1.00 0.00 H new ATOM 0 HH11 ARG A 8 21.802 -6.463 6.224 1.00 0.00 H new ATOM 0 HH12 ARG A 8 23.108 -6.649 7.399 1.00 0.00 H new ATOM 0 HH21 ARG A 8 25.588 -5.343 5.262 1.00 0.00 H new ATOM 0 HH22 ARG A 8 25.242 -6.018 6.857 1.00 0.00 H new ATOM 90 N VAL A 9 20.569 -0.796 0.853 1.00 0.00 N ATOM 91 CA VAL A 9 20.287 0.630 0.963 1.00 0.00 C ATOM 92 C VAL A 9 19.126 0.889 1.916 1.00 0.00 C ATOM 93 O VAL A 9 18.077 0.250 1.823 1.00 0.00 O ATOM 94 CB VAL A 9 19.957 1.244 -0.411 1.00 0.00 C ATOM 95 CG1 VAL A 9 19.654 2.728 -0.274 1.00 0.00 C ATOM 96 CG2 VAL A 9 21.101 1.012 -1.386 1.00 0.00 C ATOM 0 H VAL A 9 19.864 -1.327 0.342 1.00 0.00 H new ATOM 0 HA VAL A 9 21.187 1.102 1.357 1.00 0.00 H new ATOM 0 HB VAL A 9 19.068 0.752 -0.806 1.00 0.00 H new ATOM 0 HG11 VAL A 9 19.423 3.144 -1.255 1.00 0.00 H new ATOM 0 HG12 VAL A 9 18.800 2.865 0.389 1.00 0.00 H new ATOM 0 HG13 VAL A 9 20.522 3.240 0.142 1.00 0.00 H new ATOM 0 HG21 VAL A 9 20.851 1.452 -2.351 1.00 0.00 H new ATOM 0 HG22 VAL A 9 22.008 1.476 -0.999 1.00 0.00 H new ATOM 0 HG23 VAL A 9 21.265 -0.059 -1.507 1.00 0.00 H new ATOM 106 N LYS A 10 19.319 1.831 2.833 1.00 0.00 N ATOM 107 CA LYS A 10 18.287 2.177 3.803 1.00 0.00 C ATOM 108 C LYS A 10 17.980 3.671 3.761 1.00 0.00 C ATOM 109 O LYS A 10 18.630 4.466 4.439 1.00 0.00 O ATOM 110 CB LYS A 10 18.729 1.777 5.212 1.00 0.00 C ATOM 111 CG LYS A 10 17.576 1.620 6.189 1.00 0.00 C ATOM 112 CD LYS A 10 18.036 1.796 7.627 1.00 0.00 C ATOM 113 CE LYS A 10 16.927 2.359 8.502 1.00 0.00 C ATOM 114 NZ LYS A 10 16.717 3.814 8.264 1.00 0.00 N ATOM 0 H LYS A 10 20.181 2.369 2.925 1.00 0.00 H new ATOM 0 HA LYS A 10 17.381 1.630 3.543 1.00 0.00 H new ATOM 0 HB2 LYS A 10 19.279 0.838 5.158 1.00 0.00 H new ATOM 0 HB3 LYS A 10 19.419 2.529 5.595 1.00 0.00 H new ATOM 0 HG2 LYS A 10 16.802 2.353 5.961 1.00 0.00 H new ATOM 0 HG3 LYS A 10 17.127 0.634 6.068 1.00 0.00 H new ATOM 0 HD2 LYS A 10 18.363 0.836 8.026 1.00 0.00 H new ATOM 0 HD3 LYS A 10 18.897 2.463 7.655 1.00 0.00 H new ATOM 0 HE2 LYS A 10 16.000 1.821 8.304 1.00 0.00 H new ATOM 0 HE3 LYS A 10 17.173 2.194 9.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 16.065 4.192 8.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 17.628 4.311 8.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 16.311 3.956 7.317 1.00 0.00 H new ATOM 128 N GLU A 11 16.985 4.044 2.961 1.00 0.00 N ATOM 129 CA GLU A 11 16.593 5.442 2.832 1.00 0.00 C ATOM 130 C GLU A 11 15.336 5.732 3.648 1.00 0.00 C ATOM 131 O GLU A 11 14.479 4.865 3.818 1.00 0.00 O ATOM 132 CB GLU A 11 16.352 5.794 1.363 1.00 0.00 C ATOM 133 CG GLU A 11 17.565 5.567 0.476 1.00 0.00 C ATOM 134 CD GLU A 11 17.249 5.731 -0.998 1.00 0.00 C ATOM 135 OE1 GLU A 11 16.251 6.411 -1.318 1.00 0.00 O ATOM 136 OE2 GLU A 11 17.998 5.180 -1.831 1.00 0.00 O ATOM 0 H GLU A 11 16.437 3.398 2.393 1.00 0.00 H new ATOM 0 HA GLU A 11 17.406 6.057 3.217 1.00 0.00 H new ATOM 0 HB2 GLU A 11 15.521 5.198 0.987 1.00 0.00 H new ATOM 0 HB3 GLU A 11 16.052 6.840 1.293 1.00 0.00 H new ATOM 0 HG2 GLU A 11 18.351 6.269 0.755 1.00 0.00 H new ATOM 0 HG3 GLU A 11 17.956 4.564 0.651 1.00 0.00 H new ATOM 143 N SER A 12 15.235 6.958 4.153 1.00 0.00 N ATOM 144 CA SER A 12 14.086 7.361 4.955 1.00 0.00 C ATOM 145 C SER A 12 12.780 7.039 4.234 1.00 0.00 C ATOM 146 O SER A 12 12.779 6.699 3.051 1.00 0.00 O ATOM 147 CB SER A 12 14.154 8.858 5.265 1.00 0.00 C ATOM 148 OG SER A 12 15.013 9.112 6.363 1.00 0.00 O ATOM 0 H SER A 12 15.935 7.688 4.021 1.00 0.00 H new ATOM 0 HA SER A 12 14.113 6.801 5.890 1.00 0.00 H new ATOM 0 HB2 SER A 12 14.510 9.399 4.388 1.00 0.00 H new ATOM 0 HB3 SER A 12 13.155 9.233 5.487 1.00 0.00 H new ATOM 0 HG SER A 12 15.041 10.075 6.540 1.00 0.00 H new ATOM 154 N ILE A 13 11.671 7.148 4.957 1.00 0.00 N ATOM 155 CA ILE A 13 10.358 6.870 4.388 1.00 0.00 C ATOM 156 C ILE A 13 10.214 7.496 3.005 1.00 0.00 C ATOM 157 O ILE A 13 10.785 8.552 2.726 1.00 0.00 O ATOM 158 CB ILE A 13 9.228 7.392 5.295 1.00 0.00 C ATOM 159 CG1 ILE A 13 9.276 8.919 5.379 1.00 0.00 C ATOM 160 CG2 ILE A 13 9.336 6.776 6.683 1.00 0.00 C ATOM 161 CD1 ILE A 13 7.980 9.539 5.852 1.00 0.00 C ATOM 0 H ILE A 13 11.655 7.427 5.938 1.00 0.00 H new ATOM 0 HA ILE A 13 10.274 5.786 4.305 1.00 0.00 H new ATOM 0 HB ILE A 13 8.271 7.101 4.863 1.00 0.00 H new ATOM 0 HG12 ILE A 13 10.078 9.213 6.056 1.00 0.00 H new ATOM 0 HG13 ILE A 13 9.525 9.321 4.397 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.531 7.154 7.313 1.00 0.00 H new ATOM 0 HG22 ILE A 13 9.258 5.691 6.607 1.00 0.00 H new ATOM 0 HG23 ILE A 13 10.297 7.040 7.125 1.00 0.00 H new ATOM 0 HD11 ILE A 13 8.087 10.623 5.887 1.00 0.00 H new ATOM 0 HD12 ILE A 13 7.178 9.276 5.163 1.00 0.00 H new ATOM 0 HD13 ILE A 13 7.740 9.165 6.847 1.00 0.00 H new ATOM 173 N THR A 14 9.446 6.840 2.141 1.00 0.00 N ATOM 174 CA THR A 14 9.226 7.332 0.787 1.00 0.00 C ATOM 175 C THR A 14 7.825 7.913 0.634 1.00 0.00 C ATOM 176 O THR A 14 6.830 7.221 0.848 1.00 0.00 O ATOM 177 CB THR A 14 9.424 6.216 -0.256 1.00 0.00 C ATOM 178 OG1 THR A 14 9.293 6.751 -1.578 1.00 0.00 O ATOM 179 CG2 THR A 14 8.410 5.100 -0.052 1.00 0.00 C ATOM 0 H THR A 14 8.966 5.966 2.355 1.00 0.00 H new ATOM 0 HA THR A 14 9.963 8.116 0.612 1.00 0.00 H new ATOM 0 HB THR A 14 10.425 5.804 -0.130 1.00 0.00 H new ATOM 0 HG1 THR A 14 9.422 6.035 -2.235 1.00 0.00 H new ATOM 0 HG21 THR A 14 8.569 4.323 -0.800 1.00 0.00 H new ATOM 0 HG22 THR A 14 8.532 4.675 0.944 1.00 0.00 H new ATOM 0 HG23 THR A 14 7.402 5.501 -0.154 1.00 0.00 H new ATOM 187 N ARG A 15 7.755 9.186 0.261 1.00 0.00 N ATOM 188 CA ARG A 15 6.475 9.860 0.079 1.00 0.00 C ATOM 189 C ARG A 15 6.327 10.372 -1.351 1.00 0.00 C ATOM 190 O ARG A 15 5.409 11.133 -1.658 1.00 0.00 O ATOM 191 CB ARG A 15 6.342 11.023 1.065 1.00 0.00 C ATOM 192 CG ARG A 15 7.536 11.962 1.063 1.00 0.00 C ATOM 193 CD ARG A 15 8.638 11.465 1.986 1.00 0.00 C ATOM 194 NE ARG A 15 9.953 11.957 1.584 1.00 0.00 N ATOM 195 CZ ARG A 15 10.336 13.222 1.718 1.00 0.00 C ATOM 196 NH1 ARG A 15 9.510 14.117 2.241 1.00 0.00 N ATOM 197 NH2 ARG A 15 11.549 13.593 1.329 1.00 0.00 N ATOM 0 H ARG A 15 8.570 9.772 0.079 1.00 0.00 H new ATOM 0 HA ARG A 15 5.682 9.137 0.271 1.00 0.00 H new ATOM 0 HB2 ARG A 15 5.443 11.591 0.825 1.00 0.00 H new ATOM 0 HB3 ARG A 15 6.207 10.623 2.070 1.00 0.00 H new ATOM 0 HG2 ARG A 15 7.924 12.056 0.049 1.00 0.00 H new ATOM 0 HG3 ARG A 15 7.219 12.957 1.376 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.428 11.785 3.006 1.00 0.00 H new ATOM 0 HD3 ARG A 15 8.644 10.375 1.989 1.00 0.00 H new ATOM 0 HE ARG A 15 10.613 11.293 1.178 1.00 0.00 H new ATOM 0 HH11 ARG A 15 8.577 13.835 2.542 1.00 0.00 H new ATOM 0 HH12 ARG A 15 9.807 15.087 2.342 1.00 0.00 H new ATOM 0 HH21 ARG A 15 12.188 12.907 0.927 1.00 0.00 H new ATOM 0 HH22 ARG A 15 11.843 14.564 1.432 1.00 0.00 H new ATOM 211 N THR A 16 7.238 9.949 -2.222 1.00 0.00 N ATOM 212 CA THR A 16 7.211 10.365 -3.618 1.00 0.00 C ATOM 213 C THR A 16 8.012 9.407 -4.493 1.00 0.00 C ATOM 214 O THR A 16 9.241 9.367 -4.422 1.00 0.00 O ATOM 215 CB THR A 16 7.770 11.790 -3.791 1.00 0.00 C ATOM 216 OG1 THR A 16 6.865 12.743 -3.223 1.00 0.00 O ATOM 217 CG2 THR A 16 7.994 12.109 -5.261 1.00 0.00 C ATOM 0 H THR A 16 8.004 9.318 -1.985 1.00 0.00 H new ATOM 0 HA THR A 16 6.167 10.352 -3.931 1.00 0.00 H new ATOM 0 HB THR A 16 8.728 11.846 -3.274 1.00 0.00 H new ATOM 0 HG1 THR A 16 6.060 12.282 -2.907 1.00 0.00 H new ATOM 0 HG21 THR A 16 8.389 13.120 -5.358 1.00 0.00 H new ATOM 0 HG22 THR A 16 8.706 11.400 -5.683 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.048 12.036 -5.797 1.00 0.00 H new ATOM 225 N SER A 17 7.309 8.638 -5.318 1.00 0.00 N ATOM 226 CA SER A 17 7.956 7.678 -6.205 1.00 0.00 C ATOM 227 C SER A 17 6.938 7.031 -7.140 1.00 0.00 C ATOM 228 O SER A 17 5.830 6.689 -6.728 1.00 0.00 O ATOM 229 CB SER A 17 8.673 6.600 -5.389 1.00 0.00 C ATOM 230 OG SER A 17 9.024 5.494 -6.202 1.00 0.00 O ATOM 0 H SER A 17 6.292 8.661 -5.391 1.00 0.00 H new ATOM 0 HA SER A 17 8.689 8.214 -6.808 1.00 0.00 H new ATOM 0 HB2 SER A 17 9.570 7.020 -4.934 1.00 0.00 H new ATOM 0 HB3 SER A 17 8.029 6.267 -4.575 1.00 0.00 H new ATOM 0 HG SER A 17 9.482 4.820 -5.658 1.00 0.00 H new ATOM 236 N ARG A 18 7.324 6.868 -8.401 1.00 0.00 N ATOM 237 CA ARG A 18 6.446 6.263 -9.396 1.00 0.00 C ATOM 238 C ARG A 18 6.779 4.787 -9.591 1.00 0.00 C ATOM 239 O ARG A 18 7.777 4.444 -10.224 1.00 0.00 O ATOM 240 CB ARG A 18 6.564 7.004 -10.729 1.00 0.00 C ATOM 241 CG ARG A 18 5.715 8.263 -10.805 1.00 0.00 C ATOM 242 CD ARG A 18 5.458 8.676 -12.245 1.00 0.00 C ATOM 243 NE ARG A 18 4.340 7.944 -12.833 1.00 0.00 N ATOM 244 CZ ARG A 18 3.948 8.089 -14.094 1.00 0.00 C ATOM 245 NH1 ARG A 18 4.580 8.936 -14.895 1.00 0.00 N ATOM 246 NH2 ARG A 18 2.921 7.387 -14.556 1.00 0.00 N ATOM 0 H ARG A 18 8.238 7.146 -8.758 1.00 0.00 H new ATOM 0 HA ARG A 18 5.421 6.341 -9.034 1.00 0.00 H new ATOM 0 HB2 ARG A 18 7.608 7.270 -10.896 1.00 0.00 H new ATOM 0 HB3 ARG A 18 6.273 6.331 -11.536 1.00 0.00 H new ATOM 0 HG2 ARG A 18 4.765 8.093 -10.299 1.00 0.00 H new ATOM 0 HG3 ARG A 18 6.217 9.074 -10.277 1.00 0.00 H new ATOM 0 HD2 ARG A 18 5.252 9.746 -12.284 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.356 8.503 -12.838 1.00 0.00 H new ATOM 0 HE ARG A 18 3.832 7.285 -12.243 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.369 9.478 -14.543 1.00 0.00 H new ATOM 0 HH12 ARG A 18 4.277 9.045 -15.863 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.432 6.735 -13.943 1.00 0.00 H new ATOM 0 HH22 ARG A 18 2.621 7.499 -15.524 1.00 0.00 H new ATOM 260 N ALA A 19 5.937 3.918 -9.041 1.00 0.00 N ATOM 261 CA ALA A 19 6.142 2.480 -9.155 1.00 0.00 C ATOM 262 C ALA A 19 4.971 1.814 -9.872 1.00 0.00 C ATOM 263 O ALA A 19 3.808 2.163 -9.669 1.00 0.00 O ATOM 264 CB ALA A 19 6.339 1.863 -7.778 1.00 0.00 C ATOM 0 H ALA A 19 5.107 4.185 -8.512 1.00 0.00 H new ATOM 0 HA ALA A 19 7.041 2.312 -9.748 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.491 0.788 -7.879 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.211 2.309 -7.301 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.456 2.049 -7.166 1.00 0.00 H new ATOM 270 N PRO A 20 5.283 0.832 -10.731 1.00 0.00 N ATOM 271 CA PRO A 20 4.271 0.098 -11.495 1.00 0.00 C ATOM 272 C PRO A 20 3.424 -0.812 -10.611 1.00 0.00 C ATOM 273 O PRO A 20 3.954 -1.619 -9.847 1.00 0.00 O ATOM 274 CB PRO A 20 5.101 -0.733 -12.477 1.00 0.00 C ATOM 275 CG PRO A 20 6.423 -0.897 -11.811 1.00 0.00 C ATOM 276 CD PRO A 20 6.649 0.364 -11.022 1.00 0.00 C ATOM 0 HA PRO A 20 3.560 0.768 -11.977 1.00 0.00 H new ATOM 0 HB2 PRO A 20 4.634 -1.698 -12.672 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.201 -0.227 -13.437 1.00 0.00 H new ATOM 0 HG2 PRO A 20 6.426 -1.771 -11.159 