USER MOD reduce.3.24.130724 H: found=0, std=0, add=906, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 904 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 24 ASN : amide:sc= -0.202 X(o=-0.57,f=-0.16) USER MOD Set 1.2: A 41 MET CE :methyl -149:sc= -0.37 (180deg=-1.24) USER MOD Set 2.1: A 33 SER OG : rot 72:sc= 1.03 USER MOD Set 2.2: A 35 ASN : amide:sc= -0.953 K(o=0.076,f=-7.7!) USER MOD Single : A 1 GLY N :NH3+ -102:sc= 0.0165 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.107 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 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 66:sc= 1.18 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc=-0.00121 K(o=-0.0012,f=-0.62) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -130:sc= -1.96! (180deg=-4.64!) USER MOD Single : A 45 THR OG1 : rot 47:sc= -0.398 USER MOD Single : A 46 LYS NZ :NH3+ -179:sc= 0.904 (180deg=0.898) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 48 GLN : amide:sc= -0.0527 K(o=-0.053,f=-1.7!) USER MOD Single : A 55 TYR OH : rot 130:sc= -0.113 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 HIS : no HD1:sc= -7.27! K(o=-7.3!,f=-5.9) USER MOD Single : A 62 GLN : amide:sc= -0.0831 K(o=-0.083,f=-1.4!) USER MOD Single : A 63 SER OG : rot 180:sc= -0.169 USER MOD Single : A 67 SER OG : rot 15:sc= 1.09 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -1.86 K(o=-1.9,f=-3.2) USER MOD Single : A 77 ASN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 88 HIS : no HD1:sc= -0.979 X(o=-0.98,f=-1) USER MOD Single : A 89 ASN : amide:sc= -0.984 X(o=-0.98,f=-0.89!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.00918 USER MOD Single : A 92 CYS SG : rot 51:sc= 0.00303 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 169:sc= -0.442 USER MOD Single : A 108 SER OG : rot -130:sc=-0.00453 USER MOD Single : A 112 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.766) USER MOD Single : A 118 HIS : no HD1:sc= -1.77! K(o=-1.8!,f=-0.8) USER MOD Single : A 119 SER OG : rot 21:sc= 0.312! USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -33.227 35.506 -23.216 1.00 0.00 N ATOM 2 CA GLY A 1 -32.569 34.635 -22.259 1.00 0.00 C ATOM 3 C GLY A 1 -32.191 35.357 -20.982 1.00 0.00 C ATOM 4 O GLY A 1 -31.832 36.534 -21.009 1.00 0.00 O ATOM 0 H1 GLY A 1 -34.252 35.333 -23.195 1.00 0.00 H new ATOM 0 H2 GLY A 1 -33.039 36.498 -22.969 1.00 0.00 H new ATOM 0 H3 GLY A 1 -32.862 35.312 -24.170 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -33.228 33.800 -22.019 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -31.672 34.213 -22.713 1.00 0.00 H new ATOM 8 N SER A 2 -32.274 34.652 -19.858 1.00 0.00 N ATOM 9 CA SER A 2 -31.942 35.235 -18.563 1.00 0.00 C ATOM 10 C SER A 2 -30.619 34.685 -18.042 1.00 0.00 C ATOM 11 O SER A 2 -30.152 33.636 -18.486 1.00 0.00 O ATOM 12 CB SER A 2 -33.057 34.955 -17.554 1.00 0.00 C ATOM 13 OG SER A 2 -32.716 35.445 -16.268 1.00 0.00 O ATOM 0 H SER A 2 -32.568 33.676 -19.818 1.00 0.00 H new ATOM 0 HA SER A 2 -31.841 36.313 -18.693 1.00 0.00 H new ATOM 0 HB2 SER A 2 -33.982 35.422 -17.891 1.00 0.00 H new ATOM 0 HB3 SER A 2 -33.242 33.882 -17.501 1.00 0.00 H new ATOM 0 HG SER A 2 -33.445 35.255 -15.642 1.00 0.00 H new ATOM 19 N SER A 3 -30.018 35.400 -17.096 1.00 0.00 N ATOM 20 CA SER A 3 -28.746 34.987 -16.516 1.00 0.00 C ATOM 21 C SER A 3 -28.880 34.770 -15.012 1.00 0.00 C ATOM 22 O SER A 3 -29.949 34.971 -14.437 1.00 0.00 O ATOM 23 CB SER A 3 -27.668 36.035 -16.798 1.00 0.00 C ATOM 24 OG SER A 3 -27.929 37.237 -16.095 1.00 0.00 O ATOM 0 H SER A 3 -30.392 36.269 -16.715 1.00 0.00 H new ATOM 0 HA SER A 3 -28.454 34.043 -16.977 1.00 0.00 H new ATOM 0 HB2 SER A 3 -26.692 35.645 -16.508 1.00 0.00 H new ATOM 0 HB3 SER A 3 -27.625 36.238 -17.868 1.00 0.00 H new ATOM 0 HG SER A 3 -27.225 37.890 -16.291 1.00 0.00 H new ATOM 30 N GLY A 4 -27.785 34.359 -14.380 1.00 0.00 N ATOM 31 CA GLY A 4 -27.800 34.121 -12.948 1.00 0.00 C ATOM 32 C GLY A 4 -26.627 34.770 -12.240 1.00 0.00 C ATOM 33 O GLY A 4 -25.996 35.681 -12.777 1.00 0.00 O ATOM 0 H GLY A 4 -26.888 34.187 -14.834 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -28.730 34.504 -12.529 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -27.784 33.047 -12.761 1.00 0.00 H new ATOM 37 N SER A 5 -26.335 34.302 -11.031 1.00 0.00 N ATOM 38 CA SER A 5 -25.233 34.847 -10.246 1.00 0.00 C ATOM 39 C SER A 5 -24.650 33.786 -9.318 1.00 0.00 C ATOM 40 O SER A 5 -25.142 32.659 -9.259 1.00 0.00 O ATOM 41 CB SER A 5 -25.708 36.050 -9.429 1.00 0.00 C ATOM 42 OG SER A 5 -26.575 35.647 -8.384 1.00 0.00 O ATOM 0 H SER A 5 -26.846 33.547 -10.574 1.00 0.00 H new ATOM 0 HA SER A 5 -24.453 35.170 -10.935 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.847 36.572 -9.011 1.00 0.00 H new ATOM 0 HB3 SER A 5 -26.223 36.756 -10.081 1.00 0.00 H new ATOM 0 HG SER A 5 -26.863 36.434 -7.876 1.00 0.00 H new ATOM 48 N SER A 6 -23.598 34.155 -8.595 1.00 0.00 N ATOM 49 CA SER A 6 -22.944 33.234 -7.672 1.00 0.00 C ATOM 50 C SER A 6 -23.329 33.547 -6.229 1.00 0.00 C ATOM 51 O SER A 6 -24.036 34.517 -5.960 1.00 0.00 O ATOM 52 CB SER A 6 -21.425 33.310 -7.834 1.00 0.00 C ATOM 53 OG SER A 6 -20.968 34.648 -7.738 1.00 0.00 O ATOM 0 H SER A 6 -23.180 35.085 -8.630 1.00 0.00 H new ATOM 0 HA SER A 6 -23.278 32.223 -7.908 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.944 32.702 -7.068 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.138 32.893 -8.799 1.00 0.00 H new ATOM 0 HG SER A 6 -19.994 34.669 -7.843 1.00 0.00 H new ATOM 59 N GLY A 7 -22.859 32.715 -5.304 1.00 0.00 N ATOM 60 CA GLY A 7 -23.164 32.918 -3.900 1.00 0.00 C ATOM 61 C GLY A 7 -22.004 32.553 -2.996 1.00 0.00 C ATOM 62 O GLY A 7 -20.843 32.746 -3.357 1.00 0.00 O ATOM 0 H GLY A 7 -22.273 31.904 -5.502 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.433 33.962 -3.737 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -24.034 32.319 -3.630 1.00 0.00 H new ATOM 66 N TRP A 8 -22.317 32.026 -1.818 1.00 0.00 N ATOM 67 CA TRP A 8 -21.291 31.635 -0.858 1.00 0.00 C ATOM 68 C TRP A 8 -20.932 30.162 -1.015 1.00 0.00 C ATOM 69 O TRP A 8 -21.552 29.443 -1.799 1.00 0.00 O ATOM 70 CB TRP A 8 -21.768 31.908 0.569 1.00 0.00 C ATOM 71 CG TRP A 8 -23.095 31.286 0.881 1.00 0.00 C ATOM 72 CD1 TRP A 8 -24.317 31.691 0.426 1.00 0.00 C ATOM 73 CD2 TRP A 8 -23.333 30.148 1.717 1.00 0.00 C ATOM 74 NE1 TRP A 8 -25.301 30.874 0.930 1.00 0.00 N ATOM 75 CE2 TRP A 8 -24.723 29.919 1.723 1.00 0.00 C ATOM 76 CE3 TRP A 8 -22.507 29.299 2.459 1.00 0.00 C ATOM 77 CZ2 TRP A 8 -25.302 28.878 2.444 1.00 0.00 C ATOM 78 CZ3 TRP A 8 -23.084 28.267 3.174 1.00 0.00 C ATOM 79 CH2 TRP A 8 -24.470 28.063 3.162 1.00 0.00 C ATOM 0 H TRP A 8 -23.273 31.859 -1.504 1.00 0.00 H new ATOM 0 HA TRP A 8 -20.399 32.230 -1.055 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -21.024 31.531 1.271 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -21.835 32.985 0.722 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -24.486 32.530 -0.233 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -26.300 30.965 0.743 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -21.437 29.447 2.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -26.370 28.719 2.437 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -22.455 27.606 3.752 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -24.890 27.246 3.731 1.00 0.00 H new ATOM 90 N ILE A 9 -19.929 29.718 -0.265 1.00 0.00 N ATOM 91 CA ILE A 9 -19.490 28.330 -0.321 1.00 0.00 C ATOM 92 C ILE A 9 -19.587 27.667 1.049 1.00 0.00 C ATOM 93 O ILE A 9 -19.523 28.336 2.081 1.00 0.00 O ATOM 94 CB ILE A 9 -18.041 28.217 -0.831 1.00 0.00 C ATOM 95 CG1 ILE A 9 -17.875 28.996 -2.138 1.00 0.00 C ATOM 96 CG2 ILE A 9 -17.660 26.758 -1.027 1.00 0.00 C ATOM 97 CD1 ILE A 9 -18.427 28.273 -3.347 1.00 0.00 C ATOM 0 H ILE A 9 -19.405 30.300 0.389 1.00 0.00 H new ATOM 0 HA ILE A 9 -20.153 27.818 -1.018 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.375 28.649 -0.084 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -18.374 29.960 -2.042 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -16.816 29.199 -2.298 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -16.633 26.695 -1.388 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -17.744 26.229 -0.078 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.329 26.302 -1.757 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -18.275 28.884 -4.237 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -17.911 27.320 -3.468 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -19.493 28.093 -3.208 1.00 0.00 H new ATOM 109 N LEU A 10 -19.741 26.347 1.052 1.00 0.00 N ATOM 110 CA LEU A 10 -19.845 25.592 2.295 1.00 0.00 C ATOM 111 C LEU A 10 -18.696 24.597 2.426 1.00 0.00 C ATOM 112 O LEU A 10 -17.844 24.499 1.544 1.00 0.00 O ATOM 113 CB LEU A 10 -21.183 24.854 2.356 1.00 0.00 C ATOM 114 CG LEU A 10 -21.532 23.995 1.140 1.00 0.00 C ATOM 115 CD1 LEU A 10 -20.824 22.651 1.216 1.00 0.00 C ATOM 116 CD2 LEU A 10 -23.038 23.802 1.038 1.00 0.00 C ATOM 0 H LEU A 10 -19.797 25.778 0.207 1.00 0.00 H new ATOM 0 HA LEU A 10 -19.787 26.296 3.125 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -21.183 24.215 3.239 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -21.975 25.590 2.495 1.00 0.00 H new ATOM 0 HG LEU A 10 -21.191 24.512 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -21.084 22.053 0.343 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -19.746 22.809 1.240 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -21.134 22.127 2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -23.268 23.188 0.167 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -23.403 23.306 1.938 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -23.523 24.773 0.936 1.00 0.00 H new ATOM 128 N ALA A 11 -18.682 23.860 3.532 1.00 0.00 N ATOM 129 CA ALA A 11 -17.641 22.869 3.776 1.00 0.00 C ATOM 130 C ALA A 11 -18.241 21.539 4.219 1.00 0.00 C ATOM 131 O ALA A 11 -19.461 21.398 4.312 1.00 0.00 O ATOM 132 CB ALA A 11 -16.659 23.381 4.819 1.00 0.00 C ATOM 0 H ALA A 11 -19.380 23.930 4.273 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.107 22.702 2.841 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -15.887 22.631 4.991 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -16.197 24.302 4.463 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -17.188 23.578 5.751 1.00 0.00 H new ATOM 138 N SER A 12 -17.377 20.566 4.490 1.00 0.00 N ATOM 139 CA SER A 12 -17.823 19.246 4.919 1.00 0.00 C ATOM 140 C SER A 12 -17.215 18.879 6.270 1.00 0.00 C ATOM 141 O SER A 12 -16.208 19.452 6.687 1.00 0.00 O ATOM 142 CB SER A 12 -17.447 18.193 3.875 1.00 0.00 C ATOM 143 OG SER A 12 -18.274 18.293 2.729 1.00 0.00 O ATOM 0 H SER A 12 -16.364 20.667 4.420 1.00 0.00 H new ATOM 0 HA SER A 12 -18.908 19.273 5.024 1.00 0.00 H new ATOM 0 HB2 SER A 12 -16.403 18.319 3.586 1.00 0.00 H new ATOM 0 HB3 SER A 12 -17.540 17.197 4.309 1.00 0.00 H new ATOM 0 HG SER A 12 -18.012 17.610 2.076 1.00 0.00 H new ATOM 149 N THR A 13 -17.835 17.920 6.950 1.00 0.00 N ATOM 150 CA THR A 13 -17.358 17.477 8.254 1.00 0.00 C ATOM 151 C THR A 13 -17.056 15.982 8.250 1.00 0.00 C ATOM 152 O THR A 13 -17.967 15.154 8.219 1.00 0.00 O ATOM 153 CB THR A 13 -18.385 17.779 9.361 1.00 0.00 C ATOM 154 OG1 THR A 13 -17.874 17.360 10.631 1.00 0.00 O ATOM 155 CG2 THR A 13 -19.704 17.074 9.082 1.00 0.00 C ATOM 0 H THR A 13 -18.669 17.435 6.619 1.00 0.00 H new ATOM 0 HA THR A 13 -16.441 18.030 8.459 1.00 0.00 H new ATOM 0 HB THR A 13 -18.562 18.854 9.378 1.00 0.00 H new ATOM 0 HG1 THR A 13 -18.532 17.557 11.330 1.00 0.00 H new ATOM 0 HG21 THR A 13 -20.414 17.302 9.877 1.00 0.00 H new ATOM 0 HG22 THR A 13 -20.105 17.417 8.128 1.00 0.00 H new ATOM 0 HG23 THR A 13 -19.539 15.997 9.040 1.00 0.00 H new ATOM 163 N THR A 14 -15.771 15.642 8.281 1.00 0.00 N ATOM 164 CA THR A 14 -15.350 14.247 8.281 1.00 0.00 C ATOM 165 C THR A 14 -14.874 13.816 9.664 1.00 0.00 C ATOM 166 O THR A 14 -14.051 14.488 10.284 1.00 0.00 O ATOM 167 CB THR A 14 -14.220 14.002 7.263 1.00 0.00 C ATOM 168 OG1 THR A 14 -14.683 14.292 5.939 1.00 0.00 O ATOM 169 CG2 THR A 14 -13.733 12.562 7.331 1.00 0.00 C ATOM 0 H THR A 14 -15.004 16.314 8.306 1.00 0.00 H new ATOM 0 HA THR A 14 -16.220 13.654 7.998 1.00 0.00 H new ATOM 0 HB THR A 14 -13.389 14.662 7.510 1.00 0.00 H new ATOM 0 HG1 THR A 14 -13.959 14.136 5.298 1.00 0.00 H new ATOM 0 HG21 THR A 14 -12.935 12.413 6.603 1.00 0.00 H new ATOM 0 HG22 THR A 14 -13.355 12.353 8.332 1.00 0.00 H new ATOM 0 HG23 THR A 14 -14.559 11.887 7.107 1.00 0.00 H new ATOM 177 N GLU A 15 -15.398 12.691 10.141 1.00 0.00 N ATOM 178 CA GLU A 15 -15.025 12.172 11.451 1.00 0.00 C ATOM 179 C