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.214 -1.045 -12.546 1.00 0.00 H new ATOM 0 HD2 PRO A 20 7.211 0.171 -10.108 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.213 1.101 -11.594 1.00 0.00 H new ATOM 284 N SER A 21 2.107 -0.676 -10.720 1.00 0.00 N ATOM 285 CA SER A 21 1.187 -1.483 -9.928 1.00 0.00 C ATOM 286 C SER A 21 -0.195 -1.523 -10.573 1.00 0.00 C ATOM 287 O SER A 21 -0.821 -0.485 -10.793 1.00 0.00 O ATOM 288 CB SER A 21 1.082 -0.928 -8.506 1.00 0.00 C ATOM 289 OG SER A 21 0.712 -1.943 -7.588 1.00 0.00 O ATOM 0 H SER A 21 1.653 -0.014 -11.349 1.00 0.00 H new ATOM 0 HA SER A 21 1.579 -2.499 -9.886 1.00 0.00 H new ATOM 0 HB2 SER A 21 2.038 -0.496 -8.209 1.00 0.00 H new ATOM 0 HB3 SER A 21 0.347 -0.124 -8.480 1.00 0.00 H new ATOM 0 HG SER A 21 0.653 -1.563 -6.686 1.00 0.00 H new ATOM 295 N VAL A 22 -0.667 -2.729 -10.874 1.00 0.00 N ATOM 296 CA VAL A 22 -1.975 -2.906 -11.493 1.00 0.00 C ATOM 297 C VAL A 22 -3.095 -2.555 -10.520 1.00 0.00 C ATOM 298 O VAL A 22 -3.154 -3.082 -9.410 1.00 0.00 O ATOM 299 CB VAL A 22 -2.172 -4.352 -11.986 1.00 0.00 C ATOM 300 CG1 VAL A 22 -1.121 -4.709 -13.027 1.00 0.00 C ATOM 301 CG2 VAL A 22 -2.127 -5.323 -10.817 1.00 0.00 C ATOM 0 H VAL A 22 -0.162 -3.598 -10.699 1.00 0.00 H new ATOM 0 HA VAL A 22 -2.015 -2.231 -12.348 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.153 -4.428 -12.454 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.276 -5.734 -13.364 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -1.205 -4.031 -13.877 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.128 -4.618 -12.587 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -2.268 -6.340 -11.183 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -1.161 -5.247 -10.318 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -2.920 -5.079 -10.110 1.00 0.00 H new ATOM 311 N ALA A 23 -3.982 -1.662 -10.945 1.00 0.00 N ATOM 312 CA ALA A 23 -5.103 -1.242 -10.113 1.00 0.00 C ATOM 313 C ALA A 23 -6.241 -0.688 -10.963 1.00 0.00 C ATOM 314 O ALA A 23 -6.056 0.260 -11.726 1.00 0.00 O ATOM 315 CB ALA A 23 -4.647 -0.205 -9.097 1.00 0.00 C ATOM 0 H ALA A 23 -3.946 -1.215 -11.861 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.476 -2.117 -9.580 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -5.494 0.100 -8.483 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.873 -0.635 -8.461 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.246 0.664 -9.619 1.00 0.00 H new ATOM 321 N THR A 24 -7.421 -1.287 -10.827 1.00 0.00 N ATOM 322 CA THR A 24 -8.589 -0.855 -11.584 1.00 0.00 C ATOM 323 C THR A 24 -9.511 0.006 -10.729 1.00 0.00 C ATOM 324 O THR A 24 -9.655 -0.225 -9.528 1.00 0.00 O ATOM 325 CB THR A 24 -9.384 -2.058 -12.125 1.00 0.00 C ATOM 326 OG1 THR A 24 -8.486 -3.053 -12.628 1.00 0.00 O ATOM 327 CG2 THR A 24 -10.338 -1.624 -13.229 1.00 0.00 C ATOM 0 H THR A 24 -7.592 -2.073 -10.199 1.00 0.00 H new ATOM 0 HA THR A 24 -8.221 -0.265 -12.423 1.00 0.00 H new ATOM 0 HB THR A 24 -9.968 -2.477 -11.306 1.00 0.00 H new ATOM 0 HG1 THR A 24 -9.000 -3.815 -12.968 1.00 0.00 H new ATOM 0 HG21 THR A 24 -10.889 -2.490 -13.596 1.00 0.00 H new ATOM 0 HG22 THR A 24 -11.039 -0.888 -12.835 1.00 0.00 H new ATOM 0 HG23 THR A 24 -9.770 -1.182 -14.048 1.00 0.00 H new ATOM 335 N VAL A 25 -10.134 1.000 -11.354 1.00 0.00 N ATOM 336 CA VAL A 25 -11.044 1.895 -10.649 1.00 0.00 C ATOM 337 C VAL A 25 -12.487 1.421 -10.775 1.00 0.00 C ATOM 338 O VAL A 25 -12.986 1.200 -11.877 1.00 0.00 O ATOM 339 CB VAL A 25 -10.940 3.336 -11.184 1.00 0.00 C ATOM 340 CG1 VAL A 25 -11.369 3.396 -12.642 1.00 0.00 C ATOM 341 CG2 VAL A 25 -11.776 4.281 -10.334 1.00 0.00 C ATOM 0 H VAL A 25 -10.025 1.206 -12.347 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.751 1.883 -9.599 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.899 3.654 -11.123 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.289 4.421 -13.003 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.724 2.750 -13.238 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.402 3.059 -12.732 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.691 5.295 -10.726 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -12.820 3.968 -10.361 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.417 4.259 -9.305 1.00 0.00 H new ATOM 351 N GLY A 26 -13.155 1.266 -9.635 1.00 0.00 N ATOM 352 CA GLY A 26 -14.536 0.819 -9.639 1.00 0.00 C ATOM 353 C GLY A 26 -14.656 -0.691 -9.658 1.00 0.00 C ATOM 354 O GLY A 26 -15.529 -1.243 -10.328 1.00 0.00 O ATOM 0 H GLY A 26 -12.764 1.442 -8.709 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -15.044 1.210 -8.757 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.046 1.232 -10.509 1.00 0.00 H new ATOM 358 N SER A 27 -13.775 -1.363 -8.923 1.00 0.00 N ATOM 359 CA SER A 27 -13.783 -2.820 -8.863 1.00 0.00 C ATOM 360 C SER A 27 -12.866 -3.323 -7.752 1.00 0.00 C ATOM 361 O SER A 27 -11.978 -2.604 -7.293 1.00 0.00 O ATOM 362 CB SER A 27 -13.347 -3.409 -10.206 1.00 0.00 C ATOM 363 OG SER A 27 -13.917 -4.691 -10.410 1.00 0.00 O ATOM 0 H SER A 27 -13.047 -0.922 -8.361 1.00 0.00 H new ATOM 0 HA SER A 27 -14.800 -3.145 -8.645 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.647 -2.742 -11.014 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.260 -3.481 -10.239 1.00 0.00 H new ATOM 0 HG SER A 27 -13.624 -5.045 -11.276 1.00 0.00 H new ATOM 369 N ILE A 28 -13.088 -4.562 -7.326 1.00 0.00 N ATOM 370 CA ILE A 28 -12.282 -5.162 -6.270 1.00 0.00 C ATOM 371 C ILE A 28 -10.930 -5.621 -6.805 1.00 0.00 C ATOM 372 O ILE A 28 -10.859 -6.419 -7.740 1.00 0.00 O ATOM 373 CB ILE A 28 -13.001 -6.361 -5.626 1.00 0.00 C ATOM 374 CG1 ILE A 28 -14.163 -5.880 -4.755 1.00 0.00 C ATOM 375 CG2 ILE A 28 -12.022 -7.186 -4.803 1.00 0.00 C ATOM 376 CD1 ILE A 28 -15.100 -6.989 -4.331 1.00 0.00 C ATOM 0 H ILE A 28 -13.819 -5.170 -7.696 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.128 -4.392 -5.514 1.00 0.00 H new ATOM 0 HB ILE A 28 -13.403 -6.993 -6.418 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.763 -5.394 -3.865 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.729 -5.127 -5.303 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -12.545 -8.030 -4.354 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.225 -7.555 -5.448 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -11.594 -6.565 -4.016 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -15.899 -6.575 -3.716 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -15.529 -7.461 -5.215 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.548 -7.732 -3.756 1.00 0.00 H new ATOM 388 N CYS A 29 -9.859 -5.113 -6.205 1.00 0.00 N ATOM 389 CA CYS A 29 -8.507 -5.472 -6.620 1.00 0.00 C ATOM 390 C CYS A 29 -7.807 -6.292 -5.541 1.00 0.00 C ATOM 391 O CYS A 29 -7.725 -5.875 -4.386 1.00 0.00 O ATOM 392 CB CYS A 29 -7.695 -4.213 -6.928 1.00 0.00 C ATOM 393 SG CYS A 29 -7.374 -3.170 -5.487 1.00 0.00 S ATOM 0 H CYS A 29 -9.900 -4.451 -5.430 1.00 0.00 H new ATOM 0 HA CYS A 29 -8.579 -6.079 -7.522 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -6.743 -4.507 -7.370 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -8.226 -3.626 -7.677 1.00 0.00 H new ATOM 0 HG CYS A 29 -7.372 -3.902 -4.413 1.00 0.00 H new ATOM 399 N ASP A 30 -7.306 -7.460 -5.926 1.00 0.00 N ATOM 400 CA ASP A 30 -6.613 -8.340 -4.992 1.00 0.00 C ATOM 401 C ASP A 30 -5.182 -7.865 -4.757 1.00 0.00 C ATOM 402 O ASP A 30 -4.343 -7.919 -5.658 1.00 0.00 O ATOM 403 CB ASP A 30 -6.607 -9.776 -5.519 1.00 0.00 C ATOM 404 CG ASP A 30 -6.250 -9.851 -6.991 1.00 0.00 C ATOM 405 OD1 ASP A 30 -5.046 -9.954 -7.305 1.00 0.00 O ATOM 406 OD2 ASP A 30 -7.175 -9.805 -7.829 1.00 0.00 O ATOM 0 H ASP A 30 -7.367 -7.820 -6.878 1.00 0.00 H new ATOM 0 HA ASP A 30 -7.146 -8.312 -4.042 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.894 -10.368 -4.945 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -7.590 -10.221 -5.363 1.00 0.00 H new ATOM 411 N LEU A 31 -4.911 -7.399 -3.543 1.00 0.00 N ATOM 412 CA LEU A 31 -3.582 -6.913 -3.190 1.00 0.00 C ATOM 413 C LEU A 31 -2.848 -7.923 -2.313 1.00 0.00 C ATOM 414 O LEU A 31 -3.071 -7.989 -1.105 1.00 0.00 O ATOM 415 CB LEU A 31 -3.684 -5.570 -2.465 1.00 0.00 C ATOM 416 CG LEU A 31 -2.371 -4.811 -2.269 1.00 0.00 C ATOM 417 CD1 LEU A 31 -1.970 -4.100 -3.552 1.00 0.00 C ATOM 418 CD2 LEU A 31 -2.496 -3.818 -1.123 1.00 0.00 C ATOM 0 H LEU A 31 -5.594 -7.347 -2.787 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.015 -6.779 -4.111 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.370 -4.931 -3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.131 -5.742 -1.486 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.591 -5.530 -2.017 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -1.034 -3.565 -3.394 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.840 -4.833 -4.348 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.749 -3.392 -3.834 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.553 -3.287 -0.997 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -3.288 -3.103 -1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.737 -4.352 -0.204 1.00 0.00 H new ATOM 430 N ASN A 32 -1.970 -8.707 -2.931 1.00 0.00 N ATOM 431 CA ASN A 32 -1.202 -9.713 -2.206 1.00 0.00 C ATOM 432 C ASN A 32 0.097 -9.121 -1.666 1.00 0.00 C ATOM 433 O ASN A 32 0.960 -8.689 -2.432 1.00 0.00 O ATOM 434 CB ASN A 32 -0.893 -10.903 -3.116 1.00 0.00 C ATOM 435 CG ASN A 32 -0.243 -10.480 -4.420 1.00 0.00 C ATOM 436 OD1 ASN A 32 -0.864 -9.815 -5.249 1.00 0.00 O ATOM 437 ND2 ASN A 32 1.014 -10.866 -4.606 1.00 0.00 N ATOM 0 H ASN A 32 -1.773 -8.665 -3.931 1.00 0.00 H new ATOM 0 HA ASN A 32 -1.803 -10.055 -1.363 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -0.234 -11.596 -2.593 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.816 -11.442 -3.331 1.00 0.00 H new ATOM 0 HD21 ASN A 32 1.504 -10.612 -5.464 1.00 0.00 H new ATOM 0 HD22 ASN A 32 1.490 -11.416 -3.891 1.00 0.00 H new ATOM 444 N LEU A 33 0.229 -9.104 -0.345 1.00 0.00 N ATOM 445 CA LEU A 33 1.423 -8.566 0.298 1.00 0.00 C ATOM 446 C LEU A 33 2.200 -9.667 1.013 1.00 0.00 C ATOM 447 O LEU A 33 1.621 -10.494 1.718 1.00 0.00 O ATOM 448 CB LEU A 33 1.040 -7.469 1.293 1.00 0.00 C ATOM 449 CG LEU A 33 0.438 -6.198 0.692 1.00 0.00 C ATOM 450 CD1 LEU A 33 -0.474 -5.512 1.698 1.00 0.00 C ATOM 451 CD2 LEU A 33 1.538 -5.252 0.234 1.00 0.00 C ATOM 0 H LEU A 33 -0.476 -9.457 0.302 1.00 0.00 H new ATOM 0 HA LEU A 33 2.061 -8.140 -0.476 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.326 -7.884 2.004 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.930 -7.193 1.859 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.158 -6.477 -0.177 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -0.893 -4.610 1.253 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.282 -6.188 1.977 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.099 -5.246 2.586 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.091 -4.353 -0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.162 -4.980 1.086 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.150 -5.745 -0.521 1.00 0.00 H new ATOM 463 N LYS A 34 3.516 -9.671 0.827 1.00 0.00 N ATOM 464 CA LYS A 34 4.374 -10.668 1.456 1.00 0.00 C ATOM 465 C LYS A 34 4.566 -10.364 2.938 1.00 0.00 C ATOM 466 O LYS A 34 5.625 -9.891 3.352 1.00 0.00 O ATOM 467 CB LYS A 34 5.734 -10.715 0.754 1.00 0.00 C ATOM 468 CG LYS A 34 6.486 -9.397 0.796 1.00 0.00 C ATOM 469 CD LYS A 34 7.421 -9.250 -0.393 1.00 0.00 C ATOM 470 CE LYS A 34 6.673 -8.798 -1.638 1.00 0.00 C ATOM 471 NZ LYS A 34 7.561 -8.753 -2.832 1.00 0.00 N ATOM 0 H LYS A 34 4.011 -8.995 0.246 1.00 0.00 H new ATOM 0 HA LYS A 34 3.889 -11.640 1.363 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.346 -11.488 1.218 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.587 -11.007 -0.286 1.00 0.00 H new ATOM 0 HG2 LYS A 34 5.775 -8.571 0.805 1.00 0.00 H new ATOM 0 HG3 LYS A 34 7.059 -9.334 1.721 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.203 -8.529 -0.155 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.914 -10.202 -0.589 1.00 0.00 H new ATOM 0 HE2 LYS A 34 5.842 -9.477 -1.829 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.245 -7.810 -1.