GLU A 15 -15.345 10.683 11.557 1.00 0.00 C ATOM 180 O GLU A 15 -16.042 10.125 10.711 1.00 0.00 O ATOM 181 CB GLU A 15 -15.754 12.941 12.555 1.00 0.00 C ATOM 182 CG GLU A 15 -17.267 12.819 12.486 1.00 0.00 C ATOM 183 CD GLU A 15 -17.961 13.493 13.653 1.00 0.00 C ATOM 184 OE1 GLU A 15 -17.801 13.013 14.795 1.00 0.00 O ATOM 185 OE2 GLU A 15 -18.663 14.500 13.425 1.00 0.00 O ATOM 0 H GLU A 15 -16.081 12.123 9.640 1.00 0.00 H new ATOM 0 HA GLU A 15 -13.950 12.305 11.574 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -15.413 12.578 13.525 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -15.480 13.994 12.494 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -17.621 13.260 11.554 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -17.542 11.764 12.465 1.00 0.00 H new ATOM 192 N GLY A 16 -14.829 10.046 12.604 1.00 0.00 N ATOM 193 CA GLY A 16 -15.070 8.629 12.802 1.00 0.00 C ATOM 194 C GLY A 16 -13.989 7.765 12.183 1.00 0.00 C ATOM 195 O GLY A 16 -13.399 6.920 12.855 1.00 0.00 O ATOM 0 H GLY A 16 -14.249 10.486 13.318 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -15.131 8.420 13.870 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -16.035 8.364 12.370 1.00 0.00 H new ATOM 199 N ALA A 17 -13.729 7.976 10.897 1.00 0.00 N ATOM 200 CA ALA A 17 -12.712 7.211 10.187 1.00 0.00 C ATOM 201 C ALA A 17 -11.410 7.997 10.078 1.00 0.00 C ATOM 202 O ALA A 17 -11.355 9.196 10.355 1.00 0.00 O ATOM 203 CB ALA A 17 -13.213 6.822 8.804 1.00 0.00 C ATOM 0 H ALA A 17 -14.209 8.671 10.325 1.00 0.00 H new ATOM 0 HA ALA A 17 -12.512 6.304 10.757 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.443 6.251 8.285 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -14.112 6.214 8.901 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -13.443 7.722 8.234 1.00 0.00 H new ATOM 209 N PRO A 18 -10.334 7.309 9.666 1.00 0.00 N ATOM 210 CA PRO A 18 -9.013 7.924 9.512 1.00 0.00 C ATOM 211 C PRO A 18 -8.960 8.898 8.340 1.00 0.00 C ATOM 212 O PRO A 18 -8.607 8.521 7.222 1.00 0.00 O ATOM 213 CB PRO A 18 -8.093 6.728 9.254 1.00 0.00 C ATOM 214 CG PRO A 18 -8.983 5.684 8.673 1.00 0.00 C ATOM 215 CD PRO A 18 -10.327 5.878 9.319 1.00 0.00 C ATOM 0 HA PRO A 18 -8.734 8.514 10.385 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.288 6.989 8.567 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -7.626 6.382 10.176 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -9.052 5.789 7.590 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.595 4.685 8.873 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -11.140 5.625 8.639 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -10.443 5.250 10.202 1.00 0.00 H new ATOM 223 N SER A 19 -9.312 10.152 8.602 1.00 0.00 N ATOM 224 CA SER A 19 -9.308 11.180 7.568 1.00 0.00 C ATOM 225 C SER A 19 -7.897 11.715 7.339 1.00 0.00 C ATOM 226 O SER A 19 -7.694 12.920 7.190 1.00 0.00 O ATOM 227 CB SER A 19 -10.243 12.327 7.955 1.00 0.00 C ATOM 228 OG SER A 19 -9.564 13.299 8.731 1.00 0.00 O ATOM 0 H SER A 19 -9.604 10.481 9.522 1.00 0.00 H new ATOM 0 HA SER A 19 -9.662 10.729 6.641 1.00 0.00 H new ATOM 0 HB2 SER A 19 -10.645 12.792 7.055 1.00 0.00 H new ATOM 0 HB3 SER A 19 -11.091 11.935 8.517 1.00 0.00 H new ATOM 0 HG SER A 19 -8.878 13.734 8.183 1.00 0.00 H new ATOM 234 N VAL A 20 -6.925 10.809 7.312 1.00 0.00 N ATOM 235 CA VAL A 20 -5.533 11.187 7.101 1.00 0.00 C ATOM 236 C VAL A 20 -4.695 9.986 6.678 1.00 0.00 C ATOM 237 O VAL A 20 -5.022 8.844 7.000 1.00 0.00 O ATOM 238 CB VAL A 20 -4.920 11.805 8.371 1.00 0.00 C ATOM 239 CG1 VAL A 20 -5.506 13.185 8.630 1.00 0.00 C ATOM 240 CG2 VAL A 20 -5.139 10.891 9.567 1.00 0.00 C ATOM 0 H VAL A 20 -7.076 9.808 7.434 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.525 11.931 6.304 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.846 11.915 8.219 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -5.061 13.606 9.532 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.293 13.836 7.782 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.585 13.103 8.762 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -4.699 11.343 10.456 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.208 10.747 9.724 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.667 9.927 9.379 1.00 0.00 H new ATOM 250 N ALA A 21 -3.611 10.251 5.956 1.00 0.00 N ATOM 251 CA ALA A 21 -2.724 9.192 5.491 1.00 0.00 C ATOM 252 C ALA A 21 -1.483 9.090 6.371 1.00 0.00 C ATOM 253 O ALA A 21 -1.199 9.965 7.189 1.00 0.00 O ATOM 254 CB ALA A 21 -2.328 9.434 4.042 1.00 0.00 C ATOM 0 H ALA A 21 -3.326 11.191 5.680 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.262 8.246 5.556 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.666 8.636 3.708 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -3.222 9.449 3.418 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.813 10.391 3.961 1.00 0.00 H new ATOM 260 N PRO A 22 -0.725 7.996 6.202 1.00 0.00 N ATOM 261 CA PRO A 22 0.498 7.754 6.973 1.00 0.00 C ATOM 262 C PRO A 22 1.622 8.712 6.592 1.00 0.00 C ATOM 263 O PRO A 22 1.637 9.261 5.490 1.00 0.00 O ATOM 264 CB PRO A 22 0.872 6.317 6.602 1.00 0.00 C ATOM 265 CG PRO A 22 0.262 6.100 5.260 1.00 0.00 C ATOM 266 CD PRO A 22 -1.004 6.912 5.245 1.00 0.00 C ATOM 0 HA PRO A 22 0.344 7.907 8.041 1.00 0.00 H new ATOM 0 HB2 PRO A 22 1.954 6.185 6.571 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.485 5.606 7.332 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.939 6.418 4.467 1.00 0.00 H new ATOM 0 HG3 PRO A 22 0.050 5.044 5.094 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -1.221 7.300 4.250 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.866 6.318 5.550 1.00 0.00 H new ATOM 274 N LEU A 23 2.562 8.908 7.510 1.00 0.00 N ATOM 275 CA LEU A 23 3.691 9.800 7.271 1.00 0.00 C ATOM 276 C LEU A 23 4.962 9.005 6.985 1.00 0.00 C ATOM 277 O LEU A 23 4.930 7.779 6.888 1.00 0.00 O ATOM 278 CB LEU A 23 3.909 10.715 8.477 1.00 0.00 C ATOM 279 CG LEU A 23 2.658 11.078 9.278 1.00 0.00 C ATOM 280 CD1 LEU A 23 2.433 10.077 10.400 1.00 0.00 C ATOM 281 CD2 LEU A 23 2.773 12.490 9.835 1.00 0.00 C ATOM 0 H LEU A 23 2.565 8.461 8.427 1.00 0.00 H new ATOM 0 HA LEU A 23 3.461 10.410 6.397 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.620 10.234 9.149 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.374 11.637 8.129 1.00 0.00 H new ATOM 0 HG LEU A 23 1.798 11.041 8.609 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.538 10.352 10.959 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.305 9.080 9.978 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.294 10.080 11.069 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.874 12.732 10.402 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.643 12.553 10.489 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.885 13.197 9.013 1.00 0.00 H new ATOM 293 N ASN A 24 6.079 9.712 6.855 1.00 0.00 N ATOM 294 CA ASN A 24 7.361 9.072 6.583 1.00 0.00 C ATOM 295 C ASN A 24 7.215 7.996 5.511 1.00 0.00 C ATOM 296 O ASN A 24 7.933 6.996 5.519 1.00 0.00 O ATOM 297 CB ASN A 24 7.931 8.459 7.863 1.00 0.00 C ATOM 298 CG ASN A 24 8.820 9.426 8.622 1.00 0.00 C ATOM 299 OD1 ASN A 24 9.994 9.146 8.865 1.00 0.00 O ATOM 300 ND2 ASN A 24 8.262 10.570 9.000 1.00 0.00 N ATOM 0 H ASN A 24 6.123 10.728 6.934 1.00 0.00 H new ATOM 0 HA ASN A 24 8.049 9.834 6.216 1.00 0.00 H new ATOM 0 HB2 ASN A 24 7.111 8.142 8.507 1.00 0.00 H new ATOM 0 HB3 ASN A 24 8.502 7.566 7.611 1.00 0.00 H new ATOM 0 HD21 ASN A 24 8.810 11.260 9.514 1.00 0.00 H new ATOM 0 HD22 ASN A 24 7.285 10.759 8.776 1.00 0.00 H new ATOM 307 N VAL A 25 6.282 8.209 4.590 1.00 0.00 N ATOM 308 CA VAL A 25 6.042 7.259 3.510 1.00 0.00 C ATOM 309 C VAL A 25 7.148 7.327 2.462 1.00 0.00 C ATOM 310 O VAL A 25 7.232 8.285 1.693 1.00 0.00 O ATOM 311 CB VAL A 25 4.686 7.516 2.827 1.00 0.00 C ATOM 312 CG1 VAL A 25 4.474 6.542 1.678 1.00 0.00 C ATOM 313 CG2 VAL A 25 3.553 7.416 3.837 1.00 0.00 C ATOM 0 H VAL A 25 5.679 9.032 4.570 1.00 0.00 H new ATOM 0 HA VAL A 25 6.031 6.266 3.959 1.00 0.00 H new ATOM 0 HB VAL A 25 4.690 8.527 2.419 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.511 6.739 1.207 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.269 6.667 0.943 1.00 0.00 H new ATOM 0 HG13 VAL A 25 4.490 5.521 2.059 1.00 0.00 H new ATOM 0 HG21 VAL A 25 2.602 7.600 3.337 1.00 0.00 H new ATOM 0 HG22 VAL A 25 3.544 6.419 4.276 1.00 0.00 H new ATOM 0 HG23 VAL A 25 3.699 8.157 4.623 1.00 0.00 H new ATOM 323 N THR A 26 7.995 6.303 2.437 1.00 0.00 N ATOM 324 CA THR A 26 9.097 6.247 1.485 1.00 0.00 C ATOM 325 C THR A 26 9.105 4.922 0.731 1.00 0.00 C ATOM 326 O THR A 26 8.410 3.977 1.108 1.00 0.00 O ATOM 327 CB THR A 26 10.456 6.433 2.185 1.00 0.00 C ATOM 328 OG1 THR A 26 10.567 5.527 3.288 1.00 0.00 O ATOM 329 CG2 THR A 26 10.618 7.863 2.679 1.00 0.00 C ATOM 0 H THR A 26 7.939 5.501 3.065 1.00 0.00 H new ATOM 0 HA THR A 26 8.946 7.064 0.779 1.00 0.00 H new ATOM 0 HB THR A 26 11.244 6.223 1.462 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.435 5.651 3.727 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.585 7.971 3.170 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.562 8.549 1.833 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.823 8.095 3.388 1.00 0.00 H new ATOM 337 N VAL A 27 9.895 4.858 -0.336 1.00 0.00 N ATOM 338 CA VAL A 27 9.994 3.647 -1.143 1.00 0.00 C ATOM 339 C VAL A 27 11.442 3.354 -1.518 1.00 0.00 C ATOM 340 O VAL A 27 12.066 4.108 -2.265 1.00 0.00 O ATOM 341 CB VAL A 27 9.154 3.758 -2.429 1.00 0.00 C ATOM 342 CG1 VAL A 27 9.347 2.528 -3.301 1.00 0.00 C ATOM 343 CG2 VAL A 27 7.684 3.956 -2.089 1.00 0.00 C ATOM 0 H VAL A 27 10.476 5.630 -0.662 1.00 0.00 H new ATOM 0 HA VAL A 27 9.606 2.829 -0.535 1.00 0.00 H new ATOM 0 HB VAL A 27 9.494 4.628 -2.991 1.00 0.00 H new ATOM 0 HG11 VAL A 27 8.746 2.625 -4.205 1.00 0.00 H new ATOM 0 HG12 VAL A 27 10.399 2.436 -3.573 1.00 0.00 H new ATOM 0 HG13 VAL A 27 9.035 1.640 -2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 27 7.105 4.033 -3.009 1.00 0.00 H new ATOM 0 HG22 VAL A 27 7.328 3.107 -1.506 1.00 0.00 H new ATOM 0 HG23 VAL A 27 7.565 4.871 -1.508 1.00 0.00 H new ATOM 353 N PHE A 28 11.972 2.252 -0.996 1.00 0.00 N ATOM 354 CA PHE A 28 13.348 1.859 -1.276 1.00 0.00 C ATOM 355 C PHE A 28 13.392 0.718 -2.289 1.00 0.00 C ATOM 356 O PHE A 28 12.643 -0.254 -2.179 1.00 0.00 O ATOM 357 CB PHE A 28 14.053 1.438 0.015 1.00 0.00 C ATOM 358 CG PHE A 28 14.740 2.572 0.720 1.00 0.00 C ATOM 359 CD1 PHE A 28 14.004 3.592 1.301 1.00 0.00 C ATOM 360 CD2 PHE A 28 16.123 2.619 0.800 1.00 0.00 C ATOM 361 CE1 PHE A 28 14.633 4.637 1.951 1.00 0.00 C ATOM 362 CE2 PHE A 28 16.758 3.661 1.449 1.00 0.00 C ATOM 363 CZ PHE A 28 16.012 4.672 2.024 1.00 0.00 C ATOM 0 H PHE A 28 11.469 1.616 -0.377 1.00 0.00 H new ATOM 0 HA PHE A 28 13.866 2.719 -1.701 1.00 0.00 H new ATOM 0 HB2 PHE A 28 13.323 0.991 0.689 1.00 0.00 H new ATOM 0 HB3 PHE A 28 14.787 0.666 -0.216 1.00 0.00 H new ATOM 0 HD1 PHE A 28 12.926 3.570 1.245 1.00 0.00 H new ATOM 0 HD2 PHE A 28 16.711 1.833 0.350 1.00 0.00 H new ATOM 0 HE1 PHE A 28 14.047 5.425 2.401 1.00 0.00 H new ATOM 0 HE2 PHE A 28 17.836 3.685 1.507 1.00 0.00 H new ATOM 0 HZ PHE A 28 16.506 5.488 2.530 1.00 0.00 H new ATOM 373 N LEU A 29 14.273 0.844 -3.274 1.00 0.00 N ATOM 374 CA LEU A 29 14.416 -0.176 -4.308 1.00 0.00 C ATOM 375 C LEU A 29 15.831 -0.745 -4.320 1.00 0.00 C ATOM 376 O LEU A 29 16.810 0.000 -4.316 1.00 0.00 O ATOM 377 CB LEU A 29 14.078 0.410 -5.680 1.00 0.00 C ATOM 378 CG LEU A 29 14.556 -0.394 -6.889 1.00 0.00 C ATOM 379 CD1 LEU A 29 13.574 -1.510 -7.211 1.00 0.00 C ATOM 380 CD2 LEU A 29 14.746 0.516 -8.094 1.00 0.00 C ATOM 0 H LEU A 29 14.900 1.642 -3.379 1.00 0.00 H new ATOM 0 HA LEU A 29 13.721 -0.985 -4.084 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.996 0.522 -5.748 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.507 1.410 -5.741 1.00 0.00 H new ATOM 0 HG LEU A 29 15.518 -0.844 -6.644 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.931 -2.071 -8.074 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.489 -2.178 -6.354 1.00 0.00 H new ATOM 0 HD13 LEU A 29 12.597 -1.082 -7.436 1.00 0.00 H new ATOM 0 HD21 LEU A 29 15.087 -0.074 -8.945 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.799 0.996 -8.341 1.00 0.00 H new ATOM 0 HD23 LEU A 29 15.489 1.279 -7.860 1.00 0.00 H new ATOM 392 N ASN A 30 15.931 -2.070 -4.336 1.00 0.00 N ATOM 393 CA ASN A 30 17.226 -2.739 -4.350 1.00 0.00 C ATOM 394 C ASN A 30 17.488 -3.388 -5.706 1.00 0.00 C ATOM 395 O ASN A 30 16.711 -4.225 -6.165 1.00 0.00 O ATOM 396 CB ASN A 30 17.290 -3.796 -3.246 1.00 0.00 C ATOM 397 CG ASN A 30 17.354 -3.181 -1.861 1.00 0.00 C ATOM 398 