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 7.014 -8.441 -3.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.340 -8.086 -2.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.950 -9.701 -3.012 1.00 0.00 H new ATOM 485 N ILE A 35 3.537 -10.639 3.732 1.00 0.00 N ATOM 486 CA ILE A 35 3.594 -10.397 5.168 1.00 0.00 C ATOM 487 C ILE A 35 4.030 -11.651 5.920 1.00 0.00 C ATOM 488 O ILE A 35 3.604 -12.766 5.617 1.00 0.00 O ATOM 489 CB ILE A 35 2.232 -9.932 5.715 1.00 0.00 C ATOM 490 CG1 ILE A 35 1.806 -8.626 5.041 1.00 0.00 C ATOM 491 CG2 ILE A 35 2.299 -9.757 7.225 1.00 0.00 C ATOM 492 CD1 ILE A 35 0.345 -8.291 5.241 1.00 0.00 C ATOM 0 H ILE A 35 2.653 -11.030 3.405 1.00 0.00 H new ATOM 0 HA ILE A 35 4.329 -9.607 5.326 1.00 0.00 H new ATOM 0 HB ILE A 35 1.487 -10.695 5.490 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.414 -7.810 5.431 1.00 0.00 H new ATOM 0 HG13 ILE A 35 2.012 -8.694 3.973 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.329 -9.428 7.597 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.563 -10.707 7.690 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.054 -9.010 7.472 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.114 -7.353 4.736 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.271 -9.088 4.825 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.137 -8.190 6.306 1.00 0.00 H new ATOM 504 N PRO A 36 4.897 -11.466 6.926 1.00 0.00 N ATOM 505 CA PRO A 36 5.408 -12.570 7.744 1.00 0.00 C ATOM 506 C PRO A 36 4.335 -13.165 8.649 1.00 0.00 C ATOM 507 O PRO A 36 3.158 -12.821 8.540 1.00 0.00 O ATOM 508 CB PRO A 36 6.508 -11.912 8.581 1.00 0.00 C ATOM 509 CG PRO A 36 6.123 -10.474 8.649 1.00 0.00 C ATOM 510 CD PRO A 36 5.446 -10.164 7.342 1.00 0.00 C ATOM 0 HA PRO A 36 5.758 -13.402 7.133 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.566 -12.354 9.576 1.00 0.00 H new ATOM 0 HB3 PRO A 36 7.487 -12.038 8.118 1.00 0.00 H new ATOM 0 HG2 PRO A 36 5.453 -10.289 9.489 1.00 0.00 H new ATOM 0 HG3 PRO A 36 6.999 -9.842 8.794 1.00 0.00 H new ATOM 0 HD2 PRO A 36 4.661 -9.417 7.463 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.150 -9.771 6.608 1.00 0.00 H new ATOM 518 N GLU A 37 4.749 -14.059 9.541 1.00 0.00 N ATOM 519 CA GLU A 37 3.821 -14.702 10.464 1.00 0.00 C ATOM 520 C GLU A 37 2.768 -13.713 10.954 1.00 0.00 C ATOM 521 O GLU A 37 1.656 -14.101 11.313 1.00 0.00 O ATOM 522 CB GLU A 37 4.579 -15.290 11.657 1.00 0.00 C ATOM 523 CG GLU A 37 3.926 -16.531 12.241 1.00 0.00 C ATOM 524 CD GLU A 37 2.937 -16.207 13.343 1.00 0.00 C ATOM 525 OE1 GLU A 37 1.748 -15.987 13.027 1.00 0.00 O ATOM 526 OE2 GLU A 37 3.350 -16.173 14.521 1.00 0.00 O ATOM 0 H GLU A 37 5.720 -14.354 9.644 1.00 0.00 H new ATOM 0 HA GLU A 37 3.317 -15.507 9.930 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.594 -15.536 11.346 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.659 -14.531 12.436 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.414 -17.075 11.447 1.00 0.00 H new ATOM 0 HG3 GLU A 37 4.698 -17.192 12.634 1.00 0.00 H new ATOM 533 N ILE A 38 3.126 -12.433 10.967 1.00 0.00 N ATOM 534 CA ILE A 38 2.213 -11.388 11.412 1.00 0.00 C ATOM 535 C ILE A 38 0.785 -11.678 10.961 1.00 0.00 C ATOM 536 O ILE A 38 0.542 -11.983 9.794 1.00 0.00 O ATOM 537 CB ILE A 38 2.637 -10.006 10.880 1.00 0.00 C ATOM 538 CG1 ILE A 38 3.945 -9.562 11.538 1.00 0.00 C ATOM 539 CG2 ILE A 38 1.538 -8.984 11.129 1.00 0.00 C ATOM 540 CD1 ILE A 38 4.574 -8.356 10.878 1.00 0.00 C ATOM 0 H ILE A 38 4.043 -12.095 10.674 1.00 0.00 H new ATOM 0 HA ILE A 38 2.253 -11.376 12.501 1.00 0.00 H new ATOM 0 HB ILE A 38 2.800 -10.080 9.805 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.756 -9.334 12.587 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.654 -10.390 11.514 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.852 -8.012 10.748 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.627 -9.297 10.618 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.346 -8.909 12.199 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.497 -8.098 11.397 1.00 0.00 H new ATOM 0 HD12 ILE A 38 4.795 -8.586 9.836 1.00 0.00 H new ATOM 0 HD13 ILE A 38 3.884 -7.514 10.925 1.00 0.00 H new ATOM 552 N ASN A 39 -0.156 -11.578 11.894 1.00 0.00 N ATOM 553 CA ASN A 39 -1.561 -11.828 11.593 1.00 0.00 C ATOM 554 C ASN A 39 -2.295 -10.523 11.299 1.00 0.00 C ATOM 555 O ASN A 39 -1.923 -9.463 11.803 1.00 0.00 O ATOM 556 CB ASN A 39 -2.233 -12.553 12.760 1.00 0.00 C ATOM 557 CG ASN A 39 -1.534 -13.852 13.114 1.00 0.00 C ATOM 558 OD1 ASN A 39 -1.110 -14.601 12.234 1.00 0.00 O ATOM 559 ND2 ASN A 39 -1.412 -14.124 14.408 1.00 0.00 N ATOM 0 H ASN A 39 0.029 -11.326 12.865 1.00 0.00 H new ATOM 0 HA ASN A 39 -1.610 -12.459 10.706 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -2.243 -11.900 13.632 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -3.272 -12.761 12.505 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -0.951 -14.983 14.707 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -1.779 -13.473 15.103 1.00 0.00 H new ATOM 566 N SER A 40 -3.339 -10.609 10.482 1.00 0.00 N ATOM 567 CA SER A 40 -4.124 -9.435 10.118 1.00 0.00 C ATOM 568 C SER A 40 -4.696 -8.758 11.360 1.00 0.00 C ATOM 569 O SER A 40 -4.556 -7.549 11.542 1.00 0.00 O ATOM 570 CB SER A 40 -5.258 -9.826 9.169 1.00 0.00 C ATOM 571 OG SER A 40 -6.101 -10.801 9.758 1.00 0.00 O ATOM 0 H SER A 40 -3.661 -11.479 10.059 1.00 0.00 H new ATOM 0 HA SER A 40 -3.464 -8.731 9.612 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.842 -8.943 8.912 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.841 -10.214 8.240 1.00 0.00 H new ATOM 0 HG SER A 40 -6.819 -11.033 9.133 1.00 0.00 H new ATOM 577 N SER A 41 -5.341 -9.548 12.213 1.00 0.00 N ATOM 578 CA SER A 41 -5.938 -9.026 13.436 1.00 0.00 C ATOM 579 C SER A 41 -5.080 -7.912 14.028 1.00 0.00 C ATOM 580 O SER A 41 -5.596 -6.956 14.607 1.00 0.00 O ATOM 581 CB SER A 41 -6.115 -10.148 14.461 1.00 0.00 C ATOM 582 OG SER A 41 -4.863 -10.578 14.969 1.00 0.00 O ATOM 0 H SER A 41 -5.463 -10.552 12.079 1.00 0.00 H new ATOM 0 HA SER A 41 -6.916 -8.614 13.186 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.743 -9.800 15.281 1.00 0.00 H new ATOM 0 HB3 SER A 41 -6.631 -10.989 13.998 1.00 0.00 H new ATOM 0 HG SER A 41 -5.004 -11.294 15.623 1.00 0.00 H new ATOM 588 N ASP A 42 -3.767 -8.044 13.878 1.00 0.00 N ATOM 589 CA ASP A 42 -2.835 -7.048 14.396 1.00 0.00 C ATOM 590 C ASP A 42 -2.608 -5.935 13.378 1.00 0.00 C ATOM 591 O ASP A 42 -2.547 -4.758 13.734 1.00 0.00 O ATOM 592 CB ASP A 42 -1.502 -7.706 14.757 1.00 0.00 C ATOM 593 CG ASP A 42 -1.663 -8.826 15.765 1.00 0.00 C ATOM 594 OD1 ASP A 42 -1.771 -8.527 16.973 1.00 0.00 O ATOM 595 OD2 ASP A 42 -1.681 -10.002 15.346 1.00 0.00 O ATOM 0 H ASP A 42 -3.324 -8.830 13.402 1.00 0.00 H new ATOM 0 HA ASP A 42 -3.271 -6.610 15.294 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -1.038 -8.099 13.853 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.826 -6.952 15.161 1.00 0.00 H new ATOM 600 N MET A 43 -2.482 -6.315 12.111 1.00 0.00 N ATOM 601 CA MET A 43 -2.262 -5.348 11.042 1.00 0.00 C ATOM 602 C MET A 43 -3.549 -4.595 10.716 1.00 0.00 C ATOM 603 O MET A 43 -4.631 -4.974 11.164 1.00 0.00 O ATOM 604 CB MET A 43 -1.739 -6.052 9.788 1.00 0.00 C ATOM 605 CG MET A 43 -0.308 -6.546 9.922 1.00 0.00 C ATOM 606 SD MET A 43 0.197 -7.592 8.543 1.00 0.00 S ATOM 607 CE MET A 43 -0.874 -9.007 8.781 1.00 0.00 C ATOM 0 H MET A 43 -2.528 -7.285 11.799 1.00 0.00 H new ATOM 0 HA MET A 43 -1.518 -4.629 11.384 1.00 0.00 H new ATOM 0 HB2 MET A 43 -2.387 -6.898 9.559 1.00 0.00 H new ATOM 0 HB3 MET A 43 -1.800 -5.366 8.943 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.363 -5.690 9.988 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.206 -7.104 10.853 1.00 0.00 H new ATOM 0 HE1 MET A 43 -0.276 -9.918 8.789 1.00 0.00 H new ATOM 0 HE2 MET A 43 -1.400 -8.910 9.731 1.00 0.00 H new ATOM 0 HE3 MET A 43 -1.599 -9.056 7.968 1.00 0.00 H new ATOM 617 N SER A 44 -3.422 -3.527 9.936 1.00 0.00 N ATOM 618 CA SER A 44 -4.574 -2.718 9.554 1.00 0.00 C ATOM 619 C SER A 44 -4.352 -2.063 8.194 1.00 0.00 C ATOM 620 O SER A 44 -3.390 -1.321 8.000 1.00 0.00 O ATOM 621 CB SER A 44 -4.844 -1.646 10.611 1.00 0.00 C ATOM 622 OG SER A 44 -5.476 -2.201 11.752 1.00 0.00 O ATOM 0 H SER A 44 -2.533 -3.201 9.556 1.00 0.00 H new ATOM 0 HA SER A 44 -5.441 -3.375 9.484 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.905 -1.176 10.904 1.00 0.00 H new ATOM 0 HB3 SER A 44 -5.474 -0.864 10.187 1.00 0.00 H new ATOM 0 HG SER A 44 -5.436 -3.179 11.705 1.00 0.00 H new ATOM 628 N ALA A 45 -5.250 -2.345 7.256 1.00 0.00 N ATOM 629 CA ALA A 45 -5.155 -1.783 5.914 1.00 0.00 C ATOM 630 C ALA A 45 -6.219 -0.714 5.690 1.00 0.00 C ATOM 631 O ALA A 45 -7.388 -0.908 6.025 1.00 0.00 O ATOM 632 CB ALA A 45 -5.280 -2.883 4.871 1.00 0.00 C ATOM 0 H ALA A 45 -6.051 -2.959 7.400 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.177 -1.312 5.812 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.207 -2.449 3.874 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.479 -3.609 5.010 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -6.244 -3.381 4.981 1.00 0.00 H new ATOM 638 N HIS A 46 -5.807 0.415 5.121 1.00 0.00 N ATOM 639 CA HIS A 46 -6.727 1.515 4.852 