OD1 ASN A 30 18.024 -2.171 -1.648 1.00 0.00 O ATOM 399 ND2 ASN A 30 16.654 -3.791 -0.911 1.00 0.00 N ATOM 0 H ASN A 30 15.130 -2.702 -4.340 1.00 0.00 H new ATOM 0 HA ASN A 30 17.996 -1.989 -4.170 1.00 0.00 H new ATOM 0 HB2 ASN A 30 16.415 -4.442 -3.314 1.00 0.00 H new ATOM 0 HB3 ASN A 30 18.165 -4.427 -3.401 1.00 0.00 H new ATOM 0 HD21 ASN A 30 16.658 -3.424 0.041 1.00 0.00 H new ATOM 0 HD22 ASN A 30 16.112 -4.626 -1.133 1.00 0.00 H new ATOM 406 N GLU A 31 18.588 -2.996 -6.341 1.00 0.00 N ATOM 407 CA GLU A 31 18.952 -3.540 -7.644 1.00 0.00 C ATOM 408 C GLU A 31 19.564 -4.931 -7.502 1.00 0.00 C ATOM 409 O GLU A 31 19.398 -5.786 -8.371 1.00 0.00 O ATOM 410 CB GLU A 31 19.937 -2.608 -8.354 1.00 0.00 C ATOM 411 CG GLU A 31 19.304 -1.319 -8.850 1.00 0.00 C ATOM 412 CD GLU A 31 18.932 -0.379 -7.720 1.00 0.00 C ATOM 413 OE1 GLU A 31 19.791 0.434 -7.318 1.00 0.00 O ATOM 414 OE2 GLU A 31 17.783 -0.456 -7.237 1.00 0.00 O ATOM 0 H GLU A 31 19.242 -2.304 -5.975 1.00 0.00 H new ATOM 0 HA GLU A 31 18.044 -3.621 -8.241 1.00 0.00 H new ATOM 0 HB2 GLU A 31 20.751 -2.364 -7.671 1.00 0.00 H new ATOM 0 HB3 GLU A 31 20.378 -3.135 -9.200 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.996 -0.815 -9.524 1.00 0.00 H new ATOM 0 HG3 GLU A 31 18.411 -1.556 -9.429 1.00 0.00 H new ATOM 421 N SER A 32 20.274 -5.148 -6.399 1.00 0.00 N ATOM 422 CA SER A 32 20.915 -6.433 -6.144 1.00 0.00 C ATOM 423 C SER A 32 19.877 -7.503 -5.818 1.00 0.00 C ATOM 424 O SER A 32 20.056 -8.676 -6.145 1.00 0.00 O ATOM 425 CB SER A 32 21.914 -6.308 -4.992 1.00 0.00 C ATOM 426 OG SER A 32 22.929 -7.292 -5.088 1.00 0.00 O ATOM 0 H SER A 32 20.420 -4.451 -5.668 1.00 0.00 H new ATOM 0 HA SER A 32 21.447 -6.731 -7.047 1.00 0.00 H new ATOM 0 HB2 SER A 32 22.364 -5.315 -5.003 1.00 0.00 H new ATOM 0 HB3 SER A 32 21.392 -6.411 -4.041 1.00 0.00 H new ATOM 0 HG SER A 32 23.555 -7.190 -4.341 1.00 0.00 H new ATOM 432 N SER A 33 18.792 -7.089 -5.172 1.00 0.00 N ATOM 433 CA SER A 33 17.726 -8.011 -4.798 1.00 0.00 C ATOM 434 C SER A 33 16.385 -7.547 -5.358 1.00 0.00 C ATOM 435 O SER A 33 15.998 -6.390 -5.194 1.00 0.00 O ATOM 436 CB SER A 33 17.641 -8.135 -3.276 1.00 0.00 C ATOM 437 OG SER A 33 17.520 -6.862 -2.666 1.00 0.00 O ATOM 0 H SER A 33 18.628 -6.121 -4.897 1.00 0.00 H new ATOM 0 HA SER A 33 17.958 -8.988 -5.222 1.00 0.00 H new ATOM 0 HB2 SER A 33 16.785 -8.754 -3.006 1.00 0.00 H new ATOM 0 HB3 SER A 33 18.531 -8.639 -2.899 1.00 0.00 H new ATOM 0 HG SER A 33 16.628 -6.498 -2.843 1.00 0.00 H new ATOM 443 N ASP A 34 15.680 -8.458 -6.020 1.00 0.00 N ATOM 444 CA ASP A 34 14.382 -8.144 -6.604 1.00 0.00 C ATOM 445 C ASP A 34 13.328 -7.956 -5.517 1.00 0.00 C ATOM 446 O ASP A 34 12.429 -8.782 -5.360 1.00 0.00 O ATOM 447 CB ASP A 34 13.949 -9.253 -7.564 1.00 0.00 C ATOM 448 CG ASP A 34 14.808 -9.306 -8.812 1.00 0.00 C ATOM 449 OD1 ASP A 34 15.987 -8.900 -8.739 1.00 0.00 O ATOM 450 OD2 ASP A 34 14.302 -9.754 -9.862 1.00 0.00 O ATOM 0 H ASP A 34 15.986 -9.420 -6.165 1.00 0.00 H new ATOM 0 HA ASP A 34 14.477 -7.210 -7.158 1.00 0.00 H new ATOM 0 HB2 ASP A 34 13.999 -10.214 -7.051 1.00 0.00 H new ATOM 0 HB3 ASP A 34 12.908 -9.097 -7.849 1.00 0.00 H new ATOM 455 N ASN A 35 13.447 -6.865 -4.767 1.00 0.00 N ATOM 456 CA ASN A 35 12.506 -6.570 -3.693 1.00 0.00 C ATOM 457 C ASN A 35 12.394 -5.065 -3.465 1.00 0.00 C ATOM 458 O ASN A 35 13.347 -4.320 -3.695 1.00 0.00 O ATOM 459 CB ASN A 35 12.942 -7.261 -2.399 1.00 0.00 C ATOM 460 CG ASN A 35 14.401 -7.008 -2.072 1.00 0.00 C ATOM 461 OD1 ASN A 35 15.123 -6.383 -2.849 1.00 0.00 O ATOM 462 ND2 ASN A 35 14.842 -7.495 -0.918 1.00 0.00 N ATOM 0 H ASN A 35 14.185 -6.171 -4.883 1.00 0.00 H new ATOM 0 HA ASN A 35 11.528 -6.949 -3.988 1.00 0.00 H new ATOM 0 HB2 ASN A 35 12.321 -6.909 -1.575 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.773 -8.334 -2.489 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.815 -7.357 -0.645 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.208 -8.007 -0.305 1.00 0.00 H new ATOM 469 N VAL A 36 11.225 -4.626 -3.012 1.00 0.00 N ATOM 470 CA VAL A 36 10.989 -3.211 -2.752 1.00 0.00 C ATOM 471 C VAL A 36 10.574 -2.980 -1.303 1.00 0.00 C ATOM 472 O VAL A 36 9.539 -3.474 -0.856 1.00 0.00 O ATOM 473 CB VAL A 36 9.900 -2.643 -3.682 1.00 0.00 C ATOM 474 CG1 VAL A 36 9.684 -1.162 -3.410 1.00 0.00 C ATOM 475 CG2 VAL A 36 10.270 -2.877 -5.139 1.00 0.00 C ATOM 0 H VAL A 36 10.426 -5.230 -2.817 1.00 0.00 H new ATOM 0 HA VAL A 36 11.928 -2.693 -2.945 1.00 0.00 H new ATOM 0 HB VAL A 36 8.965 -3.165 -3.479 1.00 0.00 H new ATOM 0 HG11 VAL A 36 8.911 -0.779 -4.076 1.00 0.00 H new ATOM 0 HG12 VAL A 36 9.372 -1.024 -2.375 1.00 0.00 H new ATOM 0 HG13 VAL A 36 10.614 -0.621 -3.584 1.00 0.00 H new ATOM 0 HG21 VAL A 36 9.490 -2.470 -5.782 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.216 -2.382 -5.358 1.00 0.00 H new ATOM 0 HG23 VAL A 36 10.369 -3.947 -5.322 1.00 0.00 H new ATOM 485 N ASP A 37 11.390 -2.227 -0.573 1.00 0.00 N ATOM 486 CA ASP A 37 11.108 -1.929 0.827 1.00 0.00 C ATOM 487 C ASP A 37 10.228 -0.689 0.951 1.00 0.00 C ATOM 488 O ASP A 37 10.234 0.178 0.077 1.00 0.00 O ATOM 489 CB ASP A 37 12.412 -1.724 1.600 1.00 0.00 C ATOM 490 CG ASP A 37 12.289 -2.123 3.057 1.00 0.00 C ATOM 491 OD1 ASP A 37 11.367 -2.899 3.385 1.00 0.00 O ATOM 492 OD2 ASP A 37 13.116 -1.660 3.870 1.00 0.00 O ATOM 0 H ASP A 37 12.252 -1.812 -0.927 1.00 0.00 H new ATOM 0 HA ASP A 37 10.572 -2.777 1.253 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.204 -2.308 1.132 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.708 -0.677 1.537 1.00 0.00 H new ATOM 497 N ILE A 38 9.473 -0.613 2.042 1.00 0.00 N ATOM 498 CA ILE A 38 8.588 0.521 2.280 1.00 0.00 C ATOM 499 C ILE A 38 8.533 0.873 3.763 1.00 0.00 C ATOM 500 O ILE A 38 8.323 0.004 4.610 1.00 0.00 O ATOM 501 CB ILE A 38 7.160 0.236 1.779 1.00 0.00 C ATOM 502 CG1 ILE A 38 7.197 -0.298 0.345 1.00 0.00 C ATOM 503 CG2 ILE A 38 6.309 1.494 1.859 1.00 0.00 C ATOM 504 CD1 ILE A 38 7.321 -1.804 0.264 1.00 0.00 C ATOM 0 H ILE A 38 9.456 -1.323 2.775 1.00 0.00 H new ATOM 0 HA ILE A 38 8.998 1.364 1.723 1.00 0.00 H new ATOM 0 HB ILE A 38 6.711 -0.524 2.419 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.290 0.012 -0.173 1.00 0.00 H new ATOM 0 HG13 ILE A 38 8.036 0.156 -0.182 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.303 1.276 1.501 1.00 0.00 H new ATOM 0 HG22 ILE A 38 6.261 1.835 2.893 1.00 0.00 H new ATOM 0 HG23 ILE A 38 6.753 2.274 1.240 1.00 0.00 H new ATOM 0 HD11 ILE A 38 7.341 -2.112 -0.781 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.242 -2.120 0.753 1.00 0.00 H new ATOM 0 HD13 ILE A 38 6.469 -2.267 0.762 1.00 0.00 H new ATOM 516 N ARG A 39 8.721 2.152 4.069 1.00 0.00 N ATOM 517 CA ARG A 39 8.692 2.619 5.450 1.00 0.00 C ATOM 518 C ARG A 39 7.695 3.762 5.616 1.00 0.00 C ATOM 519 O ARG A 39 7.683 4.708 4.829 1.00 0.00 O ATOM 520 CB ARG A 39 10.086 3.077 5.885 1.00 0.00 C ATOM 521 CG ARG A 39 10.213 3.302 7.383 1.00 0.00 C ATOM 522 CD ARG A 39 9.951 2.023 8.162 1.00 0.00 C ATOM 523 NE ARG A 39 10.693 1.987 9.420 1.00 0.00 N ATOM 524 CZ ARG A 39 12.010 1.825 9.492 1.00 0.00 C ATOM 525 NH1 ARG A 39 12.726 1.686 8.385 1.00 0.00 N ATOM 526 NH2 ARG A 39 12.613 1.803 10.674 1.00 0.00 N ATOM 0 H ARG A 39 8.895 2.883 3.380 1.00 0.00 H new ATOM 0 HA ARG A 39 8.376 1.789 6.082 1.00 0.00 H new ATOM 0 HB2 ARG A 39 10.818 2.331 5.575 1.00 0.00 H new ATOM 0 HB3 ARG A 39 10.334 4.002 5.365 1.00 0.00 H new ATOM 0 HG2 ARG A 39 11.212 3.671 7.613 1.00 0.00 H new ATOM 0 HG3 ARG A 39 9.508 4.072 7.698 1.00 0.00 H new ATOM 0 HD2 ARG A 39 8.884 1.936 8.368 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.229 1.164 7.552 1.00 0.00 H new ATOM 0 HE ARG A 39 10.172 2.092 10.290 1.00 0.00 H new ATOM 0 HH11 ARG A 39 12.266 1.703 7.475 1.00 0.00 H new ATOM 0 HH12 ARG A 39 13.737 1.562 8.444 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.066 1.910 11.528 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.624 1.679 10.729 1.00 0.00 H new ATOM 540 N TRP A 40 6.860 3.666 6.645 1.00 0.00 N ATOM 541 CA TRP A 40 5.858 4.691 6.914 1.00 0.00 C ATOM 542 C TRP A 40 5.648 4.867 8.414 1.00 0.00 C ATOM 543 O TRP A 40 6.250 4.159 9.221 1.00 0.00 O ATOM 544 CB TRP A 40 4.534 4.329 6.240 1.00 0.00 C ATOM 545 CG TRP A 40 3.900 3.093 6.802 1.00 0.00 C ATOM 546 CD1 TRP A 40 3.036 3.022 7.858 1.00 0.00 C ATOM 547 CD2 TRP A 40 4.082 1.750 6.340 1.00 0.00 C ATOM 548 NE1 TRP A 40 2.670 1.716 8.079 1.00 0.00 N ATOM 549 CE2 TRP A 40 3.297 0.917 7.161 1.00 0.00 C ATOM 550 CE3 TRP A 40 4.829 1.171 5.311 1.00 0.00 C ATOM 551 CZ2 TRP A 40 3.242 -0.463 6.984 1.00 0.00 C ATOM 552 CZ3 TRP A 40 4.773 -0.199 5.137 1.00 0.00 C ATOM 553 CH2 TRP A 40 3.984 -1.004 5.969 1.00 0.00 C ATOM 0 H TRP A 40 6.857 2.889 7.306 1.00 0.00 H new ATOM 0 HA TRP A 40 6.220 5.634 6.504 1.00 0.00 H new ATOM 0 HB2 TRP A 40 3.841 5.164 6.345 1.00 0.00 H new ATOM 0 HB3 TRP A 40 4.704 4.188 5.173 1.00 0.00 H new ATOM 0 HD1 TRP A 40 2.691 3.868 8.434 1.00 0.00 H new ATOM 0 HE1 TRP A 40 2.034 1.394 8.809 1.00 0.00 H new ATOM 0 HE3 TRP A 40 5.439 1.783 4.663 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 2.635 -1.085 7.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 5.348 -0.657 4.346 1.00 0.00 H new ATOM 0 HH2 TRP A 40 3.961 -2.071 5.806 1.00 0.00 H new ATOM 564 N MET A 41 4.791 5.814 8.780 1.00 0.00 N ATOM 565 CA MET A 41 4.502 6.080 10.185 1.00 0.00 C ATOM 566 C MET A 41 2.998 6.191 10.418 1.00 0.00 C ATOM 567 O MET A 41 2.223 6.357 9.476 1.00 0.00 O ATOM 568 CB MET A 41 5.195 7.367 10.635 1.00 0.00 C ATOM 569 CG MET A 41 6.599 7.144 11.175 1.00 0.00 C ATOM 570 SD MET A 41 7.070 8.368 12.412 1.00 0.00 S ATOM 571 CE MET A 41 6.407 9.862 11.680 1.00 0.00 C ATOM 0 H MET A 41 4.285 6.410 8.125 1.00 0.00 H new ATOM 0 HA MET A 41 4.883 5.245 10.774 1.00 0.00 H new ATOM 0 HB2 MET A 41 5.244 8.057 9.793 1.00 0.00 H new ATOM 0 HB3 MET A 41 4.590 7.846 11.405 1.00 0.00 H new ATOM 0 HG2 MET A 41 6.662 6.148 11.613 1.00 0.00 H new ATOM 0 HG3 MET A 41 7.311 7.175 10.350 1.00 0.00 H new ATOM 0 HE1 MET A 41 7.028 10.712 11.963 1.00 0.00 H new ATOM 0 HE2 MET A 41 6.400 9.763 10.595 1.00 0.00 H new ATOM 0 HE3 MET A 41 5.389 10.021 12.036 1.00 0.00 H new ATOM 581 N LYS A 42 2.591 6.097 11.680 1.00 0.00 N ATOM 582 CA LYS A 42 1.181 6.187 12.038 1.00 0.00 C ATOM 583 C LYS A 42 0.718 7.640 12.063 1.00 0.00 C ATOM 584 O LYS A 42 1.418 8.532 12.543 1.00 0.00 O ATOM 585 CB LYS A 42 0.938 5.540 13.403 1.00 0.00 C ATOM 586 CG LYS A 42 -0.489 5.058 13.603 1.00 0.00 C ATOM 587 CD LYS A 42 -0.655 4.346 14.935 1.00 0.00 C ATOM 588 CE LYS A 42 -0.506 5.308 16.104 1.00 0.00 C ATOM 589 NZ LYS A 42 0.922 5.627 16.381 1.00 0.00 N ATOM 0 H LYS A 42 3.219 5.958 12.472 1.00 0.00 H new ATOM 0 HA LYS A 42 0.605 5.653 11.282 1.00 0.00 H new ATOM 0 HB2 LYS A 42 1.618 4.696 13.522 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.183 6.259 14.185 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -1.171 5.907 13.556 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -0.763 4.383 12.792 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -1.636 3.872 14.975 1.00 0.00 H new ATOM 0 HD3 LYS A 42 0.087 3.552 15.019 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.049 6.228 15.888 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.960 4.872 16.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.117 5.495 17.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 1.533 4.995 15.