1.00 0.00 C ATOM 640 C HIS A 46 -6.253 2.338 3.658 1.00 0.00 C ATOM 641 O HIS A 46 -5.102 2.771 3.606 1.00 0.00 O ATOM 642 CB HIS A 46 -6.858 2.410 6.084 1.00 0.00 C ATOM 643 CG HIS A 46 -7.512 1.733 7.249 1.00 0.00 C ATOM 644 ND1 HIS A 46 -6.921 0.704 7.950 1.00 0.00 N ATOM 645 CD2 HIS A 46 -8.713 1.945 7.836 1.00 0.00 C ATOM 646 CE1 HIS A 46 -7.730 0.310 8.917 1.00 0.00 C ATOM 647 NE2 HIS A 46 -8.825 1.048 8.870 1.00 0.00 N ATOM 0 H HIS A 46 -4.843 0.592 4.838 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.703 1.092 4.615 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.867 2.751 6.382 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.434 3.297 5.819 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.447 2.682 7.545 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -7.530 -0.481 9.625 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -9.624 0.965 9.499 1.00 0.00 H new ATOM 655 N VAL A 47 -7.149 2.551 2.699 1.00 0.00 N ATOM 656 CA VAL A 47 -6.823 3.323 1.506 1.00 0.00 C ATOM 657 C VAL A 47 -6.956 4.819 1.766 1.00 0.00 C ATOM 658 O VAL A 47 -8.063 5.344 1.892 1.00 0.00 O ATOM 659 CB VAL A 47 -7.730 2.937 0.322 1.00 0.00 C ATOM 660 CG1 VAL A 47 -7.352 3.727 -0.921 1.00 0.00 C ATOM 661 CG2 VAL A 47 -7.651 1.441 0.058 1.00 0.00 C ATOM 0 H VAL A 47 -8.106 2.200 2.725 1.00 0.00 H new ATOM 0 HA VAL A 47 -5.788 3.091 1.253 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.760 3.184 0.580 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -8.004 3.440 -1.746 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -7.465 4.793 -0.723 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -6.316 3.515 -1.186 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -8.298 1.185 -0.781 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -6.623 1.167 -0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.976 0.897 0.945 1.00 0.00 H new ATOM 671 N THR A 48 -5.819 5.504 1.846 1.00 0.00 N ATOM 672 CA THR A 48 -5.807 6.940 2.092 1.00 0.00 C ATOM 673 C THR A 48 -5.994 7.722 0.797 1.00 0.00 C ATOM 674 O THR A 48 -5.147 7.675 -0.095 1.00 0.00 O ATOM 675 CB THR A 48 -4.493 7.385 2.761 1.00 0.00 C ATOM 676 OG1 THR A 48 -4.215 6.556 3.896 1.00 0.00 O ATOM 677 CG2 THR A 48 -4.573 8.840 3.198 1.00 0.00 C ATOM 0 H THR A 48 -4.894 5.086 1.744 1.00 0.00 H new ATOM 0 HA THR A 48 -6.638 7.151 2.764 1.00 0.00 H new ATOM 0 HB THR A 48 -3.689 7.285 2.032 1.00 0.00 H new ATOM 0 HG1 THR A 48 -3.377 6.845 4.314 1.00 0.00 H new ATOM 0 HG21 THR A 48 -3.633 9.131 3.668 1.00 0.00 H new ATOM 0 HG22 THR A 48 -4.755 9.472 2.328 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.388 8.961 3.911 1.00 0.00 H new ATOM 685 N SER A 49 -7.108 8.440 0.700 1.00 0.00 N ATOM 686 CA SER A 49 -7.408 9.230 -0.489 1.00 0.00 C ATOM 687 C SER A 49 -6.474 10.432 -0.592 1.00 0.00 C ATOM 688 O SER A 49 -5.977 10.952 0.407 1.00 0.00 O ATOM 689 CB SER A 49 -8.863 9.701 -0.461 1.00 0.00 C ATOM 690 OG SER A 49 -9.088 10.597 0.613 1.00 0.00 O ATOM 0 H SER A 49 -7.818 8.491 1.430 1.00 0.00 H new ATOM 0 HA SER A 49 -7.256 8.597 -1.363 1.00 0.00 H new ATOM 0 HB2 SER A 49 -9.109 10.190 -1.404 1.00 0.00 H new ATOM 0 HB3 SER A 49 -9.525 8.841 -0.366 1.00 0.00 H new ATOM 0 HG SER A 49 -8.631 10.267 1.415 1.00 0.00 H new ATOM 696 N PRO A 50 -6.229 10.885 -1.830 1.00 0.00 N ATOM 697 CA PRO A 50 -5.354 12.031 -2.095 1.00 0.00 C ATOM 698 C PRO A 50 -5.966 13.348 -1.629 1.00 0.00 C ATOM 699 O PRO A 50 -5.359 14.409 -1.768 1.00 0.00 O ATOM 700 CB PRO A 50 -5.206 12.020 -3.619 1.00 0.00 C ATOM 701 CG PRO A 50 -6.433 11.335 -4.113 1.00 0.00 C ATOM 702 CD PRO A 50 -6.787 10.314 -3.067 1.00 0.00 C ATOM 0 HA PRO A 50 -4.407 11.953 -1.560 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -5.130 13.032 -4.017 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -4.305 11.489 -3.926 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -7.247 12.046 -4.255 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -6.253 10.860 -5.077 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.865 10.172 -2.993 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -6.352 9.340 -3.292 1.00 0.00 H new ATOM 710 N SER A 51 -7.172 13.271 -1.074 1.00 0.00 N ATOM 711 CA SER A 51 -7.868 14.457 -0.590 1.00 0.00 C ATOM 712 C SER A 51 -7.692 14.612 0.918 1.00 0.00 C ATOM 713 O SER A 51 -7.657 15.726 1.438 1.00 0.00 O ATOM 714 CB SER A 51 -9.356 14.378 -0.936 1.00 0.00 C ATOM 715 OG SER A 51 -9.938 13.195 -0.418 1.00 0.00 O ATOM 0 H SER A 51 -7.687 12.399 -0.949 1.00 0.00 H new ATOM 0 HA SER A 51 -7.434 15.328 -1.081 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.873 15.248 -0.532 1.00 0.00 H new ATOM 0 HB3 SER A 51 -9.483 14.406 -2.018 1.00 0.00 H new ATOM 0 HG SER A 51 -10.889 13.169 -0.651 1.00 0.00 H new ATOM 721 N GLY A 52 -7.584 13.485 1.614 1.00 0.00 N ATOM 722 CA GLY A 52 -7.414 13.516 3.055 1.00 0.00 C ATOM 723 C GLY A 52 -8.274 12.488 3.762 1.00 0.00 C ATOM 724 O GLY A 52 -8.059 12.192 4.938 1.00 0.00 O ATOM 0 H GLY A 52 -7.611 12.551 1.206 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.366 13.338 3.298 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.663 14.510 3.426 1.00 0.00 H new ATOM 728 N ARG A 53 -9.251 11.943 3.046 1.00 0.00 N ATOM 729 CA ARG A 53 -10.149 10.944 3.614 1.00 0.00 C ATOM 730 C ARG A 53 -9.490 9.567 3.630 1.00 0.00 C ATOM 731 O ARG A 53 -8.694 9.238 2.751 1.00 0.00 O ATOM 732 CB ARG A 53 -11.453 10.887 2.817 1.00 0.00 C ATOM 733 CG ARG A 53 -12.486 11.908 3.265 1.00 0.00 C ATOM 734 CD ARG A 53 -12.313 13.232 2.538 1.00 0.00 C ATOM 735 NE ARG A 53 -13.468 14.108 2.713 1.00 0.00 N ATOM 736 CZ ARG A 53 -13.431 15.421 2.518 1.00 0.00 C ATOM 737 NH1 ARG A 53 -12.303 16.007 2.143 1.00 0.00 N ATOM 738 NH2 ARG A 53 -14.524 16.151 2.698 1.00 0.00 N ATOM 0 H ARG A 53 -9.441 12.176 2.071 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.371 11.234 4.641 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.231 11.046 1.762 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.880 9.888 2.906 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -13.487 11.519 3.081 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.399 12.068 4.340 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -11.418 13.734 2.907 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -12.158 13.044 1.475 1.00 0.00 H new ATOM 0 HE ARG A 53 -14.352 13.688 3.001 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -11.460 15.449 2.003 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -12.277 17.016 1.994 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -15.394 15.704 2.987 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -14.494 17.159 2.548 1.00 0.00 H new ATOM 752 N VAL A 54 -9.826 8.768 4.638 1.00 0.00 N ATOM 753 CA VAL A 54 -9.268 7.427 4.769 1.00 0.00 C ATOM 754 C VAL A 54 -10.363 6.368 4.710 1.00 0.00 C ATOM 755 O VAL A 54 -11.360 6.448 5.430 1.00 0.00 O ATOM 756 CB VAL A 54 -8.488 7.271 6.087 1.00 0.00 C ATOM 757 CG1 VAL A 54 -8.076 5.821 6.295 1.00 0.00 C ATOM 758 CG2 VAL A 54 -7.273 8.186 6.099 1.00 0.00 C ATOM 0 H VAL A 54 -10.482 9.026 5.376 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.584 7.285 3.932 1.00 0.00 H new ATOM 0 HB VAL A 54 -9.140 7.561 6.911 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.526 5.730 7.231 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.965 5.192 6.334 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.441 5.501 5.469 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.734 8.062 7.038 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -6.617 7.930 5.267 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -7.597 9.222 6.000 1.00 0.00 H new ATOM 768 N THR A 55 -10.172 5.374 3.848 1.00 0.00 N ATOM 769 CA THR A 55 -11.144 4.299 3.694 1.00 0.00 C ATOM 770 C THR A 55 -10.670 3.027 4.389 1.00 0.00 C ATOM 771 O THR A 55 -9.475 2.841 4.615 1.00 0.00 O ATOM 772 CB THR A 55 -11.410 3.990 2.209 1.00 0.00 C ATOM 773 OG1 THR A 55 -11.536 5.210 1.470 1.00 0.00 O ATOM 774 CG2 THR A 55 -12.674 3.160 2.047 1.00 0.00 C ATOM 0 H THR A 55 -9.353 5.291 3.246 1.00 0.00 H new ATOM 0 HA THR A 55 -12.070 4.641 4.157 1.00 0.00 H new ATOM 0 HB THR A 55 -10.567 3.417 1.823 1.00 0.00 H new ATOM 0 HG1 THR A 55 -11.703 5.005 0.526 1.00 0.00 H new ATOM 0 HG21 THR A 55 -12.841 2.954 0.990 1.00 0.00 H new ATOM 0 HG22 THR A 55 -12.563 2.219 2.587 1.00 0.00 H new ATOM 0 HG23 THR A 55 -13.525 3.711 2.448 1.00 0.00 H new ATOM 782 N GLU A 56 -11.615 2.154 4.724 1.00 0.00 N ATOM 783 CA GLU A 56 -11.292 0.899 5.393 1.00 0.00 C ATOM 784 C GLU A 56 -11.167 -0.239 4.385 1.00 0.00 C ATOM 785 O GLU A 56 -11.828 -0.237 3.346 1.00 0.00 O ATOM 786 CB GLU A 56 -12.363 0.559 6.432 1.00 0.00 C ATOM 787 CG GLU A 56 -11.967 -0.570 7.368 1.00 0.00 C ATOM 788 CD GLU A 56 -12.747 -0.552 8.668 1.00 0.00 C ATOM 789 OE1 GLU A 56 -13.181 0.543 9.085 1.00 0.00 O ATOM 790 OE2 GLU A 56 -12.925 -1.633 9.268 1.00 0.00 O ATOM 0 H GLU A 56 -12.609 2.292 4.543 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.333 1.022 5.896 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.580 1.449 7.022 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -13.284 0.286 5.916 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -12.126 -1.525 6.867 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.902 -0.498 7.587 1.00 0.00 H new ATOM 797 N ALA A 57 -10.314 -1.209 4.698 1.00 0.00 N ATOM 798 CA ALA A 57 -10.103 -2.353 3.821 1.00 0.00 C ATOM 799 C ALA A 57 -10.229 -3.664 4.590 1.00 0.00 C ATOM 800 O ALA A 57 -10.165 -3.682 5.818 1.00 0.00 O ATOM 801 CB ALA A 57 -8.740 -2.261 3.152 1.00 0.00 C ATOM 0 H ALA A 57 -9.758 -1.225 5.553 1.00 0.00 H new ATOM 0 HA ALA A 57 -10.875 -2.337 3.052 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -8.596 -3.122 2.500 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -8.685 -1.346 2.562 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -7.961 -2.249 3.914 1.00 0.00 H new ATOM 807 N GLU A 58 -10.409 -4.759 3.858 1.00 0.00 N ATOM 808 CA GLU A 58 -10.545 -6.075 4.472 1.00 0.00 C ATOM 809 C GLU A 58 -9.349 -6.960 4.134 1.00 0.00 C ATOM 810 O GLU A 58 -8.789 -6.873 3.042 1.00 0.00 O ATOM 811 CB GLU A 58 -11.839 -6.747 4.008 1.00 0.00 C ATOM 812 CG GLU A 58 -12.002 -8.170 4.518 1.00 0.00 C ATOM 813 CD GLU A 58 -13.450 -8.621 4.534 1.00 0.00 C ATOM 814 OE1 GLU A 58 -14.285 -7.911 5.131 1.00 0.00 O ATOM 815 OE2 GLU A 58 -13.746 -9.684 3.949 1.00 0.00 O ATOM 0 H GLU A 58 -10.464 -4.761 2.839 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.581 -5.941 5.553 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.688 -6.151 4.342 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -11.864 -6.755 2.918 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.422 -8.846 3.890 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.592 -8.240 5.526 1.00 0.00 H new ATOM 822 N ILE A 59 -8.964 -7.810 5.080 1.00 0.00 N ATOM 823 CA ILE A 59 -7.836 -8.712 4.882 1.00 0.00 C ATOM 824 C ILE A 59 -8.298 -10.163 4.808 1.00 0.00 C ATOM 825 O ILE A 59 -8.529 -10.806 5.833 1.00 0.00 O ATOM 826 CB ILE A 59 -6.799 -8.572 6.013 1.00 0.00 C ATOM 827 CG1 ILE A 59 -6.443 -7.100 6.229 1.00 0.00 C ATOM 828 CG2 ILE A 59 -5.553 -9.382 5.692 1.00 0.00 C ATOM 829 CD1 ILE A 59 -5.690 -6.842 7.515 1.00 0.00 C ATOM 0 H ILE A 59 -9.416 -7.893 5.991 1.00 0.00 H new ATOM 0 HA ILE A 59 -7.371 -8.433 3.936 1.00 0.00 H new ATOM 0 HB ILE A 59 -7.234 -8.960 6.934 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.841 -6.753 5.389 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.359 -6.509 6.229 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -4.830 -9.273 6.500 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.820 -10.433 5.584 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -5.114 -9.021 4.762 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -5.471 -5.778 7.601 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.299 -7.157 8.363 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -4.757 -7.405 7.509 1.00 0.00 H new ATOM 841 N VAL A 60 -8.429 -10.675 3.588 1.00 0.00 N ATOM 842 CA VAL A 60 -8.861 -12.052 3.380 1.00 0.00 C ATOM 843 C VAL A 60 -7.830 -13.038 3.917 1.00 0.00 C ATOM 844 O VAL A 60 -6.655 -13.007 3.552 1.00 0.00 O ATOM 845 CB VAL A 60 -9.105 -12.343 1.887 1.00 0.00 C ATOM 846 CG1 VAL A 60 -9.664 -13.746 1.701 1.00 0.00 C ATOM 847 CG2 VAL A 60 -10.039 -11.304 1.287 1.00 0.00 C ATOM 0 H VAL A 60 -8.242 -10.157 2.729 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.797 -12.177 3.925 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.151 -12.285 1.363 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.830 -13.934 0.640 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -8.954 -14.475 2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -10.609 -13.835 2.237 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -10.200 -11.525 0.232 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -10.994 -11.327 1.812 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -9.594 -10.314 1.386 1.00 0.00 H new ATOM 857 N PRO A 61 -8.279 -13.937 4.806 1.00 0.00 N ATOM 858 CA PRO A 61 -7.411 -14.951 5.412 1.00 0.00 C ATOM 859 C PRO A 61 -6.974 -16.015 4.410 1.00 0.00 C ATOM 860 O PRO A 61 -7.538 -17.107 4.365 1.00 0.00 O ATOM 861 CB PRO A 61 -8.295 -15.571 6.498 1.00 0.00 C ATOM 862 CG PRO A 61 -9.690 -15.342 6.027 1.00 0.00 C ATOM 863 CD PRO A 61 -9.667 -14.033 5.287 1.00 0.00 C ATOM 0 HA PRO A 61 -6.484 -14.520 5.791 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -8.087 -16.634 6.618 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -8.122 -15.101 7.466 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -10.020 -16.152 5.377 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -10.384 -15.304 6.867 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -10.379 -14.025 4.462 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.925 -13.198 5.939 1.00 0.00 H new ATOM 871 N MET A 62 -5.966 -15.687 3.609 1.00 0.00 N ATOM 872 CA MET A 62 -5.452 -16.615 2.609 1.00 0.00 C ATOM 873 C MET A 62 -5.270 -18.008 3.203 1.00 0.00 C ATOM 874 O MET A 62 -5.720 -19.001 2.632 1.00 0.00 O ATOM 875 CB MET A 62 -4.122 -16.109 2.047 1.00 0.00 C ATOM 876 CG MET A 62 -4.282 -15.110 0.913 1.00 0.00 C ATOM 877 SD MET A 62 -2.825 -15.023 -0.146 1.00 0.00 S ATOM 878 CE MET A 62 -3.550 -15.371 -1.747 1.00 0.00 C ATOM 0 H MET A 62 -5.489 -14.786 3.633 1.00 0.00 H new ATOM 0 HA MET A 62 -6.179 -16.677 1.799 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.550 -15.645 2.851 1.00 0.00 H new ATOM 0 HB3 MET A 62 -3.540 -16.959 1.692 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.148 -15.385 0.311 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.484 -14.123 1.329 1.00 0.00 H new ATOM 0 HE1 MET A 62 -2.772 -15.353 -2.510 1.00 0.00 H new ATOM 0 HE2 MET A 62 -4.017 -16.356 -1.728 1.00 0.00 H new ATOM 0 HE3 MET A 62 -4.302 -14.617 -1.978 1.00 0.00 H new ATOM 888 N GLY A 63 -4.607 -18.074 4.353 1.00 0.00 N ATOM 889 CA GLY A 63 -4.377 -19.350 5.005 1.00 0.00 C ATOM 890 C GLY A 63 -2.997 -19.444 5.625 1.00 0.00 C ATOM 891 O GLY A 63 -2.790 -20.180 6.590 1.00 0.00 O ATOM 0 H GLY A 63 -4.225 -17.266 4.845 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.130 -19.500 5.778 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -4.501 -20.153 4.279 1.00 0.00 H new ATOM 895 N LYS A 64 -2.048 -18.699 5.069 1.00 0.00 N ATOM 896 CA LYS A 64 -0.679 -18.700 5.572 1.00 0.00 C ATOM 897 C LYS A 64 -0.205 -17.280 5.864 1.00 0.00 C ATOM 898 O LYS A 64 -0.966 -16.322 5.731 1.00 0.00 O ATOM 899 CB LYS A 64 0.257 -19.364 4.560 1.00 0.00 C ATOM 900 CG LYS A 64 0.313 -18.646 3.222 1.00 0.00 C ATOM 901 CD LYS A 64 0.600 -19.611 2.083 1.00 0.00 C ATOM 902 CE LYS A 64 2.050 -20.068 2.091 1.00 0.00 C ATOM 903 NZ LYS A 64 2.438 -20.706 0.803 1.00 0.00 N ATOM 0 H LYS A 64 -2.202 -18.086 4.269 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.661 -19.268 6.502 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.261 -19.409 4.981 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -0.067 -20.392 4.398 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -0.634 -18.139 3.040 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.085 -17.877 3.252 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.056 -20.478 2.165 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.375 -19.130 1.131 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.699 -19.213 2.283 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.204 -20.774 2.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.433 -21.004 0.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.836 -21.537 0.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.316 -20.024 0.027 1.00 0.00 H new ATOM 917 N ASN A 65 1.056 -17.152 6.261 1.00 0.00 N ATOM 918 CA ASN A 65 1.632 -15.848 6.571 1.00 0.00 C ATOM 919 C ASN A 65 1.226 -14.813 5.527 1.00 0.00 C ATOM 920 O ASN A 65 1.233 -13.611 5.794 1.00 0.00 O ATOM 921 CB ASN A 65 3.157 -15.945 6.644 1.00 0.00 C ATOM 922 CG ASN A 65 3.768 -16.435 5.345 1.00 0.00 C ATOM 923 OD1 ASN A 65 3.824 -17.638 5.088 1.00 0.00 O ATOM 924 ND2 ASN A 65 4.229 -15.504 4.519 1.00 0.00 N ATOM 0 H ASN A 65 1.699 -17.935 6.376 1.00 0.00 H new ATOM 0 HA ASN A 65 1.249 -15.530 7.541 1.00 0.00 H new ATOM 0 HB2 ASN A 65 3.569 -14.966 6.890 1.00 0.00 H new ATOM 0 HB3 ASN A 65 3.437 -16.621 7.452 1.00 0.00 H new ATOM 0 HD21 ASN A 65 4.650 -15.774 3.630 1.00 0.00 H new ATOM 0 HD22 ASN A 65 4.162 -14.518 4.773 1.00 0.00 H new ATOM 931 N SER A 66 0.872 -15.287 4.337 1.00 0.00 N ATOM 932 CA SER A 66 0.466 -14.403 3.251 1.00 0.00 C ATOM 933 C SER A 66 -0.965 -13.913 3.455 1.00 0.00 C ATOM 934 O SER A 66 -1.849 -14.683 3.833 1.00 0.00 O ATOM 935 CB SER A 66 0.583 -15.124 1.907 1.00 0.00 C ATOM 936 OG SER A 66 1.886 -14.986 1.366 1.00 0.00 O ATOM 0 H SER A 66 0.858 -16.279 4.100 1.00 0.00 H new ATOM 0 HA SER A 66 1.131 -13.539 3.251 1.00 0.00 H new ATOM 0 HB2 SER A 66 0.349 -16.181 2.036 1.00 0.00 H new ATOM 0 HB3 SER A 66 -0.149 -14.719 1.208 1.00 0.00 H new ATOM 0 HG SER A 66 1.936 -15.457 0.508 1.00 0.00 H new ATOM 942 N HIS A 67 -1.185 -12.627 3.202 1.00 0.00 N ATOM 943 CA HIS A 67 -2.509 -12.033 3.357 1.00 0.00 C ATOM 944 C HIS A 67 -2.998 -11.445 2.037 1.00 0.00 C ATOM 945 O HIS A 67 -2.203 -10.971 1.225 1.00 0.00 O ATOM 946 CB HIS A 67 -2.481 -10.948 4.434 1.00 0.00 C ATOM 947 CG HIS A 67 -2.424 -11.490 5.829 1.00 0.00 C ATOM 948 ND1 HIS A 67 -3.551 -11.789 6.566 1.00 0.00 N ATOM 949 CD2 HIS A 67 -1.368 -11.787 6.621 1.00 0.00 C ATOM 950 CE1 HIS A 67 -3.189 -12.246 7.752 1.00 0.00 C ATOM 951 NE2 HIS A 67 -1.870 -12.255 7.811 1.00 0.00 N ATOM 0 H HIS A 67 -0.465 -11.976 2.889 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.200 -12.819 3.662 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.617 -10.305 4.267 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -3.368 -10.323 4.332 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -0.325 -11.677 6.365 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.859 -12.559 8.539 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -1.314 -12.560 8.610 1.00 0.00 H new ATOM 959 N CYS A 68 -4.310 -11.479 1.831 1.00 0.00 N ATOM 960 CA CYS A 68 -4.905 -10.951 0.608 1.00 0.00 C ATOM 961 C CYS A 68 -5.867 -9.810 0.922 1.00 0.00 C ATOM 962 O CYS A 68 -6.955 -10.029 1.456 1.00 0.00 O ATOM 963 CB CYS A 68 -5.639 -12.060 -0.147 1.00 0.00 C ATOM 964 SG CYS A 68 -6.691 -11.466 -1.492 1.00 0.00 S ATOM 0 H CYS A 68 -4.981 -11.866 2.494 1.00 0.00 H new ATOM 0 HA CYS A 68 -4.103 -10.564 -0.020 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -4.905 -12.755 -0.554 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -6.252 -12.621 0.559 1.00 0.00 H new ATOM 0 HG CYS A 68 -7.267 -12.477 -2.071 1.00 0.00 H new ATOM 970 N VAL A 69 -5.459 -8.590 0.587 1.00 0.00 N ATOM 971 CA VAL A 69 -6.285 -7.413 0.833 1.00 0.00 C ATOM 972 C VAL A 69 -7.088 -7.036 -0.407 1.00 0.00 C ATOM 973 O VAL A 69 -6.521 -6.724 -1.454 1.00 0.00 O ATOM 974 CB VAL A 69 -5.429 -6.207 1.264 1.00 0.00 C ATOM 975 CG1 VAL A 69 -6.229 -4.918 1.153 1.00 0.00 C ATOM 976 CG2 VAL A 69 -4.909 -6.402 2.680 1.00 0.00 C ATOM 0 H VAL A 69 -4.562 -8.391 0.145 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.970 -7.670 1.641 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.572 -6.133 0.594 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.608 -4.077 1.462 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.547 -4.775 0.120 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.106 -4.977 1.798 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.306 -5.541 2.968 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -5.750 -6.502 3.366 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -4.297 -7.303 2.722 1.00 0.00 H new ATOM 986 N ARG A 70 -8.410 -7.067 -0.280 1.00 0.00 N ATOM 987 CA ARG A 70 -9.292 -6.729 -1.391 1.00 0.00 C ATOM 988 C ARG A 70 -10.083 -5.459 -1.090 1.00 0.00 C ATOM 989 O ARG A 70 -10.723 -5.347 -0.044 1.00 0.00 O ATOM 990 CB ARG A 70 -10.252 -7.885 -1.678 1.00 0.00 C ATOM 991 CG ARG A 70 -9.551 -9.178 -2.061 1.00 0.00 C ATOM 992 CD ARG A 70 -10.545 -10.307 -2.281 1.00 0.00 C ATOM 993 NE ARG A 70 -10.996 -10.376 -3.668 1.00 0.00 N ATOM 994 CZ ARG A 70 -11.580 -11.445 -4.199 1.00 0.00 C ATOM 995 NH1 ARG A 70 -11.783 -12.528 -3.461 1.00 0.00 N ATOM 996 NH2 ARG A 70 -11.963 -11.432 -5.469 1.00 0.00 N ATOM 0 H ARG A 70 -8.894 -7.323 0.581 1.00 0.00 H new ATOM 0 HA ARG A 70 -8.675 -6.552 -2.272 