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 1.115 6.614 16.117 1.00 0.00 H new ATOM 603 N PRO A 43 -0.491 7.886 11.535 1.00 0.00 N ATOM 604 CA PRO A 43 -1.075 9.230 11.487 1.00 0.00 C ATOM 605 C PRO A 43 -1.466 9.741 12.869 1.00 0.00 C ATOM 606 O PRO A 43 -1.515 8.991 13.844 1.00 0.00 O ATOM 607 CB PRO A 43 -2.318 9.045 10.614 1.00 0.00 C ATOM 608 CG PRO A 43 -2.679 7.607 10.767 1.00 0.00 C ATOM 609 CD PRO A 43 -1.380 6.871 10.945 1.00 0.00 C ATOM 0 HA PRO A 43 -0.371 9.967 11.100 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -3.131 9.694 10.940 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -2.111 9.292 9.573 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -3.333 7.458 11.626 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -3.216 7.244 9.891 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -1.494 6.007 11.600 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -0.994 6.502 9.995 1.00 0.00 H new ATOM 617 N PRO A 44 -1.752 11.049 12.958 1.00 0.00 N ATOM 618 CA PRO A 44 -2.145 11.689 14.217 1.00 0.00 C ATOM 619 C PRO A 44 -3.531 11.255 14.680 1.00 0.00 C ATOM 620 O PRO A 44 -4.050 11.756 15.678 1.00 0.00 O ATOM 621 CB PRO A 44 -2.140 13.181 13.872 1.00 0.00 C ATOM 622 CG PRO A 44 -2.371 13.231 12.402 1.00 0.00 C ATOM 623 CD PRO A 44 -1.714 12.002 11.837 1.00 0.00 C ATOM 0 HA PRO A 44 -1.476 11.424 15.036 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -2.921 13.715 14.414 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -1.191 13.646 14.140 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -3.437 13.243 12.175 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -1.943 14.136 11.970 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.252 11.622 10.968 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -0.692 12.204 11.516 1.00 0.00 H new ATOM 631 N THR A 45 -4.128 10.318 13.949 1.00 0.00 N ATOM 632 CA THR A 45 -5.455 9.817 14.285 1.00 0.00 C ATOM 633 C THR A 45 -5.475 9.208 15.682 1.00 0.00 C ATOM 634 O THR A 45 -5.436 7.987 15.839 1.00 0.00 O ATOM 635 CB THR A 45 -5.929 8.760 13.270 1.00 0.00 C ATOM 636 OG1 THR A 45 -4.960 7.711 13.166 1.00 0.00 O ATOM 637 CG2 THR A 45 -6.155 9.386 11.902 1.00 0.00 C ATOM 0 H THR A 45 -3.713 9.891 13.121 1.00 0.00 H new ATOM 0 HA THR A 45 -6.133 10.670 14.254 1.00 0.00 H new ATOM 0 HB THR A 45 -6.874 8.347 13.624 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.686 7.428 14.064 1.00 0.00 H new ATOM 0 HG21 THR A 45 -6.489 8.620 11.202 1.00 0.00 H new ATOM 0 HG22 THR A 45 -6.915 10.164 11.979 1.00 0.00 H new ATOM 0 HG23 THR A 45 -5.223 9.823 11.543 1.00 0.00 H new ATOM 645 N LYS A 46 -5.537 10.065 16.695 1.00 0.00 N ATOM 646 CA LYS A 46 -5.564 9.612 18.081 1.00 0.00 C ATOM 647 C LYS A 46 -6.683 10.300 18.856 1.00 0.00 C ATOM 648 O LYS A 46 -6.509 10.668 20.018 1.00 0.00 O ATOM 649 CB LYS A 46 -4.218 9.886 18.756 1.00 0.00 C ATOM 650 CG LYS A 46 -3.856 8.870 19.824 1.00 0.00 C ATOM 651 CD LYS A 46 -4.559 9.166 21.138 1.00 0.00 C ATOM 652 CE LYS A 46 -5.900 8.453 21.226 1.00 0.00 C ATOM 653 NZ LYS A 46 -6.876 9.208 22.059 1.00 0.00 N ATOM 0 H LYS A 46 -5.570 11.078 16.582 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.752 8.538 18.082 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.436 9.897 17.997 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -4.241 10.879 19.204 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.126 7.871 19.483 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -2.777 8.873 19.979 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -3.925 8.855 21.969 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.710 10.241 21.237 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -6.306 8.318 20.223 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -5.755 7.458 21.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -7.771 8.681 22.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -6.493 9.330 23.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -7.047 10.141 21.633 1.00 0.00 H new ATOM 667 N GLN A 47 -7.830 10.469 18.207 1.00 0.00 N ATOM 668 CA GLN A 47 -8.977 11.113 18.837 1.00 0.00 C ATOM 669 C GLN A 47 -10.276 10.703 18.151 1.00 0.00 C ATOM 670 O GLN A 47 -10.385 10.758 16.926 1.00 0.00 O ATOM 671 CB GLN A 47 -8.821 12.634 18.795 1.00 0.00 C ATOM 672 CG GLN A 47 -7.374 13.099 18.823 1.00 0.00 C ATOM 673 CD GLN A 47 -7.227 14.569 18.488 1.00 0.00 C ATOM 674 OE1 GLN A 47 -7.980 15.409 18.982 1.00 0.00 O ATOM 675 NE2 GLN A 47 -6.253 14.890 17.643 1.00 0.00 N ATOM 0 H GLN A 47 -7.990 10.169 17.245 1.00 0.00 H new ATOM 0 HA GLN A 47 -9.019 10.788 19.877 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -9.299 13.015 17.892 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -9.350 13.069 19.643 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -6.955 12.912 19.812 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -6.793 12.509 18.114 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -5.652 14.162 17.257 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -6.106 15.865 17.380 1.00 0.00 H new ATOM 684 N GLN A 48 -11.257 10.293 18.948 1.00 0.00 N ATOM 685 CA GLN A 48 -12.548 9.874 18.417 1.00 0.00 C ATOM 686 C GLN A 48 -12.374 9.082 17.125 1.00 0.00 C ATOM 687 O GLN A 48 -13.154 9.231 16.184 1.00 0.00 O ATOM 688 CB GLN A 48 -13.440 11.091 18.166 1.00 0.00 C ATOM 689 CG GLN A 48 -14.925 10.796 18.304 1.00 0.00 C ATOM 690 CD GLN A 48 -15.747 12.045 18.554 1.00 0.00 C ATOM 691 OE1 GLN A 48 -15.210 13.149 18.639 1.00 0.00 O ATOM 692 NE2 GLN A 48 -17.059 11.876 18.674 1.00 0.00 N ATOM 0 H GLN A 48 -11.182 10.242 19.964 1.00 0.00 H new ATOM 0 HA GLN A 48 -13.024 9.230 19.156 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -13.168 11.881 18.866 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -13.246 11.473 17.164 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -15.280 10.307 17.397 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -15.078 10.095 19.124 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -17.462 10.942 18.597 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -17.663 12.680 18.844 1.00 0.00 H new ATOM 701 N ASP A 49 -11.345 8.242 17.086 1.00 0.00 N ATOM 702 CA ASP A 49 -11.069 7.426 15.910 1.00 0.00 C ATOM 703 C ASP A 49 -11.232 5.943 16.226 1.00 0.00 C ATOM 704 O ASP A 49 -11.867 5.203 15.475 1.00 0.00 O ATOM 705 CB ASP A 49 -9.654 7.697 15.395 1.00 0.00 C ATOM 706 CG ASP A 49 -9.332 6.908 14.142 1.00 0.00 C ATOM 707 OD1 ASP A 49 -9.407 5.663 14.190 1.00 0.00 O ATOM 708 OD2 ASP A 49 -9.005 7.536 13.113 1.00 0.00 O ATOM 0 H ASP A 49 -10.689 8.109 17.855 1.00 0.00 H new ATOM 0 HA ASP A 49 -11.788 7.695 15.136 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -9.544 8.762 15.189 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -8.933 7.447 16.173 1.00 0.00 H new ATOM 713 N GLY A 50 -10.653 5.514 17.344 1.00 0.00 N ATOM 714 CA GLY A 50 -10.746 4.121 17.740 1.00 0.00 C ATOM 715 C GLY A 50 -9.385 3.491 17.966 1.00 0.00 C ATOM 716 O GLY A 50 -8.635 3.918 18.843 1.00 0.00 O ATOM 0 H GLY A 50 -10.122 6.106 17.982 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -11.335 4.045 18.654 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -11.278 3.562 16.970 1.00 0.00 H new ATOM 720 N GLU A 51 -9.068 2.472 17.174 1.00 0.00 N ATOM 721 CA GLU A 51 -7.789 1.781 17.294 1.00 0.00 C ATOM 722 C GLU A 51 -7.263 1.367 15.923 1.00 0.00 C ATOM 723 O GLU A 51 -8.033 1.000 15.034 1.00 0.00 O ATOM 724 CB GLU A 51 -7.932 0.550 18.191 1.00 0.00 C ATOM 725 CG GLU A 51 -8.717 -0.583 17.549 1.00 0.00 C ATOM 726 CD GLU A 51 -8.518 -1.907 18.261 1.00 0.00 C ATOM 727 OE1 GLU A 51 -9.132 -2.105 19.329 1.00 0.00 O ATOM 728 OE2 GLU A 51 -7.747 -2.745 17.747 1.00 0.00 O ATOM 0 H GLU A 51 -9.678 2.107 16.443 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.074 2.469 17.745 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.939 0.188 18.457 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -8.424 0.842 19.119 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.777 -0.331 17.549 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -8.413 -0.686 16.507 1.00 0.00 H new ATOM 735 N LEU A 52 -5.946 1.429 15.758 1.00 0.00 N ATOM 736 CA LEU A 52 -5.315 1.062 14.495 1.00 0.00 C ATOM 737 C LEU A 52 -5.212 -0.454 14.359 1.00 0.00 C ATOM 738 O LEU A 52 -4.804 -1.145 15.293 1.00 0.00 O ATOM 739 CB LEU A 52 -3.925 1.691 14.395 1.00 0.00 C ATOM 740 CG LEU A 52 -3.350 1.828 12.984 1.00 0.00 C ATOM 741 CD1 LEU A 52 -3.736 3.169 12.379 1.00 0.00 C ATOM 742 CD2 LEU A 52 -1.837 1.667 13.007 1.00 0.00 C ATOM 0 H LEU A 52 -5.295 1.730 16.483 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.936 1.440 13.683 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.963 2.682 14.848 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -3.234 1.094 14.991 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.770 1.037 12.362 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -3.318 3.249 11.375 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.822 3.246 12.327 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.345 3.975 13.000 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.445 1.767 11.995 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.399 2.436 13.644 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.582 0.682 13.399 1.00 0.00 H new ATOM 754 N VAL A 53 -5.581 -0.965 13.189 1.00 0.00 N ATOM 755 CA VAL A 53 -5.527 -2.399 12.929 1.00 0.00 C ATOM 756 C VAL A 53 -4.473 -2.727 11.877 1.00 0.00 C ATOM 757 O VAL A 53 -3.976 -3.850 11.811 1.00 0.00 O ATOM 758 CB VAL A 53 -6.891 -2.936 12.458 1.00 0.00 C ATOM 759 CG1 VAL A 53 -7.935 -2.776 13.553 1.00 0.00 C ATOM 760 CG2 VAL A 53 -7.330 -2.230 11.184 1.00 0.00 C ATOM 0 H VAL A 53 -5.921 -0.407 12.406 1.00 0.00 H new ATOM 0 HA VAL A 53 -5.260 -2.881 13.869 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.788 -3.999 12.240 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -8.892 -3.161 13.202 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.623 -3.332 14.437 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.039 -1.721 13.805 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.296 -2.622 10.865 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.417 -1.160 11.372 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.592 -2.402 10.400 1.00 0.00 H new ATOM 770 N GLY A 54 -4.136 -1.737 11.056 1.00 0.00 N ATOM 771 CA GLY A 54 -3.143 -1.940 10.017 1.00 0.00 C ATOM 772 C GLY A 54 -3.247 -0.914 8.907 1.00 0.00 C ATOM 773 O GLY A 54 -4.029 0.033 8.998 1.00 0.00 O ATOM 0 H GLY A 54 -4.533 -0.798 11.092 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -2.147 -1.895 10.457 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.261 -2.939 9.597 1.00 0.00 H new ATOM 777 N TYR A 55 -2.456 -1.099 7.856 1.00 0.00 N ATOM 778 CA TYR A 55 -2.459 -0.179 6.725 1.00 0.00 C ATOM 779 C TYR A 55 -2.771 -0.915 5.425 1.00 0.00 C ATOM 780 O TYR A 55 -2.811 -2.145 5.389 1.00 0.00 O ATOM 781 CB TYR A 55 -1.107 0.528 6.611 1.00 0.00 C ATOM 782 CG TYR A 55 -0.632 1.137 7.911 1.00 0.00 C ATOM 783 CD1 TYR A 55 -0.131 0.338 8.932 1.00 0.00 C ATOM 784 CD2 TYR A 55 -0.684 2.509 8.119 1.00 0.00 C ATOM 785 CE1 TYR A 55 0.304 0.890 10.122 1.00 0.00 C ATOM 786 CE2 TYR A 55 -0.250 3.070 9.304 1.00 0.00 C ATOM 787 CZ TYR A 55 0.243 2.256 10.303 1.00 0.00 C ATOM 788 OH TYR A 55 0.675 2.810 11.486 1.00 0.00 O ATOM 0 H TYR A 55 -1.804 -1.878 7.764 1.00 0.00 H new ATOM 0 HA TYR A 55 -3.237 0.565 6.897 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -0.362 -0.185 6.260 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -1.178 1.312 5.857 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -0.081 -0.732 8.793 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -1.071 3.149 7.340 1.00 0.00 H new ATOM 0 HE1 TYR A 55 0.690 0.255 10.906 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -0.296 4.139 9.448 1.00 0.00 H new ATOM 0 HH TYR A 55 1.293 3.547 11.296 1.00 0.00 H new ATOM 798 N ARG A 56 -2.992 -0.152 4.359 1.00 0.00 N ATOM 799 CA ARG A 56 -3.301 -0.730 3.057 1.00 0.00 C ATOM 800 C ARG A 56 -2.321 -0.237 1.997 1.00 0.00 C ATOM 801 O ARG A 56 -2.364 0.926 1.592 1.00 0.00 O ATOM 802 CB ARG A 56 -4.732 -0.380 2.647 1.00 0.00 C ATOM 803 CG ARG A 56 -5.764 -1.396 3.108 1.00 0.00 C ATOM 804 CD ARG A 56 -6.988 -1.397 2.205 1.00 0.00 C ATOM 805 NE ARG A 56 -8.152 -1.985 2.862 1.00 0.00 N ATOM 806 CZ ARG A 56 -9.278 -2.291 2.227 1.00 0.00 C ATOM 807 NH1 ARG A 56 -9.391 -2.065 0.925 1.00 0.00 N ATOM 808 NH2 ARG A 56 -10.294 -2.824 2.893 1.00 0.00 N ATOM 0 H ARG A 56 -2.963 0.867 4.372 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.208 -1.813 3.137 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -4.989 0.597 3.056 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -4.779 -0.294 1.561 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.318 -2.390 3.118 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.066 -1.171 4.131 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.219 -0.375 1.906 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.766 -1.953 1.294 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.098 -2.171 3.863 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.612 -1.655 0.409 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.257 -2.301 0.440 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.211 -3.000 3.894 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.158 -3.058 2.404 1.00 0.00 H new ATOM 822 N ILE A 57 -1.440 -1.127 1.552 1.00 0.00 N ATOM 823 CA ILE A 57 -0.451 -0.781 0.539 1.00 0.00 C ATOM 824 C ILE A 57 -0.952 -1.126 -0.859 1.00 0.00 C ATOM 825 O ILE A 57 -1.500 -2.205 -1.085 1.00 0.00 O ATOM 826 CB ILE A 57 0.885 -1.507 0.787 1.00 0.00 C ATOM 827 CG1 ILE A 57 1.284 -1.398 2.260 1.00 0.00 C ATOM 828 CG2 ILE A 57 1.974 -0.930 -0.106 1.00 0.00 C ATOM 829 CD1 ILE A 57 2.502 -2.220 2.618 1.00 0.00 C ATOM 0 H ILE A 57 -1.391 -2.093 1.877 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.290 0.295 0.609 1.00 0.00 H new ATOM 0 HB ILE A 57 0.760 -2.561 0.541 1.00 0.00 H new ATOM 0 HG12 ILE A 57 1.478 -0.352 2.499 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.446 -1.716 2.880 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.912 -1.453 0.080 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.691 -1.054 -1.151 1.00 0.00 H new ATOM 0 HG23 ILE A 57 2.100 0.130 0.113 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.727 -2.095 3.677 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.305 -3.272 2.411 1.00 0.00 H new ATOM 0 HD13 ILE A 57 3.353 -1.887 2.024 1.00 0.00 H new ATOM 841 N SER A 58 -0.760 -0.202 -1.795 1.00 0.00 N ATOM 842 CA SER A 58 -1.195 -0.407 -3.172 1.00 0.00 C ATOM 843 C SER A 58 -0.011 -0.335 -4.132 1.00 0.00 C ATOM 844 O SER A 58 0.537 0.739 -4.381 1.00 0.00 O ATOM 845 CB SER A 58 -2.244 0.637 -3.559 1.00 0.00 C ATOM 846 OG SER A 58 -2.809 0.347 -4.826 1.00 0.00 O ATOM 0 H SER A 58 -0.306 0.696 -1.625 1.00 0.00 H new ATOM 0 HA SER A 58 -1.638 -1.400 -3.243 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.030 0.664 -2.804 1.00 0.00 H new ATOM 0 HB3 SER A 58 -1.787 1.626 -3.579 1.00 0.00 H new ATOM 0 HG SER A 58 -3.477 1.028 -5.050 1.00 0.00 H new ATOM 852 N HIS A 59 0.379 -1.488 -4.668 1.00 0.00 N ATOM 853 CA HIS A 59 1.498 -1.557 -5.601 1.00 0.00 C ATOM 854 C HIS A 59 1.026 -2.001 -6.982 1.00 0.00 C ATOM 855 O HIS A 59 0.659 -3.159 -7.181 1.00 0.00 O ATOM 856 CB HIS A 59 2.566 -2.519 -5.080 1.00 0.00 C ATOM 857 CG HIS A 59 2.057 -3.909 -4.847 1.00 0.00 C ATOM 858 ND1 HIS A 59 2.533 -5.008 -5.530 1.00 0.00 N ATOM 859 CD2 HIS A 59 1.110 -4.375 -4.000 1.00 0.00 C ATOM 860 CE1 HIS A 59 1.899 -6.090 -5.115 1.00 0.00 C ATOM 861 NE2 HIS A 59 1.030 -5.733 -4.186 1.00 0.00 N ATOM 0 H HIS A 59 -0.063 -2.386 -4.472 1.00 0.00 H new ATOM 0 HA HIS A 59 1.930 -0.560 -5.687 1.00 0.00 H new ATOM 0 HB2 HIS A 59 3.389 -2.557 -5.794 1.00 0.00 H new ATOM 0 HB3 HIS A 59 2.972 -2.128 -4.147 1.00 0.00 H new ATOM 0 HD2 HIS A 59 0.526 -3.788 -3.307 1.00 0.00 H new ATOM 0 HE1 HIS A 59 2.063 -7.095 -5.474 1.00 0.00 H new ATOM 0 HE2 HIS A 59 0.402 -6.364 -3.688 1.00 0.00 H new ATOM 870 N VAL A 60 1.039 -1.072 -7.933 1.00 0.00 N ATOM 871 CA VAL A 60 0.613 -1.368 -9.296 1.00 0.00 C ATOM 872 C VAL A 60 1.805 -1.423 -10.245 1.00 0.00 C ATOM 873 O VAL A 60 2.894 -0.949 -9.918 1.00 0.00 O ATOM 874 CB VAL A 60 -0.390 -0.319 -9.811 1.00 0.00 C ATOM 875 CG1 VAL A 60 0.199 1.080 -9.706 1.00 0.00 C ATOM 876 CG2 VAL A 60 -0.796 -0.629 -11.244 1.00 0.00 C ATOM 0 H VAL A 60 1.340 -0.109 -7.785 1.00 0.00 H new ATOM 0 HA VAL A 60 0.127 -2.343 -9.270 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.283 -0.359 -9.188 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.524 1.808 -10.074 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.435 1.298 -8.664 1.00 0.00 H new ATOM 0 HG13 VAL A 60 1.109 1.138 -10.304 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.505 0.122 -11.592 1.00 0.00 H new ATOM 0 HG22 VAL A 60 0.087 -0.618 -11.883 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.261 -1.614 -11.285 1.00 0.00 H new ATOM 886 N TRP A 61 1.593 -2.005 -11.420 1.00 0.00 N ATOM 887 CA TRP A 61 2.650 -2.122 -12.417 1.00 0.00 C ATOM 888 C TRP A 61 2.128 -1.777 -13.807 1.00 0.00 C ATOM 889 O TRP A 61 1.254 -2.461 -14.338 1.00 0.00 O ATOM 890 CB TRP A 61 3.229 -3.537 -12.413 1.00 0.00 C ATOM 891 CG TRP A 61 3.710 -3.978 -11.063 1.00 0.00 C ATOM 892 CD1 TRP A 61 2.946 -4.458 -10.038 1.00 0.00 C ATOM 893 CD2 TRP A 61 5.062 -3.979 -10.593 1.00 0.00 C ATOM 894 NE1 TRP A 61 3.742 -4.756 -8.958 1.00 0.00 N ATOM 895 CE2 TRP A 61 5.045 -4.472 -9.274 1.00 0.00 C ATOM 896 CE3 TRP A 61 6.286 -3.612 -11.159 1.00 0.00 C ATOM 897 CZ2 TRP A 61 6.203 -4.606 -8.514 1.00 0.00 C ATOM 898 CZ3 TRP A 61 7.436 -3.745 -10.403 1.00 0.00 C ATOM 899 CH2 TRP A 61 7.388 -4.239 -9.093 1.00 0.00 C ATOM 0 H TRP A 61 0.698 -2.403 -11.705 1.00 0.00 H new ATOM 0 HA TRP A 61 3.438 -1.414 -12.159 1.00 0.00 H new ATOM 0 HB2 TRP A 61 2.469 -4.234 -12.766 1.00 0.00 H new ATOM 0 HB3 TRP A 61 4.058 -3.585 -13.120 1.00 0.00 H new ATOM 0 HD1 TRP A 61 1.874 -4.585 -10.071 1.00 0.00 H new ATOM 0 HE1 TRP A 61 3.416 -5.128 -8.066 1.00 0.00 H new ATOM 0 HE3 TRP A 61 6.333 -3.231 -12.169 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 6.168 -4.986 -7.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 8.387 -3.463 -10.830 1.00 0.00 H new ATOM 0 HH2 TRP A 61 8.304 -4.332 -8.529 1.00 0.00 H new ATOM 910 N GLN A 62 2.670 -0.713 -14.391 1.00 0.00 N ATOM 911 CA GLN A 62 2.257 -0.278 -15.721 1.00 0.00 C ATOM 912 C GLN A 62 3.438 -0.281 -16.686 1.00 0.00 C ATOM 913 O GLN A 62 4.295 0.601 -16.636 1.00 0.00 O ATOM 914 CB GLN A 62 1.640 1.120 -15.654 1.00 0.00 C ATOM 915 CG GLN A 62 0.143 1.113 -15.394 1.00 0.00 C ATOM 916 CD GLN A 62 -0.547 2.355 -15.921 1.00 0.00 C ATOM 917 OE1 GLN A 62 0.103 3.286 -16.396 1.00 0.00 O ATOM 918 NE2 GLN A 62 -1.873 2.376 -15.840 1.00 0.00 N ATOM 0 H GLN A 62 3.396 -0.136 -13.965 1.00 0.00 H new ATOM 0 HA GLN A 62 1.509 -0.980 -16.090 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.134 1.689 -14.866 1.00 0.00 H new ATOM 0 HB3 GLN A 62 1.835 1.639 -16.592 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.298 0.232 -15.859 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -0.035 1.030 -14.322 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -2.372 1.582 -15.439 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -2.392 3.186 -16.179 1.00 0.00 H new ATOM 927 N SER A 63 3.477 -1.279 -17.563 1.00 0.00 N ATOM 928 CA SER A 63 4.555 -1.399 -18.537 1.00 0.00 C ATOM 929 C SER A 63 4.031 -1.194 -19.956 1.00 0.00 C ATOM 930 O SER A 63 2.835 -1.330 -20.213 1.00 0.00 O ATOM 931 CB SER A 63 5.225 -2.769 -18.421 1.00 0.00 C ATOM 932 OG SER A 63 5.822 -3.150 -19.649 1.00 0.00 O ATOM 0 H SER A 63 2.774 -2.016 -17.619 1.00 0.00 H new ATOM 0 HA SER A 63 5.291 -0.624 -18.325 1.00 0.00 H new ATOM 0 HB2 SER A 63 5.982 -2.742 -17.638 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.487 -3.514 -18.125 1.00 0.00 H new ATOM 0 HG SER A 63 6.245 -4.028 -19.548 1.00 0.00 H new ATOM 938 N ALA A 64 4.936 -0.867 -20.872 1.00 0.00 N ATOM 939 CA ALA A 64 4.567 -0.646 -22.265 1.00 0.00 C ATOM 940 C ALA A 64 3.995 -1.914 -22.890 1.00 0.00 C ATOM 941 O ALA A 64 4.735 -2.833 -23.240 1.00 0.00 O ATOM 942 CB ALA A 64 5.770 -0.160 -23.059 1.00 0.00 C ATOM 0 H ALA A 64 5.930 -0.749 -20.675 1.00 0.00 H new ATOM 0 HA ALA A 64 3.793 0.121 -22.292 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.480 0.001 -24.097 1.00 0.00 H new ATOM 0 HB2 ALA A 64 6.132 0.776 -22.634 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.561 -0.908 -23.015 1.00 0.00 H new ATOM 948 N GLY A 65 2.673 -1.958 -23.026 1.00 0.00 N ATOM 949 CA GLY A 65 2.025 -3.119 -23.608 1.00 0.00 C ATOM 950 C GLY A 65 1.366 -3.999 -22.564 1.00 0.00 C ATOM 951 O GLY A 65 0.407 -4.711 -22.860 1.00 0.00 O ATOM 0 H GLY A 65 2.039 -1.210 -22.744 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.275 -2.790 -24.327 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.761 -3.704 -24.160 1.00 0.00 H new ATOM 955 N ILE A 66 1.883 -3.951 -21.341 1.00 0.00 N ATOM 956 CA ILE A 66 1.338 -4.751 -20.251 1.00 0.00 C ATOM 957 C ILE A 66 1.002 -3.880 -19.045 1.00 0.00 C ATOM 958 O ILE A 66 1.856 -3.158 -18.530 1.00 0.00 O ATOM 959 CB ILE A 66 2.322 -5.853 -19.815 1.00 0.00 C ATOM 960 CG1 ILE A 66 2.418 -6.936 -20.892 1.00 0.00 C ATOM 961 CG2 ILE A 66 1.887 -6.456 -18.488 1.00 0.00 C ATOM 962 CD1 ILE A 66 1.074 -7.489 -21.314 1.00 0.00 C ATOM 0 H ILE A 66 2.678 -3.367 -21.080 1.00 0.00 H new ATOM 0 HA ILE A 66 0.426 -5.216 -20.626 1.00 0.00 H new ATOM 0 HB ILE A 66 3.308 -5.408 -19.684 1.00 0.00 H new ATOM 0 HG12 ILE A 66 2.923 -6.524 -21.766 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.038 -7.752 -20.521 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.592 -7.233 -18.193 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.864 -5.678 -17.725 1.00 0.00 H new ATOM 0 HG23 ILE A 66 0.893 -6.890 -18.594 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.218 -8.252 -22.079 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.575 -7.931 -20.451 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.459 -6.684 -21.716 1.00 0.00 H new ATOM 974 N SER A 67 -0.248 -3.954 -18.598 1.00 0.00 N ATOM 975 CA SER A 67 -0.698 -3.170 -17.454 1.00 0.00 C ATOM 976 C SER A 67 -1.383 -4.061 -16.422 1.00 0.00 C ATOM 977 O SER A 67 -2.505 -4.523 -16.630 1.00 0.00 O ATOM 978 CB SER A 67 -1.656 -2.068 -17.909 1.00 0.00 C ATOM 979 OG SER A 67 -2.885 -2.612 -18.357 1.00 0.00 O ATOM 0 H SER A 67 -0.967 -4.549 -19.011 1.00 0.00 H new ATOM 0 HA SER A 67 0.176 -2.712 -16.991 1.00 0.00 H new ATOM 0 HB2 SER A 67 -1.839 -1.378 -17.085 1.00 0.00 H new ATOM 0 HB3 SER A 67 -1.196 -1.491 -18.711 1.00 0.00 H new ATOM 0 HG SER A 67 -2.956 -3.544 -18.064 1.00 0.00 H new ATOM 985 N LYS A 68 -0.700 -4.298 -15.307 1.00 0.00 N ATOM 986 CA LYS A 68 -1.240 -5.132 -14.241 1.00 0.00 C ATOM 987 C LYS A 68 -1.365 -4.341 -12.942 1.00 0.00 C ATOM 988 O LYS A 68 -0.731 -3.300 -12.776 1.00 0.00 O ATOM 989 CB LYS A 68 -0.349 -6.357 -14.021 1.00 0.00 C ATOM 990 CG LYS A 68 -0.053 -7.130 -15.294 1.00 0.00 C ATOM 991 CD LYS A 68 0.174 -8.605 -15.011 1.00 0.00 C ATOM 992 CE LYS A 68 -1.127 -9.391 -15.065 1.00 0.00 C ATOM 993 NZ LYS A 68 -1.022 -10.689 -14.344 1.00 0.00 N ATOM 0 H LYS A 68 0.230 -3.923 -15.119 1.00 0.00 H new ATOM 0 HA LYS A 68 -2.234 -5.463 -14.542 1.00 0.00 H new ATOM 0 HB2 LYS A 68 0.592 -6.036 -13.574 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -0.831 -7.023 -13.305 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.883 -7.016 -15.991 1.00 0.00 H new ATOM 0 HG3 LYS A 68 0.829 -6.711 -15.778 1.00 0.00 H new ATOM 0 HD2 LYS A 68 0.876 -9.012 -15.738 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.630 -8.722 -14.028 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -1.929 -8.796 -14.627 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -1.397 -9.574 -16.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -1.929 -11.194 -14.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -0.274 -11.267 -14.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.789 -10.514 -13.346 1.00 0.00 H new ATOM 1007 N GLU A 69 -2.186 -4.844 -12.025 1.00 0.00 N ATOM 1008 CA GLU A 69 -2.391 -4.184 -10.741 1.00 0.00 C ATOM 1009 C GLU A 69 -2.321 -5.188 -9.595 1.00 0.00 C ATOM 1010 O GLU A 69 -2.842 -6.300 -9.695 1.00 0.00 O ATOM 1011 CB GLU A 69 -3.743 -3.467 -10.722 1.00 0.00 C ATOM 1012 CG GLU A 69 -3.974 -2.635 -9.472 1.00 0.00 C ATOM 1013 CD GLU A 69 -5.414 -2.181 -9.330 1.00 0.00 C ATOM 1014 OE1 GLU A 69 -6.214 -2.930 -8.732 1.00 0.00 O ATOM 1015 OE2 GLU A 69 -5.740 -1.079 -9.817 1.00 0.00 O ATOM 0 H GLU A 69 -2.719 -5.705 -12.147 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.596 -3.451 -10.608 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.814 -2.820 -11.597 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.538 -4.207 -10.807 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.693 -3.218 -8.595 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.322 -1.761 -9.496 1.00 0.00 H new ATOM 1022 N LEU A 70 -1.671 -4.790 -8.506 1.00 0.00 N ATOM 1023 CA LEU A 70 -1.531 -5.655 -7.340 1.00 0.00 C ATOM 1024 C LEU A 70 -1.881 -4.903 -6.060 1.00 0.00 C ATOM 1025 O LEU A 70 -1.837 -3.673 -6.017 1.00 0.00 O ATOM 1026 CB LEU A 70 -0.103 -6.198 -7.252 1.00 0.00 C ATOM 1027 CG LEU A 70 0.362 -7.055 -8.430 1.00 0.00 C ATOM 1028 CD1 LEU A 70 1.860 -7.305 -8.348 1.00 0.00 C ATOM 1029 CD2 LEU A 70 -0.399 -8.372 -8.465 1.00 0.00 C ATOM 0 H LEU A 70 -1.233 -3.874 -8.407 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.224 -6.489 -7.451 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.580 -5.354 -7.150 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.016 -6.790 -6.341 1.00 0.00 H new ATOM 0 HG LEU A 70 0.154 -6.514 -9.353 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.174 -7.916 -9.194 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.390 -6.353 -8.372 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.092 -7.825 -7.419 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -0.055 -8.969 -9.310 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -0.223 -8.919 -7.539 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.465 -8.173 -8.572 1.00 0.00 H new ATOM 1041 N LEU A 71 -2.226 -5.651 -5.017 1.00 0.00 N ATOM 1042 CA LEU A 71 -2.582 -5.055 -3.733 1.00 0.00 C ATOM 1043 C LEU A 71 -2.025 -5.881 -2.578 1.00 0.00 C ATOM 1044 O LEU A 71 -2.219 -7.094 -2.519 1.00 0.00 O ATOM 1045 CB LEU A 71 -4.101 -4.939 -3.606 1.00 0.00 C ATOM 1046 CG LEU A 71 -4.614 -3.877 -2.633 1.00 0.00 C ATOM 1047 CD1 LEU A 71 -4.177 -4.199 -1.213 1.00 0.00 C ATOM 1048 CD2 LEU A 71 -4.124 -2.496 -3.044 1.00 0.00 C ATOM 0 H LEU A 71 -2.267 -6.670 -5.035 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.143 -4.058 -3.688 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.513 -4.728 -4.593 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.495 -5.907 -3.296 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.704 -3.878 -2.665 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.551 -3.432 -0.534 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.578 -5.170 -0.920 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -3.088 -4.226 -1.165 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.499 -1.753 -2.340 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.034 -2.481 -3.042 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.488 -2.264 -4.045 1.00 0.00 H new ATOM 1060 N GLU A 72 -1.333 -5.213 -1.660 1.00 0.00 N ATOM 1061 CA GLU A 72 -0.750 -5.885 -0.505 1.00 0.00 C ATOM 1062 C GLU A 72 -1.558 -5.599 0.757 1.00 0.00 C ATOM 1063 O GLU A 72 -2.170 -4.539 0.887 1.00 0.00 O ATOM 1064 CB GLU A 72 0.701 -5.440 -0.306 1.00 0.00 C ATOM 1065 CG GLU A 72 1.572 -6.486 0.368 1.00 0.00 C ATOM 1066 CD GLU A 72 1.708 -7.752 -0.457 1.00 0.00 C ATOM 1067 OE1 GLU A 72 2.247 -7.672 -1.580 1.00 0.00 O ATOM 1068 OE2 GLU A 72 1.275 -8.821 0.021 1.00 0.00 O ATOM 0 H GLU A 72 -1.163 -4.208 -1.694 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.771 -6.958 -0.694 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.132 -5.191 -1.276 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.714 -4.529 0.292 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.562 -6.067 0.549 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.148 -6.735 1.341 1.00 0.00 H new ATOM 1075 N GLU A 73 -1.556 -6.553 1.684 1.00 0.00 N ATOM 1076 CA GLU A 73 -2.290 -6.403 2.935 1.00 0.00 C ATOM 1077 C GLU A 73 -1.356 -6.537 4.133 1.00 0.00 C ATOM 1078 O GLU A 73 -0.640 -7.530 4.269 1.00 0.00 O ATOM 1079 CB GLU A 73 -3.406 -7.447 3.024 1.00 0.00 C ATOM 1080 CG GLU A 73 -4.351 -7.431 1.835 1.00 0.00 C ATOM 1081 CD GLU A 73 -5.009 -8.776 1.595 1.00 0.00 C ATOM 1082 OE1 GLU A 73 -6.003 -9.082 2.287 1.00 0.00 O ATOM 1083 OE2 GLU A 73 -4.530 -9.523 0.716 1.00 0.00 O ATOM 0 H GLU A 73 -1.055 -7.437 1.592 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.732 -5.407 2.951 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -2.959 -8.438 3.109 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.979 -7.277 3.935 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.122 -6.678 1.998 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.800 -7.135 0.942 1.00 0.00 H new ATOM 1090 N VAL A 74 -1.368 -5.530 5.001 1.00 0.00 N ATOM 1091 CA VAL A 74 -0.522 -5.535 6.189 1.00 0.00 C ATOM 1092 C VAL A 74 -1.301 -5.081 7.419 1.00 0.00 C ATOM 1093 O VAL A 74 -2.296 -4.367 7.308 1.00 0.00 O ATOM 1094 CB VAL A 74 0.706 -4.623 6.007 1.00 0.00 C ATOM 1095 CG1 VAL A 74 1.821 -5.367 5.289 1.00 0.00 C ATOM 1096 CG2 VAL A 74 0.324 -3.359 5.252 1.00 0.00 C ATOM 0 H VAL A 74 -1.954 -4.701 4.904 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.185 -6.561 6.334 1.00 0.00 H new ATOM 0 HB VAL A 74 1.071 -4.333 6.992 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.680 -4.707 5.169 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.112 -6.239 5.874 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.471 -5.689 4.308 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.204 -2.727 5.133 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.067 -3.626 4.270 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.439 -2.818 5.811 1.00 0.00 H new ATOM 1106 N GLY A 75 -0.839 -5.501 8.593 1.00 0.00 N ATOM 1107 CA GLY A 75 -1.503 -5.128 9.828 1.00 0.00 C ATOM 1108 C GLY A 75 -0.869 -3.918 10.485 1.00 0.00 C ATOM 1109 O GLY A 75 -0.062 -3.222 9.869 1.00 0.00 O ATOM 0 H GLY A 75 -0.017 -6.093 8.711 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.553 -4.918 9.623 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.475 -5.970 10.520 1.00 0.00 H new ATOM 1113 N GLN A 76 -1.236 -3.666 11.737 1.00 0.00 N ATOM 1114 CA GLN A 76 -0.699 -2.530 12.477 1.00 0.00 C ATOM 1115 C GLN A 76 0.710 -2.825 12.980 1.00 0.00 C ATOM 1116 O GLN A 76 1.607 -1.991 12.867 1.00 0.00 O ATOM 1117 CB GLN A 76 -1.612 -2.183 13.654 1.00 0.00 C ATOM 1118 CG GLN A 76 -1.752 -3.308 14.667 1.00 0.00 C ATOM 1119 CD GLN A 76 -2.777 -3.002 15.741 1.00 0.00 C ATOM 1120 OE1 GLN A 76 -3.902 -3.502 15.703 1.00 0.00 O ATOM 1121 NE2 GLN A 76 -2.394 -2.176 16.707 1.00 0.00 N ATOM 0 H GLN A 76 -1.903 -4.233 12.260 1.00 0.00 H new ATOM 0 HA GLN A 76 -0.652 -1.677 11.800 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -1.222 -1.298 14.157 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.600 -1.923 13.273 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.036 -4.224 14.150 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.785 -3.493 15.135 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -1.452 -1.784 16.700 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.042 -1.933 17.457 1.00 0.00 H new ATOM 1130 N ASN A 77 0.897 -4.018 13.535 1.00 0.00 N ATOM 1131 CA ASN A 77 2.197 -4.423 14.057 1.00 0.00 C ATOM 1132 C ASN A 77 3.251 -4.420 12.953 1.00 0.00 C ATOM 1133 O ASN A 77 4.371 -3.951 13.151 1.00 0.00 O ATOM 1134 CB ASN A 77 2.106 -5.814 14.687 1.00 0.00 C ATOM 1135 CG ASN A 77 1.707 -5.762 16.149 1.00 0.00 C ATOM 1136 OD1 ASN A 77 0.901 -4.923 16.554 1.00 0.00 O ATOM 1137 ND2 ASN A 77 2.270 -6.660 16.949 1.00 0.00 N ATOM 0 H ASN A 77 0.165 -4.721 13.635 1.00 0.00 H new ATOM 0 HA ASN A 77 2.494 -3.705 14.821 1.00 0.00 H new ATOM 0 HB2 ASN A 77 1.380 -6.412 14.136 1.00 0.00 H new ATOM 0 HB3 ASN A 77 3.069 -6.316 14.594 1.00 0.00 H new ATOM 0 HD21 ASN A 77 2.040 -6.673 17.943 1.00 0.00 H new ATOM 0 HD22 ASN A 77 2.933 -7.336 16.570 1.00 0.00 H new ATOM 1144 N GLY A 78 2.883 -4.947 11.789 1.00 0.00 N ATOM 1145 CA GLY A 78 3.807 -4.995 10.671 1.00 0.00 C ATOM 1146 C GLY A 78 4.204 -3.614 10.188 1.00 0.00 C ATOM 1147 O GLY A 78 3.607 -3.081 9.252 1.00 0.00 O ATOM 0 H GLY A 78 1.961 -5.341 11.600 1.00 0.00 H new ATOM 0 HA2 GLY A 78 4.701 -5.544 10.966 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.350 -5.547 9.849 1.00 0.00 H new ATOM 1151 N SER A 79 5.213 -3.032 10.827 1.00 0.00 N ATOM 1152 CA SER A 79 5.686 -1.703 10.461 1.00 0.00 C ATOM 1153 C SER A 79 6.682 -1.779 9.307 1.00 0.00 C ATOM 1154 O SER A 79 7.629 -0.996 9.238 1.00 0.00 O ATOM 1155 CB SER A 79 6.335 -1.019 11.665 1.00 0.00 C ATOM 1156 OG SER A 79 7.576 -1.624 11.988 1.00 0.00 O ATOM 0 H SER A 79 5.719 -3.461 11.602 1.00 0.00 H new ATOM 0 HA SER A 79 4.827 -1.115 10.138 1.00 0.00 H new ATOM 0 HB2 SER A 79 6.488 0.038 11.448 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.665 -1.075 12.523 1.00 0.00 H new ATOM 0 HG SER A 79 7.971 -1.168 12.760 1.00 0.00 H new ATOM 1162 N ARG A 80 6.459 -2.728 8.404 1.00 0.00 N ATOM 1163 CA ARG A 80 7.336 -2.908 7.253 1.00 0.00 C ATOM 1164 C ARG A 80 6.679 -3.799 6.203 1.00 0.00 C ATOM 1165 O ARG A 80 5.992 -4.764 6.536 1.00 0.00 O ATOM 1166 CB ARG A 80 8.669 -3.517 7.692 1.00 0.00 C ATOM 1167 CG ARG A 80 9.624 -3.788 6.541 1.00 0.00 C ATOM 1168 CD ARG A 80 11.037 -4.050 7.038 1.00 0.00 C ATOM 1169 NE ARG A 80 11.857 -4.716 6.030 1.00 0.00 N ATOM 1170 CZ ARG A 80 13.101 -5.127 6.249 1.00 0.00 C ATOM 1171 NH1 ARG A 80 13.665 -4.940 7.435 1.00 0.00 N ATOM 1172 NH2 ARG A 80 13.784 -5.725 5.282 1.00 0.00 N ATOM 0 H ARG A 80 5.679 -3.384 8.447 1.00 0.00 H new ATOM 0 HA ARG A 80 7.519 -1.929 6.810 1.00 0.00 H new ATOM 0 HB2 ARG A 80 9.150 -2.844 8.401 1.00 0.00 H new ATOM 0 HB3 ARG A 80 8.476 -4.451 8.220 1.00 0.00 H new ATOM 0 HG2 ARG A 80 9.273 -4.648 5.970 1.00 0.00 H new ATOM 0 HG3 ARG A 80 9.628 -2.935 5.862 1.00 0.00 H new ATOM 0 HD2 ARG A 80 11.503 -3.106 7.319 1.00 0.00 H new ATOM 0 HD3 ARG A 80 10.997 -4.665 7.937 1.00 0.00 H new ATOM 0 HE ARG A 80 11.452 -4.874 5.107 1.00 0.00 H new ATOM 0 HH11 ARG A 80 13.143 -4.480 8.181 1.00 0.00 H new ATOM 0 HH12 ARG A 80 14.620 -5.256 7.601 1.00 0.00 H new ATOM 0 HH21 ARG A 80 13.354 -5.870 4.368 1.00 0.00 H new ATOM 0 HH22 ARG A 80 14.739 -6.040 5.452 1.00 0.00 H new ATOM 1186 N ALA A 81 6.896 -3.468 4.934 1.00 0.00 N ATOM 1187 CA ALA A 81 6.327 -4.238 3.836 1.00 0.00 C ATOM 1188 C ALA A 81 7.328 -4.389 2.695 1.00 0.00 C ATOM 1189 O ALA A 81 8.084 -3.466 2.394 1.00 0.00 O ATOM 1190 CB ALA A 81 5.049 -3.581 3.336 1.00 0.00 C ATOM 0 H ALA A 81 7.462 -2.671 4.642 1.00 0.00 H new ATOM 0 HA ALA A 81 6.088 -5.234 4.209 1.00 0.00 H new ATOM 0 HB1 ALA A 81 4.635 -4.167 2.516 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.324 -3.531 4.148 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.271 -2.573 2.985 1.00 0.00 H new ATOM 1196 N ARG A 82 7.326 -5.559 2.064 1.00 0.00 N ATOM 1197 CA ARG A 82 8.236 -5.831 0.957 1.00 0.00 C ATOM 1198 C ARG A 82 7.481 -6.405 -0.238 1.00 0.00 C ATOM 1199 O ARG A 82 6.549 -7.193 -0.076 1.00 0.00 O ATOM 1200 CB ARG A 82 9.332 -6.803 1.396 1.00 0.00 C ATOM 1201 CG ARG A 82 10.447 -6.964 0.377 1.00 0.00 C ATOM 1202 CD ARG A 82 11.341 -8.149 0.711 1.00 0.00 C ATOM 1203 NE ARG A 82 10.766 -9.413 0.259 1.00 0.00 N ATOM 1204 CZ ARG A 82 9.979 -10.173 1.011 1.00 0.00 C ATOM 1205 NH1 ARG A 82 9.674 -9.799 2.246 1.00 0.00 N ATOM 1206 NH2 ARG A 82 9.494 -11.310 0.528 1.00 0.00 N ATOM 0 H ARG A 82 6.705 -6.333 2.300 1.00 0.00 H new ATOM 0 HA ARG A 82 8.695 -4.889 0.657 1.00 0.00 H new ATOM 0 HB2 ARG A 82 9.759 -6.455 2.337 1.00 0.00 H new ATOM 0 HB3 ARG A 82 8.885 -7.778 1.590 1.00 0.00 H new ATOM 0 HG2 ARG A 82 10.017 -7.099 -0.616 1.00 0.00 H new ATOM 0 HG3 ARG A 82 11.045 -6.053 0.344 1.00 0.00 H new ATOM 0 HD2 ARG A 82 12.317 -8.009 0.247 1.00 0.00 H new ATOM 0 HD3 ARG A 82 11.503 -8.189 1.788 1.00 0.00 H new ATOM 0 HE ARG A 82 10.981 -9.729 -0.687 1.00 0.00 H new ATOM 0 HH11 ARG A 82 10.044 -8.925 2.620 1.00 0.00 H new ATOM 0 HH12 ARG A 82 9.069 -10.385 2.822 1.00 0.00 H new ATOM 0 HH21 ARG A 82 9.726 -11.601 -0.422 1.00 0.00 H new ATOM 0 HH22 ARG A 82 8.889 -11.893 1.107 1.00 0.00 H new ATOM 1220 N ILE A 83 7.889 -6.004 -1.438 1.00 0.00 N ATOM 1221 CA ILE A 83 7.252 -6.479 -2.659 1.00 0.00 C ATOM 1222 C ILE A 83 8.275 -7.088 -3.612 1.00 0.00 C ATOM 1223 O ILE A 83 9.360 -6.541 -3.806 1.00 0.00 O ATOM 1224 CB ILE A 83 6.505 -5.344 -3.383 1.00 0.00 C ATOM 1225 CG1 ILE A 83 5.838 -4.413 -2.368 1.00 0.00 C ATOM 1226 CG2 ILE A 83 5.472 -5.916 -4.343 1.00 0.00 C ATOM 1227 CD1 ILE A 83 5.048 -3.292 -3.004 1.00 0.00 C ATOM 0 H ILE A 83 8.658 -5.351 -1.590 1.00 0.00 H new ATOM 0 HA ILE A 83 6.534 -7.244 -2.363 1.00 0.00 H new ATOM 0 HB ILE A 83 7.227 -4.765 -3.959 1.00 0.00 H new ATOM 0 HG12 ILE A 83 5.174 -4.998 -1.732 1.00 0.00 H new ATOM 0 HG13 ILE A 83 6.604 -3.985 -1.721 1.00 0.00 H new ATOM 0 HG21 ILE A 83 4.953 -5.101 -4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 83 5.971 -6.541 -5.084 1.00 0.00 H new ATOM 0 HG23 ILE A 83 4.752 -6.516 -3.787 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.603 -2.673 -2.225 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.711 -2.682 -3.618 1.00 0.00 H new ATOM 0 HD13 ILE A 83 4.259 -3.712 -3.628 1.00 0.00 H new ATOM 1239 N SER A 84 7.920 -8.223 -4.206 1.00 0.00 N ATOM 1240 CA SER A 84 8.809 -8.908 -5.138 1.00 0.00 C ATOM 1241 C SER A 84 8.593 -8.406 -6.563 1.00 0.00 C ATOM 1242 O SER A 84 7.556 -8.663 -7.174 1.00 0.00 O ATOM 1243 CB SER A 84 8.579 -10.419 -5.078 1.00 0.00 C ATOM 1244 OG SER A 84 8.937 -10.939 -3.809 1.00 0.00 O ATOM 0 H SER A 84 7.024 -8.687 -4.059 1.00 0.00 H new ATOM 0 HA SER A 84 9.837 -8.692 -4.847 1.00 0.00 H new ATOM 0 HB2 SER A 84 7.531 -10.639 -5.282 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.165 -10.910 -5.855 1.00 0.00 H new ATOM 0 HG SER A 84 8.779 -11.906 -3.795 1.00 0.00 H new ATOM 1250 N VAL A 85 9.581 -7.687 -7.086 1.00 0.00 N ATOM 1251 CA VAL A 85 9.502 -7.149 -8.439 1.00 0.00 C ATOM 1252 C VAL A 85 8.848 -8.146 -9.389 1.00 0.00 C ATOM 1253 O VAL A 85 9.473 -9.120 -9.808 1.00 0.00 O ATOM 1254 CB VAL A 85 10.896 -6.780 -8.979 1.00 0.00 C ATOM 1255 CG1 VAL A 85 10.796 -6.259 -10.404 1.00 0.00 C ATOM 1256 CG2 VAL A 85 11.564 -5.757 -8.073 1.00 0.00 C ATOM 0 H VAL A 85 10.446 -7.464 -6.593 1.00 0.00 H new ATOM 0 HA VAL A 85 8.891 -6.248 -8.386 1.00 0.00 H new ATOM 0 HB VAL A 85 11.512 -7.679 -8.990 1.00 0.00 H new ATOM 0 HG11 VAL A 85 11.791 -6.003 -10.769 1.00 0.00 H new ATOM 0 HG12 VAL A 85 10.362 -7.028 -11.043 1.00 0.00 H new