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.867 -8.063 -0.796 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -10.926 -7.595 -2.484 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -8.969 -9.022 -2.969 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -8.848 -9.458 -1.276 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -10.085 -11.255 -2.002 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -11.405 -10.165 -1.627 1.00 0.00 H new ATOM 0 HE ARG A 70 -10.855 -9.559 -4.262 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -11.491 -12.541 -2.484 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.231 -13.347 -3.871 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -11.809 -10.601 -6.040 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.411 -12.253 -5.875 1.00 0.00 H new ATOM 1010 N PHE A 71 -10.034 -4.505 -2.014 1.00 0.00 N ATOM 1011 CA PHE A 71 -10.745 -3.243 -1.847 1.00 0.00 C ATOM 1012 C PHE A 71 -10.931 -2.542 -3.190 1.00 0.00 C ATOM 1013 O PHE A 71 -10.327 -2.924 -4.192 1.00 0.00 O ATOM 1014 CB PHE A 71 -9.986 -2.329 -0.883 1.00 0.00 C ATOM 1015 CG PHE A 71 -8.557 -2.092 -1.281 1.00 0.00 C ATOM 1016 CD1 PHE A 71 -8.252 -1.316 -2.388 1.00 0.00 C ATOM 1017 CD2 PHE A 71 -7.519 -2.645 -0.548 1.00 0.00 C ATOM 1018 CE1 PHE A 71 -6.938 -1.098 -2.757 1.00 0.00 C ATOM 1019 CE2 PHE A 71 -6.203 -2.429 -0.912 1.00 0.00 C ATOM 1020 CZ PHE A 71 -5.913 -1.654 -2.017 1.00 0.00 C ATOM 0 H PHE A 71 -9.510 -4.582 -2.886 1.00 0.00 H new ATOM 0 HA PHE A 71 -11.729 -3.461 -1.431 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -10.501 -1.371 -0.822 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -10.009 -2.767 0.115 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -9.050 -0.877 -2.969 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -7.741 -3.252 0.318 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.713 -0.493 -3.623 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -5.403 -2.866 -0.333 1.00 0.00 H new ATOM 0 HZ PHE A 71 -4.886 -1.483 -2.303 1.00 0.00 H new ATOM 1030 N VAL A 72 -11.773 -1.513 -3.202 1.00 0.00 N ATOM 1031 CA VAL A 72 -12.039 -0.757 -4.420 1.00 0.00 C ATOM 1032 C VAL A 72 -11.311 0.582 -4.406 1.00 0.00 C ATOM 1033 O VAL A 72 -11.801 1.578 -3.874 1.00 0.00 O ATOM 1034 CB VAL A 72 -13.547 -0.507 -4.607 1.00 0.00 C ATOM 1035 CG1 VAL A 72 -13.803 0.290 -5.877 1.00 0.00 C ATOM 1036 CG2 VAL A 72 -14.306 -1.825 -4.633 1.00 0.00 C ATOM 0 H VAL A 72 -12.282 -1.184 -2.382 1.00 0.00 H new ATOM 0 HA VAL A 72 -11.672 -1.358 -5.252 1.00 0.00 H new ATOM 0 HB VAL A 72 -13.908 0.078 -3.761 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -14.874 0.457 -5.992 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -13.291 1.250 -5.813 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.428 -0.265 -6.737 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.370 -1.630 -4.766 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -13.944 -2.437 -5.459 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -14.149 -2.354 -3.693 1.00 0.00 H new ATOM 1046 N PRO A 73 -10.111 0.610 -5.005 1.00 0.00 N ATOM 1047 CA PRO A 73 -9.289 1.822 -5.076 1.00 0.00 C ATOM 1048 C PRO A 73 -9.887 2.873 -6.005 1.00 0.00 C ATOM 1049 O PRO A 73 -9.495 2.982 -7.167 1.00 0.00 O ATOM 1050 CB PRO A 73 -7.956 1.314 -5.631 1.00 0.00 C ATOM 1051 CG PRO A 73 -8.306 0.081 -6.390 1.00 0.00 C ATOM 1052 CD PRO A 73 -9.465 -0.540 -5.660 1.00 0.00 C ATOM 0 HA PRO A 73 -9.203 2.314 -4.107 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -7.487 2.057 -6.277 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -7.250 1.098 -4.829 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.576 0.319 -7.419 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.459 -0.604 -6.433 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -10.145 -1.047 -6.344 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -9.132 -1.281 -4.934 1.00 0.00 H new ATOM 1060 N GLN A 74 -10.836 3.645 -5.485 1.00 0.00 N ATOM 1061 CA GLN A 74 -11.487 4.688 -6.270 1.00 0.00 C ATOM 1062 C GLN A 74 -11.260 6.060 -5.645 1.00 0.00 C ATOM 1063 O GLN A 74 -11.756 6.345 -4.555 1.00 0.00 O ATOM 1064 CB GLN A 74 -12.986 4.408 -6.385 1.00 0.00 C ATOM 1065 CG GLN A 74 -13.687 5.267 -7.425 1.00 0.00 C ATOM 1066 CD GLN A 74 -15.138 4.873 -7.625 1.00 0.00 C ATOM 1067 OE1 GLN A 74 -16.047 5.671 -7.392 1.00 0.00 O ATOM 1068 NE2 GLN A 74 -15.362 3.639 -8.059 1.00 0.00 N ATOM 0 H GLN A 74 -11.171 3.568 -4.525 1.00 0.00 H new ATOM 0 HA GLN A 74 -11.047 4.686 -7.267 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -13.133 3.357 -6.635 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -13.454 4.573 -5.414 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -13.637 6.313 -7.121 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -13.158 5.186 -8.375 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -14.578 3.012 -8.239 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -16.318 3.318 -8.213 1.00 0.00 H new ATOM 1077 N GLU A 75 -10.508 6.906 -6.342 1.00 0.00 N ATOM 1078 CA GLU A 75 -10.215 8.248 -5.853 1.00 0.00 C ATOM 1079 C GLU A 75 -10.182 9.251 -7.004 1.00 0.00 C ATOM 1080 O GLU A 75 -10.379 8.888 -8.163 1.00 0.00 O ATOM 1081 CB GLU A 75 -8.878 8.264 -5.110 1.00 0.00 C ATOM 1082 CG GLU A 75 -9.000 7.933 -3.632 1.00 0.00 C ATOM 1083 CD GLU A 75 -9.382 6.486 -3.388 1.00 0.00 C ATOM 1084 OE1 GLU A 75 -9.141 5.650 -4.284 1.00 0.00 O ATOM 1085 OE2 GLU A 75 -9.923 6.189 -2.302 1.00 0.00 O ATOM 0 H GLU A 75 -10.091 6.686 -7.246 1.00 0.00 H new ATOM 0 HA GLU A 75 -11.008 8.537 -5.164 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.202 7.549 -5.579 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -8.424 9.249 -5.217 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -8.052 8.143 -3.137 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -9.747 8.584 -3.178 1.00 0.00 H new ATOM 1092 N MET A 76 -9.931 10.513 -6.673 1.00 0.00 N ATOM 1093 CA MET A 76 -9.871 11.568 -7.678 1.00 0.00 C ATOM 1094 C MET A 76 -8.425 11.903 -8.029 1.00 0.00 C ATOM 1095 O MET A 76 -8.157 12.867 -8.746 1.00 0.00 O ATOM 1096 CB MET A 76 -10.590 12.822 -7.176 1.00 0.00 C ATOM 1097 CG MET A 76 -12.101 12.669 -7.105 1.00 0.00 C ATOM 1098 SD MET A 76 -12.920 13.138 -8.640 1.00 0.00 S ATOM 1099 CE MET A 76 -13.132 11.537 -9.415 1.00 0.00 C ATOM 0 H MET A 76 -9.766 10.830 -5.718 1.00 0.00 H new ATOM 0 HA MET A 76 -10.370 11.207 -8.577 1.00 0.00 H new ATOM 0 HB2 MET A 76 -10.212 13.076 -6.186 1.00 0.00 H new ATOM 0 HB3 MET A 76 -10.348 13.657 -7.833 1.00 0.00 H new ATOM 0 HG2 MET A 76 -12.347 11.634 -6.869 1.00 0.00 H new ATOM 0 HG3 MET A 76 -12.486 13.282 -6.290 1.00 0.00 H new ATOM 0 HE1 MET A 76 -12.685 11.552 -10.409 1.00 0.00 H new ATOM 0 HE2 MET A 76 -12.645 10.772 -8.810 1.00 0.00 H new ATOM 0 HE3 MET A 76 -14.195 11.311 -9.498 1.00 0.00 H new ATOM 1109 N GLY A 77 -7.496 11.101 -7.518 1.00 0.00 N ATOM 1110 CA GLY A 77 -6.088 11.330 -7.788 1.00 0.00 C ATOM 1111 C GLY A 77 -5.255 10.075 -7.627 1.00 0.00 C ATOM 1112 O GLY A 77 -5.472 9.083 -8.323 1.00 0.00 O ATOM 0 H GLY A 77 -7.693 10.297 -6.922 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.973 11.711 -8.803 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -5.713 12.100 -7.114 1.00 0.00 H new ATOM 1116 N VAL A 78 -4.297 10.116 -6.707 1.00 0.00 N ATOM 1117 CA VAL A 78 -3.427 8.973 -6.456 1.00 0.00 C ATOM 1118 C VAL A 78 -3.928 8.149 -5.275 1.00 0.00 C ATOM 1119 O VAL A 78 -4.414 8.696 -4.285 1.00 0.00 O ATOM 1120 CB VAL A 78 -1.979 9.420 -6.179 1.00 0.00 C ATOM 1121 CG1 VAL A 78 -1.948 10.487 -5.096 1.00 0.00 C ATOM 1122 CG2 VAL A 78 -1.120 8.226 -5.788 1.00 0.00 C ATOM 0 H VAL A 78 -4.103 10.929 -6.122 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.444 8.359 -7.356 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.568 9.851 -7.092 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.917 10.791 -4.914 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.529 11.351 -5.420 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.376 10.086 -4.177 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.100 8.559 -5.596 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.527 7.764 -4.888 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.117 7.498 -6.600 1.00 0.00 H new ATOM 1132 N HIS A 79 -3.807 6.830 -5.387 1.00 0.00 N ATOM 1133 CA HIS A 79 -4.247 5.930 -4.327 1.00 0.00 C ATOM 1134 C HIS A 79 -3.058 5.419 -3.520 1.00 0.00 C ATOM 1135 O HIS A 79 -2.042 5.008 -4.082 1.00 0.00 O ATOM 1136 CB HIS A 79 -5.020 4.751 -4.919 1.00 0.00 C ATOM 1137 CG HIS A 79 -6.161 5.164 -5.798 1.00 0.00 C ATOM 1138 ND1 HIS A 79 -6.073 6.194 -6.711 1.00 0.00 N ATOM 1139 CD2 HIS A 79 -7.419 4.678 -5.902 1.00 0.00 C ATOM 1140 CE1 HIS A 79 -7.229 6.325 -7.337 1.00 0.00 C ATOM 1141 NE2 HIS A 79 -8.063 5.416 -6.865 1.00 0.00 N ATOM 0 H HIS A 79 -3.408 6.361 -6.200 1.00 0.00 H new ATOM 0 HA HIS A 79 -4.904 6.488 -3.660 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -4.334 4.130 -5.495 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -5.403 4.133 -4.107 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -7.839 3.861 -5.334 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -7.454 7.051 -8.104 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -9.028 5.284 -7.167 1.00 0.00 H new ATOM 1149 N THR A 80 -3.190 5.448 -2.197 1.00 0.00 N ATOM 1150 CA THR A 80 -2.126 4.991 -1.312 1.00 0.00 C ATOM 1151 C THR A 80 -2.681 4.123 -0.188 1.00 0.00 C ATOM 1152 O THR A 80 -3.642 4.499 0.483 1.00 0.00 O ATOM 1153 CB THR A 80 -1.357 6.176 -0.698 1.00 0.00 C ATOM 1154 OG1 THR A 80 -1.176 7.203 -1.680 1.00 0.00 O ATOM 1155 CG2 THR A 80 -0.003 5.727 -0.171 1.00 0.00 C ATOM 0 H THR A 80 -4.024 5.783 -1.715 1.00 0.00 H new ATOM 0 HA THR A 80 -1.441 4.400 -1.920 1.00 0.00 H new ATOM 0 HB THR A 80 -1.941 6.568 0.135 1.00 0.00 H new ATOM 0 HG1 THR A 80 -0.688 7.954 -1.282 1.00 0.00 H new ATOM 0 HG21 THR A 80 0.522 6.581 0.258 1.00 0.00 H new ATOM 0 HG22 THR A 80 -0.145 4.966 0.596 1.00 0.00 H new ATOM 0 HG23 THR A 80 0.586 5.312 -0.989 1.00 0.00 H new ATOM 1163 N VAL A 81 -2.070 2.960 0.012 1.00 0.00 N ATOM 1164 CA VAL A 81 -2.502 2.039 1.057 1.00 0.00 C ATOM 1165 C VAL A 81 -1.673 2.217 2.323 1.00 0.00 C ATOM 1166 O VAL A 81 -0.444 2.167 2.285 1.00 0.00 O ATOM 1167 CB VAL A 81 -2.401 0.574 0.591 1.00 0.00 C ATOM 1168 CG1 VAL A 81 -2.742 -0.373 1.731 1.00 0.00 C ATOM 1169 CG2 VAL A 81 -3.309 0.332 -0.605 1.00 0.00 C ATOM 0 H VAL A 81 -1.274 2.633 -0.536 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.545 2.272 1.274 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.374 0.378 0.283 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.665 -1.403 1.383 