ATOM 0 HG13 VAL A 85 10.163 -5.372 -10.423 1.00 0.00 H new ATOM 0 HG21 VAL A 85 12.548 -5.508 -8.469 1.00 0.00 H new ATOM 0 HG22 VAL A 85 10.952 -4.856 -8.028 1.00 0.00 H new ATOM 0 HG23 VAL A 85 11.671 -6.173 -7.071 1.00 0.00 H new ATOM 1266 N GLN A 86 7.587 -7.895 -9.726 1.00 0.00 N ATOM 1267 CA GLN A 86 6.848 -8.771 -10.627 1.00 0.00 C ATOM 1268 C GLN A 86 7.158 -8.440 -12.083 1.00 0.00 C ATOM 1269 O GLN A 86 7.191 -9.325 -12.939 1.00 0.00 O ATOM 1270 CB GLN A 86 5.345 -8.649 -10.373 1.00 0.00 C ATOM 1271 CG GLN A 86 4.925 -9.098 -8.982 1.00 0.00 C ATOM 1272 CD GLN A 86 4.949 -10.606 -8.824 1.00 0.00 C ATOM 1273 OE1 GLN A 86 5.139 -11.341 -9.793 1.00 0.00 O ATOM 1274 NE2 GLN A 86 4.756 -11.075 -7.597 1.00 0.00 N ATOM 0 H GLN A 86 7.056 -7.092 -9.389 1.00 0.00 H new ATOM 0 HA GLN A 86 7.160 -9.797 -10.432 1.00 0.00 H new ATOM 0 HB2 GLN A 86 5.043 -7.612 -10.517 1.00 0.00 H new ATOM 0 HB3 GLN A 86 4.810 -9.243 -11.114 1.00 0.00 H new ATOM 0 HG2 GLN A 86 5.589 -8.648 -8.243 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.920 -8.730 -8.774 1.00 0.00 H new ATOM 0 HE21 GLN A 86 4.602 -10.429 -6.823 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.762 -12.081 -7.429 1.00 0.00 H new ATOM 1283 N VAL A 87 7.384 -7.159 -12.359 1.00 0.00 N ATOM 1284 CA VAL A 87 7.692 -6.711 -13.711 1.00 0.00 C ATOM 1285 C VAL A 87 8.886 -5.764 -13.718 1.00 0.00 C ATOM 1286 O VAL A 87 9.072 -4.975 -12.791 1.00 0.00 O ATOM 1287 CB VAL A 87 6.485 -6.002 -14.356 1.00 0.00 C ATOM 1288 CG1 VAL A 87 6.925 -5.192 -15.566 1.00 0.00 C ATOM 1289 CG2 VAL A 87 5.417 -7.014 -14.741 1.00 0.00 C ATOM 0 H VAL A 87 7.359 -6.413 -11.663 1.00 0.00 H new ATOM 0 HA VAL A 87 7.935 -7.601 -14.291 1.00 0.00 H new ATOM 0 HB VAL A 87 6.056 -5.315 -13.626 1.00 0.00 H new ATOM 0 HG11 VAL A 87 6.059 -4.699 -16.008 1.00 0.00 H new ATOM 0 HG12 VAL A 87 7.652 -4.441 -15.256 1.00 0.00 H new ATOM 0 HG13 VAL A 87 7.380 -5.855 -16.302 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.572 -6.496 -15.195 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.831 -7.727 -15.454 1.00 0.00 H new ATOM 0 HG23 VAL A 87 5.081 -7.545 -13.850 1.00 0.00 H new ATOM 1299 N HIS A 88 9.695 -5.847 -14.770 1.00 0.00 N ATOM 1300 CA HIS A 88 10.872 -4.996 -14.899 1.00 0.00 C ATOM 1301 C HIS A 88 10.683 -3.971 -16.013 1.00 0.00 C ATOM 1302 O HIS A 88 9.941 -4.206 -16.965 1.00 0.00 O ATOM 1303 CB HIS A 88 12.113 -5.845 -15.176 1.00 0.00 C ATOM 1304 CG HIS A 88 12.806 -6.317 -13.935 1.00 0.00 C ATOM 1305 ND1 HIS A 88 12.851 -7.642 -13.556 1.00 0.00 N ATOM 1306 CD2 HIS A 88 13.485 -5.632 -12.985 1.00 0.00 C ATOM 1307 CE1 HIS A 88 13.526 -7.752 -12.426 1.00 0.00 C ATOM 1308 NE2 HIS A 88 13.922 -6.547 -12.058 1.00 0.00 N ATOM 0 H HIS A 88 9.557 -6.495 -15.545 1.00 0.00 H new ATOM 0 HA HIS A 88 11.008 -4.462 -13.958 1.00 0.00 H new ATOM 0 HB2 HIS A 88 11.825 -6.710 -15.773 1.00 0.00 H new ATOM 0 HB3 HIS A 88 12.814 -5.264 -15.775 1.00 0.00 H new ATOM 0 HD2 HIS A 88 13.652 -4.565 -12.960 1.00 0.00 H new ATOM 0 HE1 HIS A 88 13.721 -8.671 -11.893 1.00 0.00 H new ATOM 0 HE2 HIS A 88 14.464 -6.331 -11.222 1.00 0.00 H new ATOM 1317 N ASN A 89 11.359 -2.834 -15.885 1.00 0.00 N ATOM 1318 CA ASN A 89 11.264 -1.772 -16.881 1.00 0.00 C ATOM 1319 C ASN A 89 9.840 -1.232 -16.965 1.00 0.00 C ATOM 1320 O ASN A 89 9.324 -0.981 -18.054 1.00 0.00 O ATOM 1321 CB ASN A 89 11.708 -2.289 -18.251 1.00 0.00 C ATOM 1322 CG ASN A 89 11.893 -1.170 -19.258 1.00 0.00 C ATOM 1323 OD1 ASN A 89 10.955 -0.788 -19.958 1.00 0.00 O ATOM 1324 ND2 ASN A 89 13.108 -0.639 -19.336 1.00 0.00 N ATOM 0 H ASN A 89 11.978 -2.624 -15.102 1.00 0.00 H new ATOM 0 HA ASN A 89 11.924 -0.960 -16.575 1.00 0.00 H new ATOM 0 HB2 ASN A 89 12.644 -2.836 -18.144 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.968 -2.995 -18.628 1.00 0.00 H new ATOM 0 HD21 ASN A 89 13.293 0.117 -19.996 1.00 0.00 H new ATOM 0 HD22 ASN A 89 13.856 -0.987 -18.736 1.00 0.00 H new ATOM 1331 N ALA A 90 9.211 -1.053 -15.808 1.00 0.00 N ATOM 1332 CA ALA A 90 7.848 -0.540 -15.751 1.00 0.00 C ATOM 1333 C ALA A 90 7.703 0.512 -14.657 1.00 0.00 C ATOM 1334 O ALA A 90 8.607 0.706 -13.843 1.00 0.00 O ATOM 1335 CB ALA A 90 6.864 -1.678 -15.525 1.00 0.00 C ATOM 0 H ALA A 90 9.624 -1.256 -14.898 1.00 0.00 H new ATOM 0 HA ALA A 90 7.625 -0.066 -16.707 1.00 0.00 H new ATOM 0 HB1 ALA A 90 5.850 -1.280 -15.485 1.00 0.00 H new ATOM 0 HB2 ALA A 90 6.941 -2.393 -16.344 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.095 -2.178 -14.584 1.00 0.00 H new ATOM 1341 N THR A 91 6.560 1.192 -14.643 1.00 0.00 N ATOM 1342 CA THR A 91 6.298 2.226 -13.650 1.00 0.00 C ATOM 1343 C THR A 91 5.383 1.709 -12.546 1.00 0.00 C ATOM 1344 O THR A 91 4.218 1.390 -12.791 1.00 0.00 O ATOM 1345 CB THR A 91 5.657 3.471 -14.292 1.00 0.00 C ATOM 1346 OG1 THR A 91 4.704 3.075 -15.284 1.00 0.00 O ATOM 1347 CG2 THR A 91 6.717 4.359 -14.925 1.00 0.00 C ATOM 0 H THR A 91 5.801 1.045 -15.309 1.00 0.00 H new ATOM 0 HA THR A 91 7.261 2.503 -13.220 1.00 0.00 H new ATOM 0 HB THR A 91 5.152 4.037 -13.510 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.300 3.872 -15.686 1.00 0.00 H new ATOM 0 HG21 THR A 91 6.241 5.232 -15.372 1.00 0.00 H new ATOM 0 HG22 THR A 91 7.424 4.683 -14.161 1.00 0.00 H new ATOM 0 HG23 THR A 91 7.247 3.800 -15.696 1.00 0.00 H new ATOM 1355 N CYS A 92 5.915 1.629 -11.332 1.00 0.00 N ATOM 1356 CA CYS A 92 5.145 1.150 -10.190 1.00 0.00 C ATOM 1357 C CYS A 92 4.676 2.314 -9.323 1.00 0.00 C ATOM 1358 O CYS A 92 5.373 3.320 -9.185 1.00 0.00 O ATOM 1359 CB CYS A 92 5.982 0.181 -9.354 1.00 0.00 C ATOM 1360 SG CYS A 92 5.201 -0.320 -7.802 1.00 0.00 S ATOM 0 H CYS A 92 6.877 1.890 -11.113 1.00 0.00 H new ATOM 0 HA CYS A 92 4.267 0.627 -10.569 1.00 0.00 H new ATOM 0 HB2 CYS A 92 6.189 -0.709 -9.948 1.00 0.00 H new ATOM 0 HB3 CYS A 92 6.942 0.646 -9.131 1.00 0.00 H new ATOM 0 HG CYS A 92 3.992 -0.735 -8.039 1.00 0.00 H new ATOM 1366 N THR A 93 3.488 2.172 -8.742 1.00 0.00 N ATOM 1367 CA THR A 93 2.925 3.213 -7.892 1.00 0.00 C ATOM 1368 C THR A 93 2.653 2.687 -6.487 1.00 0.00 C ATOM 1369 O THR A 93 1.824 1.796 -6.296 1.00 0.00 O ATOM 1370 CB THR A 93 1.616 3.772 -8.481 1.00 0.00 C ATOM 1371 OG1 THR A 93 1.736 3.906 -9.902 1.00 0.00 O ATOM 1372 CG2 THR A 93 1.279 5.122 -7.866 1.00 0.00 C ATOM 0 H THR A 93 2.898 1.346 -8.845 1.00 0.00 H new ATOM 0 HA THR A 93 3.663 4.014 -7.841 1.00 0.00 H new ATOM 0 HB THR A 93 0.812 3.074 -8.249 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.899 4.260 -10.269 1.00 0.00 H new ATOM 0 HG21 THR A 93 0.351 5.497 -8.297 1.00 0.00 H new ATOM 0 HG22 THR A 93 1.160 5.011 -6.788 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.085 5.827 -8.071 1.00 0.00 H new ATOM 1380 N VAL A 94 3.354 3.245 -5.505 1.00 0.00 N ATOM 1381 CA VAL A 94 3.187 2.833 -4.117 1.00 0.00 C ATOM 1382 C VAL A 94 2.273 3.794 -3.365 1.00 0.00 C ATOM 1383 O VAL A 94 2.458 5.010 -3.414 1.00 0.00 O ATOM 1384 CB VAL A 94 4.541 2.754 -3.387 1.00 0.00 C ATOM 1385 CG1 VAL A 94 4.354 2.238 -1.969 1.00 0.00 C ATOM 1386 CG2 VAL A 94 5.511 1.873 -4.160 1.00 0.00 C ATOM 0 H VAL A 94 4.043 3.984 -5.646 1.00 0.00 H new ATOM 0 HA VAL A 94 2.734 1.842 -4.134 1.00 0.00 H new ATOM 0 HB VAL A 94 4.963 3.757 -3.330 1.00 0.00 H new ATOM 0 HG11 VAL A 94 5.321 2.189 -1.469 1.00 0.00 H new ATOM 0 HG12 VAL A 94 3.696 2.912 -1.420 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.911 1.243 -1.999 1.00 0.00 H new ATOM 0 HG21 VAL A 94 6.463 1.828 -3.631 1.00 0.00 H new ATOM 0 HG22 VAL A 94 5.098 0.868 -4.250 1.00 0.00 H new ATOM 0 HG23 VAL A 94 5.669 2.291 -5.154 1.00 0.00 H new ATOM 1396 N ARG A 95 1.285 3.241 -2.669 1.00 0.00 N ATOM 1397 CA ARG A 95 0.341 4.049 -1.907 1.00 0.00 C ATOM 1398 C ARG A 95 -0.115 3.313 -0.651 1.00 0.00 C ATOM 1399 O ARG A 95 -0.644 2.203 -0.727 1.00 0.00 O ATOM 1400 CB ARG A 95 -0.872 4.404 -2.770 1.00 0.00 C ATOM 1401 CG ARG A 95 -0.508 5.080 -4.082 1.00 0.00 C ATOM 1402 CD ARG A 95 -1.748 5.488 -4.862 1.00 0.00 C ATOM 1403 NE ARG A 95 -2.538 6.489 -4.149 1.00 0.00 N ATOM 1404 CZ ARG A 95 -3.587 7.109 -4.678 1.00 0.00 C ATOM 1405 NH1 ARG A 95 -3.971 6.833 -5.916 1.00 0.00 N ATOM 1406 NH2 ARG A 95 -4.255 8.008 -3.966 1.00 0.00 N ATOM 0 H ARG A 95 1.118 2.236 -2.617 1.00 0.00 H new ATOM 0 HA ARG A 95 0.847 4.967 -1.607 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -1.434 3.495 -2.983 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.531 5.061 -2.203 1.00 0.00 H new ATOM 0 HG2 ARG A 95 0.103 5.960 -3.882 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.096 4.403 -4.686 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -1.451 5.885 -5.833 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -2.363 4.608 -5.051 1.00 0.00 H new ATOM 0 HE ARG A 95 -2.270 6.724 -3.194 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.461 6.142 -6.466 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -4.777 7.311 -6.319 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -3.963 8.223 -3.013 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -5.060 8.484 -4.372 1.00 0.00 H new ATOM 1420 N ILE A 96 0.094 3.937 0.503 1.00 0.00 N ATOM 1421 CA ILE A 96 -0.295 3.342 1.775 1.00 0.00 C ATOM 1422 C ILE A 96 -1.399 4.152 2.446 1.00 0.00 C ATOM 1423 O ILE A 96 -1.449 5.375 2.321 1.00 0.00 O ATOM 1424 CB ILE A 96 0.904 3.233 2.736 1.00 0.00 C ATOM 1425 CG1 ILE A 96 2.156 2.789 1.977 1.00 0.00 C ATOM 1426 CG2 ILE A 96 0.591 2.264 3.866 1.00 0.00 C ATOM 1427 CD1 ILE A 96 3.357 2.568 2.870 1.00 0.00 C ATOM 0 H ILE A 96 0.531 4.855 0.583 1.00 0.00 H new ATOM 0 HA ILE A 96 -0.665 2.341 1.555 1.00 0.00 H new ATOM 0 HB ILE A 96 1.094 4.215 3.168 1.00 0.00 H new ATOM 0 HG12 ILE A 96 1.937 1.866 1.440 1.00 0.00 H new ATOM 0 HG13 ILE A 96 2.403 3.542 1.229 1.00 0.00 H new ATOM 0 HG21 ILE A 96 1.448 2.198 4.536 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.277 2.620 4.421 1.00 0.00 H new ATOM 0 HG23 ILE A 96 0.378 1.279 3.452 1.00 0.00 H new ATOM 0 HD11 ILE A 96 4.208 2.255 2.265 1.00 0.00 H new ATOM 0 HD12 ILE A 96 3.601 3.496 3.387 1.00 0.00 H new ATOM 0 HD13 ILE A 96 3.128 1.794 3.602 1.00 0.00 H new ATOM 1439 N ALA A 97 -2.281 3.461 3.161 1.00 0.00 N ATOM 1440 CA ALA A 97 -3.382 4.117 3.855 1.00 0.00 C ATOM 1441 C ALA A 97 -3.605 3.503 5.234 1.00 0.00 C ATOM 1442 O ALA A 97 -3.445 2.297 5.420 1.00 0.00 O ATOM 1443 CB ALA A 97 -4.655 4.031 3.026 1.00 0.00 C ATOM 0 H ALA A 97 -2.254 2.448 3.275 1.00 0.00 H new ATOM 0 HA ALA A 97 -3.120 5.166 3.990 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.469 4.525 3.557 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -4.498 4.522 2.065 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.912 2.985 2.861 1.00 0.00 H new ATOM 1449 N ALA A 98 -3.973 4.341 6.197 1.00 0.00 N ATOM 1450 CA ALA A 98 -4.218 3.881 7.558 1.00 0.00 C ATOM 1451 C ALA A 98 -5.590 3.226 7.677 1.00 0.00 C ATOM 1452 O ALA A 98 -6.603 3.808 7.288 1.00 0.00 O ATOM 1453 CB ALA A 98 -4.097 5.039 8.537 1.00 0.00 C ATOM 0 H ALA A 98 -4.108 5.343 6.060 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.464 3.133 7.803 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -4.283 4.680 9.549 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -3.093 5.461 8.480 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -4.828 5.807 8.284 1.00 0.00 H new ATOM 1459 N VAL A 99 -5.616 2.012 8.217 1.00 0.00 N ATOM 1460 CA VAL A 99 -6.865 1.278 8.388 1.00 0.00 C ATOM 1461 C VAL A 99 -7.216 1.126 9.864 1.00 0.00 C ATOM 1462 O VAL A 99 -6.382 0.719 10.674 1.00 0.00 O ATOM 1463 CB VAL A 99 -6.787 -0.119 7.744 1.00 0.00 C ATOM 1464 CG1 VAL A 99 -8.058 -0.907 8.023 1.00 0.00 C ATOM 1465 CG2 VAL A 99 -6.541 -0.002 6.247 1.00 0.00 C ATOM 0 H VAL A 99 -4.787 1.516 8.544 1.00 0.00 H new ATOM 0 HA VAL A 99 -7.643 1.857 7.890 1.00 0.00 H new ATOM 0 HB VAL A 99 -5.949 -0.658 8.186 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -7.985 -1.891 7.560 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -8.187 -1.021 9.099 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -8.914 -0.374 7.609 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.489 -0.998 5.808 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -7.357 0.555 5.787 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.601 0.521 6.073 1.00 0.00 H new ATOM 1475 N THR A 100 -8.456 1.456 10.209 1.00 0.00 N ATOM 1476 CA THR A 100 -8.919 1.357 11.587 1.00 0.00 C ATOM 1477 C THR A 100 -10.136 0.446 11.695 1.00 0.00 C ATOM 1478 O THR A 100 -10.643 -0.050 10.689 1.00 0.00 O ATOM 1479 CB THR A 100 -9.275 2.741 12.161 1.00 0.00 C ATOM 1480 OG1 THR A 100 -10.405 3.283 11.467 1.00 0.00 O ATOM 1481 CG2 THR A 100 -8.097 3.696 12.043 1.00 0.00 C ATOM 0 H THR A 100 -9.159 1.795 