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.046 -0.215 2.555 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.759 -0.180 2.073 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -3.225 -0.708 -0.921 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -4.341 0.545 -0.327 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -3.012 0.986 -1.425 1.00 0.00 H new ATOM 1179 N SER A 82 -2.354 2.423 3.446 1.00 0.00 N ATOM 1180 CA SER A 82 -1.680 2.612 4.725 1.00 0.00 C ATOM 1181 C SER A 82 -1.726 1.333 5.557 1.00 0.00 C ATOM 1182 O SER A 82 -2.725 1.044 6.216 1.00 0.00 O ATOM 1183 CB SER A 82 -2.325 3.762 5.501 1.00 0.00 C ATOM 1184 OG SER A 82 -1.476 4.215 6.541 1.00 0.00 O ATOM 0 H SER A 82 -3.372 2.463 3.496 1.00 0.00 H new ATOM 0 HA SER A 82 -0.637 2.858 4.525 1.00 0.00 H new ATOM 0 HB2 SER A 82 -2.544 4.586 4.821 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.276 3.433 5.921 1.00 0.00 H new ATOM 0 HG SER A 82 -1.273 5.164 6.407 1.00 0.00 H new ATOM 1190 N VAL A 83 -0.638 0.572 5.521 1.00 0.00 N ATOM 1191 CA VAL A 83 -0.552 -0.675 6.272 1.00 0.00 C ATOM 1192 C VAL A 83 0.364 -0.527 7.481 1.00 0.00 C ATOM 1193 O VAL A 83 1.585 -0.447 7.344 1.00 0.00 O ATOM 1194 CB VAL A 83 -0.035 -1.827 5.389 1.00 0.00 C ATOM 1195 CG1 VAL A 83 0.049 -3.117 6.190 1.00 0.00 C ATOM 1196 CG2 VAL A 83 -0.927 -2.004 4.169 1.00 0.00 C ATOM 0 H VAL A 83 0.197 0.797 4.980 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.561 -0.910 6.611 1.00 0.00 H new ATOM 0 HB VAL A 83 0.968 -1.576 5.044 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.416 -3.919 5.550 1.00 0.00 H new ATOM 0 HG12 VAL A 83 0.732 -2.981 7.029 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.940 -3.377 6.566 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.547 -2.822 3.556 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.943 -2.233 4.491 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.931 -1.084 3.584 1.00 0.00 H new ATOM 1206 N LYS A 84 -0.234 -0.490 8.668 1.00 0.00 N ATOM 1207 CA LYS A 84 0.527 -0.353 9.904 1.00 0.00 C ATOM 1208 C LYS A 84 0.442 -1.626 10.739 1.00 0.00 C ATOM 1209 O LYS A 84 -0.498 -2.409 10.601 1.00 0.00 O ATOM 1210 CB LYS A 84 0.011 0.838 10.715 1.00 0.00 C ATOM 1211 CG LYS A 84 0.070 2.157 9.965 1.00 0.00 C ATOM 1212 CD LYS A 84 -0.365 3.318 10.843 1.00 0.00 C ATOM 1213 CE LYS A 84 -0.855 4.493 10.011 1.00 0.00 C ATOM 1214 NZ LYS A 84 -0.732 5.783 10.746 1.00 0.00 N ATOM 0 H LYS A 84 -1.244 -0.553 8.799 1.00 0.00 H new ATOM 0 HA LYS A 84 1.571 -0.181 9.642 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -1.020 0.645 11.012 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.596 0.924 11.631 1.00 0.00 H new ATOM 0 HG2 LYS A 84 1.086 2.329 9.610 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.571 2.105 9.085 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.159 2.990 11.514 1.00 0.00 H new ATOM 0 HD3 LYS A 84 0.470 3.636 11.467 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.282 4.546 9.085 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.896 4.332 9.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -1.076 6.559 10.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.299 5.742 11.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 0.265 5.950 10.990 1.00 0.00 H new ATOM 1228 N TYR A 85 1.428 -1.826 11.607 1.00 0.00 N ATOM 1229 CA TYR A 85 1.464 -3.005 12.464 1.00 0.00 C ATOM 1230 C TYR A 85 1.698 -2.613 13.920 1.00 0.00 C ATOM 1231 O TYR A 85 2.836 -2.407 14.344 1.00 0.00 O ATOM 1232 CB TYR A 85 2.560 -3.965 12.000 1.00 0.00 C ATOM 1233 CG TYR A 85 2.852 -5.073 12.987 1.00 0.00 C ATOM 1234 CD1 TYR A 85 2.025 -6.186 13.076 1.00 0.00 C ATOM 1235 CD2 TYR A 85 3.955 -5.007 13.830 1.00 0.00 C ATOM 1236 CE1 TYR A 85 2.287 -7.201 13.976 1.00 0.00 C ATOM 1237 CE2 TYR A 85 4.225 -6.018 14.732 1.00 0.00 C ATOM 1238 CZ TYR A 85 3.389 -7.112 14.802 1.00 0.00 C ATOM 1239 OH TYR A 85 3.654 -8.120 15.700 1.00 0.00 O ATOM 0 H TYR A 85 2.213 -1.187 11.735 1.00 0.00 H new ATOM 0 HA TYR A 85 0.498 -3.505 12.392 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.266 -4.406 11.048 1.00 0.00 H new ATOM 0 HB3 TYR A 85 3.474 -3.400 11.820 1.00 0.00 H new ATOM 0 HD1 TYR A 85 1.162 -6.259 12.430 1.00 0.00 H new ATOM 0 HD2 TYR A 85 4.612 -4.151 13.779 1.00 0.00 H new ATOM 0 HE1 TYR A 85 1.633 -8.059 14.033 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.087 -5.952 15.379 1.00 0.00 H new ATOM 0 HH TYR A 85 4.466 -7.904 16.204 1.00 0.00 H new ATOM 1249 N ARG A 86 0.613 -2.513 14.681 1.00 0.00 N ATOM 1250 CA ARG A 86 0.699 -2.145 16.089 1.00 0.00 C ATOM 1251 C ARG A 86 1.199 -0.712 16.248 1.00 0.00 C ATOM 1252 O ARG A 86 1.786 -0.358 17.269 1.00 0.00 O ATOM 1253 CB ARG A 86 1.628 -3.106 16.833 1.00 0.00 C ATOM 1254 CG ARG A 86 1.294 -4.572 16.610 1.00 0.00 C ATOM 1255 CD ARG A 86 2.098 -5.473 17.534 1.00 0.00 C ATOM 1256 NE ARG A 86 2.398 -4.824 18.807 1.00 0.00 N ATOM 1257 CZ ARG A 86 3.437 -4.018 18.994 1.00 0.00 C ATOM 1258 NH1 ARG A 86 4.270 -3.763 17.994 1.00 0.00 N ATOM 1259 NH2 ARG A 86 3.644 -3.465 20.182 1.00 0.00 N ATOM 0 H ARG A 86 -0.336 -2.682 14.346 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.301 -2.212 16.517 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.655 -2.924 16.516 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.581 -2.890 17.900 1.00 0.00 H new ATOM 0 HG2 ARG A 86 0.229 -4.733 16.778 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.497 -4.839 15.573 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.542 -6.392 17.718 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.029 -5.757 17.044 1.00 0.00 H new ATOM 0 HE ARG A 86 1.776 -4.999 19.596 1.00 0.00 H new ATOM 0 HH11 ARG A 86 4.113 -4.186 17.079 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.067 -3.144 18.140 1.00 0.00 H new ATOM 0 HH21 ARG A 86 3.005 -3.659 20.953 1.00 0.00 H new ATOM 0 HH22 ARG A 86 4.442 -2.846 20.324 1.00 0.00 H new ATOM 1273 N GLY A 87 0.962 0.108 15.228 1.00 0.00 N ATOM 1274 CA GLY A 87 1.395 1.493 15.274 1.00 0.00 C ATOM 1275 C GLY A 87 2.750 1.698 14.627 1.00 0.00 C ATOM 1276 O GLY A 87 3.612 2.379 15.181 1.00 0.00 O ATOM 0 H GLY A 87 0.478 -0.162 14.371 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.657 2.118 14.771 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.438 1.823 16.312 1.00 0.00 H new ATOM 1280 N GLN A 88 2.939 1.106 13.452 1.00 0.00 N ATOM 1281 CA GLN A 88 4.201 1.225 12.731 1.00 0.00 C ATOM 1282 C GLN A 88 4.031 0.831 11.268 1.00 0.00 C ATOM 1283 O GLN A 88 3.650 -0.299 10.959 1.00 0.00 O ATOM 1284 CB GLN A 88 5.272 0.352 13.386 1.00 0.00 C ATOM 1285 CG GLN A 88 5.313 -1.069 12.845 1.00 0.00 C ATOM 1286 CD GLN A 88 6.221 -1.974 13.653 1.00 0.00 C ATOM 1287 OE1 GLN A 88 6.249 -1.908 14.883 1.00 0.00 O ATOM 1288 NE2 GLN A 88 6.969 -2.829 12.966 1.00 0.00 N ATOM 0 H GLN A 88 2.235 0.539 12.979 1.00 0.00 H new ATOM 0 HA GLN A 88 4.517 2.267 12.773 1.00 0.00 H new ATOM 0 HB2 GLN A 88 6.247 0.816 13.239 1.00 0.00 H new ATOM 0 HB3 GLN A 88 5.094 0.318 14.461 1.00 0.00 H new ATOM 0 HG2 GLN A 88 4.304 -1.482 12.842 1.00 0.00 H new ATOM 0 HG3 GLN A 88 5.653 -1.050 11.810 1.00 0.00 H new ATOM 0 HE21 GLN A 88 6.915 -2.850 11.948 1.00 0.00 H new ATOM 0 HE22 GLN A 88 7.598 -3.465 13.457 1.00 0.00 H new ATOM 1297 N HIS A 89 4.315 1.769 10.370 1.00 0.00 N ATOM 1298 CA HIS A 89 4.194 1.518 8.938 1.00 0.00 C ATOM 1299 C HIS A 89 5.133 0.398 8.501 1.00 0.00 C ATOM 1300 O HIS A 89 6.354 0.528 8.589 1.00 0.00 O ATOM 1301 CB HIS A 89 4.498 2.792 8.149 1.00 0.00 C ATOM 1302 CG HIS A 89 3.331 3.725 8.043 1.00 0.00 C ATOM 1303 ND1 HIS A 89 2.442 3.701 6.990 1.00 0.00 N ATOM 1304 CD2 HIS A 89 2.909 4.711 8.869 1.00 0.00 C ATOM 1305 CE1 HIS A 89 1.524 4.634 7.171 1.00 0.00 C ATOM 1306 NE2 HIS A 89 1.784 5.261 8.304 1.00 0.00 N ATOM 0 H HIS A 89 4.630 2.709 10.608 1.00 0.00 H new ATOM 0 HA HIS A 89 3.169 1.208 8.733 1.00 0.00 H new ATOM 0 HB2 HIS A 89 5.328 3.314 8.625 1.00 0.00 H new ATOM 0 HB3 HIS A 89 4.826 2.519 7.146 1.00 0.00 H new ATOM 0 HD2 HIS A 89 3.371 5.010 9.799 1.00 0.00 H new ATOM 0 HE1 HIS A 89 0.701 4.848 6.505 1.00 0.00 H new ATOM 0 HE2 HIS A 89 1.238 6.029 8.696 1.00 0.00 H new ATOM 1314 N VAL A 90 4.555 -0.702 8.030 1.00 0.00 N ATOM 1315 CA VAL A 90 5.340 -1.845 7.579 1.00 0.00 C ATOM 1316 C VAL A 90 6.361 -1.429 6.525 1.00 0.00 C ATOM 1317 O VAL A 90 6.475 -0.251 6.186 1.00 0.00 O ATOM 1318 CB VAL A 90 4.439 -2.950 6.997 1.00 0.00 C ATOM 1319 CG1 VAL A 90 3.599 -3.587 8.094 1.00 0.00 C ATOM 1320 CG2 VAL A 90 3.555 -2.391 5.893 1.00 0.00 C ATOM 0 H VAL A 90 3.546 -0.826 7.951 1.00 0.00 H new ATOM 0 HA VAL A 90 5.862 -2.235 8.453 1.00 0.00 H new ATOM 0 HB VAL A 90 5.075 -3.723 6.565 1.00 0.00 H new ATOM 0 HG11 VAL A 90 2.969 -4.365 7.664 1.00 0.00 H new ATOM 0 HG12 VAL A 90 4.255 -4.025 8.846 1.00 0.00 H new ATOM 0 HG13 VAL A 90 2.971 -2.827 8.559 1.00 0.00 H new ATOM 0 HG21 VAL A 90 2.925 -3.186 5.494 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.926 -1.598 6.297 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.180 -1.988 5.096 1.00 0.00 H new ATOM 1330 N THR A 91 7.101 -2.405 6.008 1.00 0.00 N ATOM 1331 CA THR A 91 8.113 -2.141 4.993 1.00 0.00 C ATOM 1332 C THR A 91 7.504 -1.455 3.776 1.00 0.00 C ATOM 1333 O THR A 91 6.345 -1.687 3.435 1.00 0.00 O ATOM 1334 CB THR A 91 8.808 -3.440 4.542 1.00 0.00 C ATOM 1335 OG1 THR A 91 9.080 -4.269 5.677 1.00 0.00 O ATOM 1336 CG2 THR A 91 10.105 -3.133 3.810 1.00 0.00 C ATOM 0 H THR A 91 7.018 -3.386 6.276 1.00 0.00 H new ATOM 0 HA THR A 91 8.852 -1.481 5.447 1.00 0.00 H new ATOM 0 HB THR A 91 8.140 -3.966 3.860 1.00 0.00 H new ATOM 0 HG1 THR A 91 9.520 -5.093 5.382 1.00 0.00 H new ATOM 0 HG21 THR A 91 10.578 -4.065 3.501 1.00 0.00 H new ATOM 0 HG22 THR A 91 9.891 -2.526 2.930 1.00 0.00 H new ATOM 0 HG23 THR A 91 10.777 -2.588 4.473 1.00 0.00 H new ATOM 1344 N GLY A 92 8.294 -0.608 3.123 1.00 0.00 N ATOM 1345 CA GLY A 92 7.815 0.099 1.949 1.00 0.00 C ATOM 1346 C GLY A 92 6.398 0.610 2.119 1.00 0.00 C ATOM 1347 O GLY A 92 5.643 0.697 1.151 1.00 0.00 O ATOM 0 H GLY A 92 9.257 -0.399 3.386 1.00 0.00 H new ATOM 0 HA2 GLY A 92 8.478 0.938 1.738 1.00 0.00 H new ATOM 0 HA3 GLY A 92 7.857 -0.565 1.086 1.00 0.00 H new ATOM 1351 N SER A 93 6.036 0.947 3.352 1.00 0.00 N ATOM 1352 CA SER A 93 4.698 1.446 3.646 1.00 0.00 C ATOM 1353 C SER A 93 4.740 2.924 4.022 1.00 0.00 C ATOM 1354 O SER A 93 5.661 3.395 4.691 1.00 0.00 O ATOM 1355 CB SER A 93 4.066 0.637 4.781 1.00 0.00 C ATOM 1356 OG SER A 93 2.657 0.576 4.641 1.00 0.00 O ATOM 0 H SER A 93 6.650 0.884 4.164 1.00 0.00 H new ATOM 0 HA SER A 93 4.090 1.334 2.748 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.478 -0.372 4.786 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.320 1.090 5.740 1.00 0.00 H new ATOM 0 HG SER A 93 2.257 0.284 5.486 1.00 0.00 H new ATOM 1362 N PRO A 94 3.719 3.675 3.584 1.00 0.00 N ATOM 1363 CA PRO A 94 2.617 3.126 2.787 1.00 0.00 C ATOM 1364 C PRO A 94 3.059 2.731 1.382 1.00 0.00 C ATOM 1365 O PRO A 94 4.237 2.829 1.041 1.00 0.00 O ATOM 1366 CB PRO A 94 1.613 4.280 2.728 1.00 0.00 C ATOM 1367 CG PRO A 94 2.436 5.508 2.913 1.00 0.00 C ATOM 1368 CD PRO A 94 3.561 5.118 3.831 1.00 0.00 C ATOM 0 HA PRO A 94 2.212 2.213 3.224 1.00 0.00 H new ATOM 0 HB2 PRO A 94 1.085 4.297 1.774 1.00 0.00 H new ATOM 0 HB3 PRO A 94 0.858 4.188 3.509 1.00 0.00 H new ATOM 0 HG2 PRO A 94 2.819 5.869 1.958 1.00 0.00 H new ATOM 0 HG3 PRO A 94 1.842 6.314 3.344 1.00 0.00 H new ATOM 0 HD2 PRO A 94 4.475 5.667 3.603 1.00 0.00 H new ATOM 0 HD3 PRO A 94 3.318 5.323 4.874 1.00 0.00 H new ATOM 1376 N PHE A 95 2.105 2.285 0.571 1.00 0.00 N ATOM 1377 CA PHE A 95 2.396 1.874 -0.798 1.00 0.00 C ATOM 1378 C PHE A 95 1.629 2.734 -1.798 1.00 0.00 C ATOM 1379 O PHE A 95 0.403 2.670 -1.874 1.00 0.00 O ATOM 1380 CB PHE A 95 2.040 0.400 -0.997 1.00 0.00 C ATOM 1381 CG PHE A 95 2.754 -0.523 -0.051 1.00 0.00 C ATOM 1382 CD1 PHE A 95 4.029 -0.982 -0.341 1.00 0.00 C ATOM 1383 CD2 PHE A 95 2.151 -0.931 1.127 1.00 0.00 C ATOM 1384 CE1 PHE A 95 4.689 -1.831 0.528 1.00 0.00 C ATOM 1385 CE2 PHE A 95 2.806 -1.779 2.000 1.00 0.00 C ATOM 1386 CZ PHE A 95 4.077 -2.231 1.699 1.00 0.00 C ATOM 0 H PHE A 95 1.124 2.199 0.838 1.00 0.00 H new ATOM 0 HA PHE A 95 3.463 2.009 -0.973 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.965 0.274 -0.872 1.00 0.00 H new ATOM 0 HB3 PHE A 95 2.278 0.112 -2.021 1.00 0.00 H new ATOM 0 HD1 PHE A 95 4.512 -0.673 -1.256 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.157 -0.582 1.366 1.00 0.00 H new ATOM 0 HE1 PHE A 95 5.683 -2.181 0.291 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.325 -2.088 2.916 1.00 0.00 H new ATOM 0 HZ PHE A 95 4.590 -2.896 2.378 1.00 0.00 H new ATOM 1396 N GLN A 96 2.362 3.538 -2.562 1.00 0.00 N ATOM 1397 CA GLN A 96 1.751 4.412 -3.556 1.00 0.00 C ATOM 1398 C GLN A 96 1.515 3.665 -4.866 1.00 0.00 C ATOM 1399 O GLN A 96 2.376 2.916 -5.329 1.00 0.00 O ATOM 1400 CB GLN A 96 2.636 5.634 -3.805 1.00 0.00 C ATOM 1401 CG GLN A 96 1.856 6.882 -4.187 1.00 0.00 C ATOM 1402 CD GLN A 96 2.673 7.847 -5.024 1.00 0.00 C ATOM 1403 OE1 GLN A 96 2.854 7.646 -6.225 1.00 0.00 O ATOM 1404 NE2 GLN A 96 3.173 8.903 -4.391 1.00 0.00 N ATOM 0 H GLN A 96 3.379 3.602 -2.512 1.00 0.00 H new ATOM 0 HA GLN A 96 0.788 4.743 -3.168 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.218 5.840 -2.907 1.00 0.00 H new ATOM 0 HB3 GLN A 96 3.346 5.402 -4.599 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.963 6.592 -4.741 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.520 7.387 -3.282 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.998 9.030 -3.394 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.732 9.586 -4.902 1.00 0.00 H new ATOM 1413 N PHE A 97 0.344 3.874 -5.457 1.00 0.00 N ATOM 1414 CA PHE A 97 -0.006 3.220 -6.713 1.00 0.00 C ATOM 1415 C PHE A 97 -1.049 4.030 -7.476 1.00 0.00 C ATOM 1416 O PHE A 97 -1.930 4.651 -6.880 1.00 0.00 O ATOM 1417 CB PHE A 97 -0.534 1.809 -6.447 1.00 0.00 C ATOM 1418 CG PHE A 97 -1.877 1.788 -5.776 1.00 0.00 C ATOM 1419 CD1 PHE A 97 -1.977 1.846 -4.395 1.00 0.00 C ATOM 1420 CD2 PHE A 97 -3.040 1.710 -6.525 1.00 0.00 C ATOM 1421 CE1 PHE A 97 -3.212 1.826 -3.775 1.00 0.00 C ATOM 1422 CE2 PHE A 97 -4.278 1.690 -5.911 1.00 0.00 C ATOM 1423 CZ PHE A 97 -4.363 1.750 -4.534 1.00 0.00 C ATOM 0 H PHE A 97 -0.379 4.491 -5.087 1.00 0.00 H new ATOM 0 HA PHE A 97 0.895 3.155 -7.323 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -0.601 1.271 -7.392 1.00 0.00 H new ATOM 0 HB3 PHE A 97 0.183 1.273 -5.825 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -1.080 1.908 -3.797 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -2.978 1.664 -7.602 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.277 1.870 -2.698 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -5.177 1.628 -6.507 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.329 1.737 -4.051 1.00 0.00 H new ATOM 1433 N THR A 98 -0.943 4.021 -8.802 1.00 0.00 N ATOM 1434 CA THR A 98 -1.875 4.756 -9.648 1.00 0.00 C ATOM 1435 C THR A 98 -2.942 3.831 -10.224 1.00 0.00 C ATOM 1436 O THR A 98 -2.648 2.706 -10.631 1.00 0.00 O ATOM 1437 CB THR A 98 -1.146 5.462 -10.806 1.00 0.00 C ATOM 1438 OG1 THR A 98 -0.040 6.218 -10.299 1.00 0.00 O ATOM 1439 CG2 THR A 98 -2.092 6.383 -11.560 1.00 0.00 C ATOM 0 H THR A 98 -0.221 3.513 -9.312 1.00 0.00 H new ATOM 0 HA THR A 98 -2.350 5.506 -9.016 1.00 0.00 H new ATOM 0 HB THR A 98 -0.781 4.700 -11.495 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.420 6.663 -11.041 1.00 0.00 H new ATOM 0 HG21 THR A 98 -1.554 6.870 -12.373 1.00 0.00 H new ATOM 0 HG22 THR A 98 -2.918 5.801 -11.969 1.00 0.00 H new ATOM 0 HG23 THR A 98 -2.483 7.139 -10.879 1.00 0.00 H new ATOM 1447 N VAL A 99 -4.181 4.311 -10.255 1.00 0.00 N ATOM 1448 CA VAL A 99 -5.291 3.527 -10.783 1.00 0.00 C ATOM 1449 C VAL A 99 -5.790 4.101 -12.105 1.00 0.00 C ATOM 1450 O VAL A 99 -5.847 5.317 -12.283 1.00 0.00 O ATOM 1451 CB VAL A 99 -6.463 3.472 -9.786 1.00 0.00 C ATOM 1452 CG1 VAL A 99 -7.604 2.636 -10.347 1.00 0.00 C ATOM 1453 CG2 VAL A 99 -5.997 2.920 -8.447 1.00 0.00 C ATOM 0 H VAL A 99 -4.441 5.239 -9.921 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.915 2.517 -10.947 1.00 0.00 H new ATOM 0 HB VAL A 99 -6.830 4.486 -9.629 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -8.423 2.609 -9.628 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -7.954 3.078 -11.280 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -7.253 1.621 -10.536 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.838 2.888 -7.754 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.603 1.913 -8.586 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.216 3.563 -8.040 1.00 0.00 H new ATOM 1463 N GLY A 100 -6.150 3.217 -13.030 1.00 0.00 N ATOM 1464 CA GLY A 100 -6.640 3.655 -14.324 1.00 0.00 C ATOM 1465 C GLY A 100 -8.103 4.047 -14.287 1.00 0.00 C ATOM 1466 O GLY A 100 -8.907 3.463 -13.560 1.00 0.00 O ATOM 0 H GLY A 100 -6.111 2.205 -12.907 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -6.048 4.504 -14.665 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -6.499 2.856 -15.052 1.00 0.00 H new ATOM 1470 N PRO A 101 -8.468 5.061 -15.086 1.00 0.00 N ATOM 1471 CA PRO A 101 -9.847 5.554 -15.160 1.00 0.00 C ATOM 1472 C PRO A 101 -10.784 4.557 -15.832 1.00 0.00 C ATOM 1473 O PRO A 101 -10.399 3.422 -16.117 1.00 0.00 O ATOM 1474 CB PRO A 101 -9.724 6.826 -16.003 1.00 0.00 C ATOM 1475 CG PRO A 101 -8.502 6.616 -16.828 1.00 0.00 C ATOM 1476 CD PRO A 101 -7.564 5.803 -15.980 1.00 0.00 C ATOM 0 HA PRO A 101 -10.274 5.722 -14.171 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -10.604 6.973 -16.629 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -9.630 7.711 -15.373 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -8.742 6.094 -17.755 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -8.051 7.568 -17.106 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -6.956 5.130 -16.585 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -6.877 6.437 -15.420 1.00 0.00 H new ATOM 1484 N LEU A 102 -12.016 4.987 -16.084 1.00 0.00 N ATOM 1485 CA LEU A 102 -13.009 4.132 -16.725 1.00 0.00 C ATOM 1486 C LEU A 102 -12.646 3.875 -18.184 1.00 0.00 C ATOM 1487 O LEU A 102 -11.994 4.697 -18.826 1.00 0.00 O ATOM 1488 CB LEU A 102 -14.395 4.773 -16.637 1.00 0.00 C ATOM 1489 CG LEU A 102 -15.195 4.469 -15.370 1.00 0.00 C ATOM 1490 CD1 LEU A 102 -14.752 5.372 -14.229 1.00 0.00 C ATOM 1491 CD2 LEU A 102 -16.686 4.629 -15.630 1.00 0.00 C ATOM 0 H LEU A 102 -12.351 5.923 -15.854 1.00 0.00 H new ATOM 0 HA LEU A 102 -13.023 3.177 -16.200 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -14.280 5.854 -16.719 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -14.979 4.448 -17.498 1.00 0.00 H new ATOM 0 HG LEU A 102 -15.005 3.435 -15.083 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -15.332 5.141 -13.336 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -13.694 5.209 -14.026 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -14.912 6.414 -14.506 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -17.240 4.409 -14.718 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.893 5.653 -15.942 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -16.994 3.940 -16.417 1.00 0.00 H new ATOM 1503 N GLY A 103 -13.077 2.729 -18.703 1.00 0.00 N ATOM 1504 CA GLY A 103 -12.790 2.386 -20.083 1.00 0.00 C ATOM 1505 C GLY A 103 -11.569 1.498 -20.218 1.00 0.00 C ATOM 1506 O GLY A 103 -11.458 0.478 -19.539 1.00 0.00 O ATOM 0 H GLY A 103 -13.620 2.033 -18.192 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -13.653 1.880 -20.515 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -12.636 3.300 -20.657 1.00 0.00 H new ATOM 1510 N GLU A 104 -10.651 1.885 -21.099 1.00 0.00 N ATOM 1511 CA GLU A 104 -9.434 1.115 -21.321 1.00 0.00 C ATOM 1512 C GLU A 104 -8.514 1.188 -20.106 1.00 0.00 C ATOM 1513 O GLU A 104 -8.411 2.225 -19.453 1.00 0.00 O ATOM 1514 CB GLU A 104 -8.699 1.627 -22.562 1.00 0.00 C ATOM 1515 CG GLU A 104 -7.332 0.996 -22.764 1.00 0.00 C ATOM 1516 CD GLU A 104 -7.385 -0.519 -22.784 1.00 0.00 C ATOM 1517 OE1 GLU A 104 -8.178 -1.075 -23.573 1.00 0.00 O ATOM 1518 OE2 GLU A 104 -6.634 -1.149 -22.010 1.00 0.00 O ATOM 0 H GLU A 104 -10.728 2.727 -21.670 1.00 0.00 H new ATOM 0 HA GLU A 104 -9.717 0.074 -21.478 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -9.312 1.434 -23.442 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.583 2.708 -22.485 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.906 1.353 -23.702 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.664 1.322 -21.966 1.00 0.00 H new ATOM 1525 N GLY A 105 -7.846 0.077 -19.809 1.00 0.00 N ATOM 1526 CA GLY A 105 -6.944 0.035 -18.673 1.00 0.00 C ATOM 1527 C GLY A 105 -5.584 -0.530 -19.033 1.00 0.00 C ATOM 1528 O GLY A 105 -4.767 0.149 -19.655 1.00 0.00 O ATOM 0 H GLY A 105 -7.914 -0.794 -20.335 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.822 1.041 -18.273 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.388 -0.570 -17.883 1.00 0.00 H new ATOM 1532 N GLY A 106 -5.339 -1.776 -18.640 1.00 0.00 N ATOM 1533 CA GLY A 106 -4.066 -2.410 -18.932 1.00 0.00 C ATOM 1534 C GLY A 106 -3.813 -3.628 -18.067 1.00 0.00 C ATOM 1535 O GLY A 106 -4.468 -4.657 -18.225 1.00 0.00 O ATOM 0 H GLY A 106 -5.999 -2.358 -18.125 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -4.042 -2.702 -19.982 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -3.262 -1.689 -18.783 1.00 0.00 H new TER 1539 GLY A 106