9.552 1.00 0.00 H new ATOM 0 HA THR A 100 -8.099 0.932 12.166 1.00 0.00 H new ATOM 0 HB THR A 100 -9.520 2.620 13.216 1.00 0.00 H new ATOM 0 HG1 THR A 100 -10.735 4.072 11.945 1.00 0.00 H new ATOM 0 HG21 THR A 100 -8.373 4.667 12.455 1.00 0.00 H new ATOM 0 HG22 THR A 100 -7.247 3.295 12.596 1.00 0.00 H new ATOM 0 HG23 THR A 100 -7.826 3.811 10.994 1.00 0.00 H new ATOM 1489 N ARG A 101 -10.601 0.230 12.921 1.00 0.00 N ATOM 1490 CA ARG A 101 -11.759 -0.622 13.160 1.00 0.00 C ATOM 1491 C ARG A 101 -13.048 0.084 12.749 1.00 0.00 C ATOM 1492 O ARG A 101 -14.144 -0.441 12.940 1.00 0.00 O ATOM 1493 CB ARG A 101 -11.831 -1.020 14.636 1.00 0.00 C ATOM 1494 CG ARG A 101 -11.079 -2.300 14.959 1.00 0.00 C ATOM 1495 CD ARG A 101 -11.528 -2.891 16.286 1.00 0.00 C ATOM 1496 NE ARG A 101 -12.888 -3.417 16.219 1.00 0.00 N ATOM 1497 CZ ARG A 101 -13.450 -4.128 17.190 1.00 0.00 C ATOM 1498 NH1 ARG A 101 -12.772 -4.395 18.298 1.00 0.00 N ATOM 1499 NH2 ARG A 101 -14.693 -4.572 17.055 1.00 0.00 N ATOM 0 H ARG A 101 -10.193 0.634 13.764 1.00 0.00 H new ATOM 0 HA ARG A 101 -11.648 -1.521 12.554 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -11.428 -0.209 15.242 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -12.876 -1.141 14.920 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -11.238 -3.027 14.163 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -10.009 -2.095 14.994 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -10.845 -3.689 16.577 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -11.473 -2.126 17.061 1.00 0.00 H new ATOM 0 HE ARG A 101 -13.437 -3.228 15.380 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -11.817 -4.054 18.406 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -13.206 -4.941 19.042 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -15.218 -4.367 16.205 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -15.123 -5.118 17.801 1.00 0.00 H new ATOM 1513 N GLY A 102 -12.908 1.280 12.184 1.00 0.00 N ATOM 1514 CA GLY A 102 -14.068 2.039 11.756 1.00 0.00 C ATOM 1515 C GLY A 102 -14.207 2.083 10.248 1.00 0.00 C ATOM 1516 O GLY A 102 -15.242 1.703 9.701 1.00 0.00 O ATOM 0 H GLY A 102 -12.011 1.736 12.015 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -14.966 1.598 12.188 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -13.995 3.056 12.141 1.00 0.00 H new ATOM 1520 N GLY A 103 -13.162 2.550 9.571 1.00 0.00 N ATOM 1521 CA GLY A 103 -13.194 2.636 8.123 1.00 0.00 C ATOM 1522 C GLY A 103 -11.836 2.956 7.531 1.00 0.00 C ATOM 1523 O GLY A 103 -10.932 3.404 8.238 1.00 0.00 O ATOM 0 H GLY A 103 -12.294 2.870 10.000 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -13.552 1.691 7.714 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -13.908 3.404 7.823 1.00 0.00 H new ATOM 1527 N VAL A 104 -11.689 2.725 6.231 1.00 0.00 N ATOM 1528 CA VAL A 104 -10.431 2.992 5.544 1.00 0.00 C ATOM 1529 C VAL A 104 -10.340 4.450 5.108 1.00 0.00 C ATOM 1530 O VAL A 104 -11.299 5.011 4.579 1.00 0.00 O ATOM 1531 CB VAL A 104 -10.263 2.087 4.309 1.00 0.00 C ATOM 1532 CG1 VAL A 104 -11.333 2.395 3.272 1.00 0.00 C ATOM 1533 CG2 VAL A 104 -8.872 2.249 3.715 1.00 0.00 C ATOM 0 H VAL A 104 -12.426 2.353 5.632 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.632 2.778 6.254 1.00 0.00 H new ATOM 0 HB VAL A 104 -10.381 1.050 4.622 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -11.198 1.746 2.407 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -12.319 2.224 3.704 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -11.249 3.436 2.961 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.771 1.602 2.843 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -8.723 3.287 3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.124 1.974 4.459 1.00 0.00 H new ATOM 1543 N GLY A 105 -9.180 5.059 5.335 1.00 0.00 N ATOM 1544 CA GLY A 105 -8.985 6.447 4.960 1.00 0.00 C ATOM 1545 C GLY A 105 -8.295 6.594 3.618 1.00 0.00 C ATOM 1546 O GLY A 105 -7.963 5.610 2.956 1.00 0.00 O ATOM 0 H GLY A 105 -8.372 4.616 5.772 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.951 6.950 4.925 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -8.393 6.947 5.726 1.00 0.00 H new ATOM 1550 N PRO A 106 -8.073 7.847 3.197 1.00 0.00 N ATOM 1551 CA PRO A 106 -7.417 8.149 1.921 1.00 0.00 C ATOM 1552 C PRO A 106 -5.936 7.784 1.929 1.00 0.00 C ATOM 1553 O PRO A 106 -5.242 7.989 2.925 1.00 0.00 O ATOM 1554 CB PRO A 106 -7.594 9.663 1.780 1.00 0.00 C ATOM 1555 CG PRO A 106 -7.738 10.159 3.177 1.00 0.00 C ATOM 1556 CD PRO A 106 -8.443 9.067 3.934 1.00 0.00 C ATOM 0 HA PRO A 106 -7.846 7.578 1.098 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.736 10.118 1.285 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -8.472 9.905 1.181 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -6.764 10.373 3.617 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -8.311 11.086 3.205 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -8.117 9.023 4.973 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -9.522 9.218 3.945 1.00 0.00 H new ATOM 1564 N PHE A 107 -5.459 7.243 0.813 1.00 0.00 N ATOM 1565 CA PHE A 107 -4.060 6.849 0.693 1.00 0.00 C ATOM 1566 C PHE A 107 -3.150 8.074 0.675 1.00 0.00 C ATOM 1567 O PHE A 107 -3.597 9.190 0.410 1.00 0.00 O ATOM 1568 CB PHE A 107 -3.848 6.024 -0.578 1.00 0.00 C ATOM 1569 CG PHE A 107 -4.391 4.627 -0.484 1.00 0.00 C ATOM 1570 CD1 PHE A 107 -5.745 4.408 -0.283 1.00 0.00 C ATOM 1571 CD2 PHE A 107 -3.549 3.533 -0.596 1.00 0.00 C ATOM 1572 CE1 PHE A 107 -6.247 3.124 -0.195 1.00 0.00 C ATOM 1573 CE2 PHE A 107 -4.046 2.246 -0.509 1.00 0.00 C ATOM 1574 CZ PHE A 107 -5.397 2.041 -0.309 1.00 0.00 C ATOM 0 H PHE A 107 -6.020 7.067 -0.021 1.00 0.00 H new ATOM 0 HA PHE A 107 -3.804 6.240 1.560 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.323 6.534 -1.416 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -2.781 5.977 -0.797 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -6.415 5.251 -0.194 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -2.492 3.687 -0.753 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -7.304 2.967 -0.037 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -3.378 1.402 -0.597 1.00 0.00 H new ATOM 0 HZ PHE A 107 -5.788 1.037 -0.242 1.00 0.00 H new ATOM 1584 N SER A 108 -1.870 7.857 0.960 1.00 0.00 N ATOM 1585 CA SER A 108 -0.896 8.942 0.982 1.00 0.00 C ATOM 1586 C SER A 108 -0.490 9.336 -0.435 1.00 0.00 C ATOM 1587 O SER A 108 -1.014 8.803 -1.414 1.00 0.00 O ATOM 1588 CB SER A 108 0.340 8.531 1.783 1.00 0.00 C ATOM 1589 OG SER A 108 1.096 7.554 1.089 1.00 0.00 O ATOM 0 H SER A 108 -1.483 6.939 1.179 1.00 0.00 H new ATOM 0 HA SER A 108 -1.360 9.804 1.462 1.00 0.00 H new ATOM 0 HB2 SER A 108 0.960 9.406 1.975 1.00 0.00 H new ATOM 0 HB3 SER A 108 0.035 8.138 2.753 1.00 0.00 H new ATOM 0 HG SER A 108 1.290 6.804 1.689 1.00 0.00 H new ATOM 1595 N ASP A 109 0.447 10.272 -0.537 1.00 0.00 N ATOM 1596 CA ASP A 109 0.926 10.738 -1.833 1.00 0.00 C ATOM 1597 C ASP A 109 1.561 9.595 -2.620 1.00 0.00 C ATOM 1598 O ASP A 109 2.480 8.922 -2.152 1.00 0.00 O ATOM 1599 CB ASP A 109 1.936 11.871 -1.650 1.00 0.00 C ATOM 1600 CG ASP A 109 2.819 11.670 -0.435 1.00 0.00 C ATOM 1601 OD1 ASP A 109 3.194 10.511 -0.159 1.00 0.00 O ATOM 1602 OD2 ASP A 109 3.136 12.671 0.240 1.00 0.00 O ATOM 0 H ASP A 109 0.890 10.723 0.263 1.00 0.00 H new ATOM 0 HA ASP A 109 0.071 11.112 -2.396 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.560 11.945 -2.541 1.00 0.00 H new ATOM 0 HB3 ASP A 109 1.403 12.817 -1.555 1.00 0.00 H new ATOM 1607 N PRO A 110 1.061 9.370 -3.844 1.00 0.00 N ATOM 1608 CA PRO A 110 1.564 8.309 -4.722 1.00 0.00 C ATOM 1609 C PRO A 110 2.967 8.604 -5.242 1.00 0.00 C ATOM 1610 O PRO A 110 3.248 9.709 -5.706 1.00 0.00 O ATOM 1611 CB PRO A 110 0.558 8.295 -5.875 1.00 0.00 C ATOM 1612 CG PRO A 110 -0.012 9.671 -5.896 1.00 0.00 C ATOM 1613 CD PRO A 110 -0.034 10.133 -4.466 1.00 0.00 C ATOM 0 HA PRO A 110 1.649 7.355 -4.201 1.00 0.00 H new ATOM 0 HB2 PRO A 110 1.043 8.053 -6.821 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.218 7.547 -5.714 1.00 0.00 H new ATOM 0 HG2 PRO A 110 0.595 10.335 -6.511 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.016 9.671 -6.321 1.00 0.00 H new ATOM 0 HD2 PRO A 110 0.130 11.208 -4.388 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -0.992 9.922 -3.990 1.00 0.00 H new ATOM 1621 N VAL A 111 3.844 7.609 -5.163 1.00 0.00 N ATOM 1622 CA VAL A 111 5.218 7.761 -5.627 1.00 0.00 C ATOM 1623 C VAL A 111 5.505 6.839 -6.807 1.00 0.00 C ATOM 1624 O VAL A 111 5.519 5.616 -6.664 1.00 0.00 O ATOM 1625 CB VAL A 111 6.227 7.466 -4.502 1.00 0.00 C ATOM 1626 CG1 VAL A 111 7.584 7.101 -5.084 1.00 0.00 C ATOM 1627 CG2 VAL A 111 6.343 8.659 -3.565 1.00 0.00 C ATOM 0 H VAL A 111 3.627 6.688 -4.782 1.00 0.00 H new ATOM 0 HA VAL A 111 5.332 8.798 -5.944 1.00 0.00 H new ATOM 0 HB VAL A 111 5.865 6.614 -3.926 1.00 0.00 H new ATOM 0 HG11 VAL A 111 8.284 6.896 -4.274 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.485 6.215 -5.711 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.957 7.930 -5.685 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.060 8.433 -2.776 1.00 0.00 H new ATOM 0 HG22 VAL A 111 6.682 9.530 -4.125 1.00 0.00 H new ATOM 0 HG23 VAL A 111 5.370 8.869 -3.122 1.00 0.00 H new ATOM 1637 N LYS A 112 5.733 7.433 -7.973 1.00 0.00 N ATOM 1638 CA LYS A 112 6.022 6.666 -9.179 1.00 0.00 C ATOM 1639 C LYS A 112 7.508 6.334 -9.270 1.00 0.00 C ATOM 1640 O LYS A 112 8.333 7.207 -9.541 1.00 0.00 O ATOM 1641 CB LYS A 112 5.586 7.447 -10.421 1.00 0.00 C ATOM 1642 CG LYS A 112 5.851 6.713 -11.725 1.00 0.00 C ATOM 1643 CD LYS A 112 5.134 7.372 -12.891 1.00 0.00 C ATOM 1644 CE LYS A 112 6.005 8.427 -13.556 1.00 0.00 C ATOM 1645 NZ LYS A 112 5.963 9.723 -12.824 1.00 0.00 N ATOM 0 H LYS A 112 5.723 8.444 -8.109 1.00 0.00 H new ATOM 0 HA LYS A 112 5.462 5.732 -9.129 1.00 0.00 H new ATOM 0 HB2 LYS A 112 4.521 7.666 -10.347 1.00 0.00 H new ATOM 0 HB3 LYS A 112 6.108 8.404 -10.440 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.923 6.692 -11.921 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.524 5.677 -11.634 1.00 0.00 H new ATOM 0 HD2 LYS A 112 4.855 6.614 -13.623 1.00 0.00 H new ATOM 0 HD3 LYS A 112 4.210 7.831 -12.539 1.00 0.00 H new ATOM 0 HE2 LYS A 112 7.034 8.071 -13.604 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.672 8.579 -14.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.173 10.500 -13.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 5.016 9.861 -12.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.671 9.714 -12.062 1.00 0.00 H new ATOM 1659 N ILE A 113 7.841 5.068 -9.043 1.00 0.00 N ATOM 1660 CA ILE A 113 9.227 4.621 -9.102 1.00 0.00 C ATOM 1661 C ILE A 113 9.501 3.844 -10.386 1.00 0.00 C ATOM 1662 O ILE A 113 8.728 2.966 -10.769 1.00 0.00 O ATOM 1663 CB ILE A 113 9.586 3.735 -7.894 1.00 0.00 C ATOM 1664 CG1 ILE A 113 10.940 3.058 -8.114 1.00 0.00 C ATOM 1665 CG2 ILE A 113 8.500 2.696 -7.659 1.00 0.00 C ATOM 1666 CD1 ILE A 113 11.677 2.750 -6.830 1.00 0.00 C ATOM 0 H ILE A 113 7.170 4.334 -8.817 1.00 0.00 H new ATOM 0 HA ILE A 113 9.847 5.517 -9.082 1.00 0.00 H new ATOM 0 HB ILE A 113 9.657 4.366 -7.008 1.00 0.00 H new ATOM 0 HG12 ILE A 113 10.788 2.131 -8.667 1.00 0.00 H new ATOM 0 HG13 ILE A 113 11.562 3.702 -8.735 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.768 2.077 -6.802 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.553 3.198 -7.462 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.401 2.067 -8.544 1.00 0.00 H new ATOM 0 HD11 ILE A 113 12.628 2.271 -7.062 1.00 0.00 H new ATOM 0 HD12 ILE A 113 11.861 3.676 -6.285 1.00 0.00 H new ATOM 0 HD13 ILE A 113 11.074 2.081 -6.216 1.00 0.00 H new ATOM 1678 N PHE A 114 10.606 4.173 -11.046 1.00 0.00 N ATOM 1679 CA PHE A 114 10.983 3.506 -12.287 1.00 0.00 C ATOM 1680 C PHE A 114 11.751 2.219 -12.001 1.00 0.00 C ATOM 1681 O PHE A 114 12.823 2.246 -11.396 1.00 0.00 O ATOM 1682 CB PHE A 114 11.831 4.438 -13.155 1.00 0.00 C ATOM 1683 CG PHE A 114 12.635 3.718 -14.200 1.00 0.00 C ATOM 1684 CD1 PHE A 114 13.836 3.111 -13.872 1.00 0.00 C ATOM 1685 CD2 PHE A 114 12.189 3.649 -15.510 1.00 0.00 C ATOM 1686 CE1 PHE A 114 14.578 2.447 -14.831 1.00 0.00 C ATOM 1687 CE2 PHE A 114 12.926 2.986 -16.472 1.00 0.00 C ATOM 1688 CZ PHE A 114 14.123 2.386 -16.133 1.00 0.00 C ATOM 0 H PHE A 114 11.256 4.898 -10.742 1.00 0.00 H new ATOM 0 HA PHE A 114 10.070 3.251 -12.825 1.00 0.00 H new ATOM 0 HB2 PHE A 114 11.177 5.160 -13.645 1.00 0.00 H new ATOM 0 HB3 PHE A 114 12.507 5.004 -12.514 1.00 0.00 H new ATOM 0 HD1 PHE A 114 14.197 3.157 -12.855 1.00 0.00 H new ATOM 0 HD2 PHE A 114 11.255 4.119 -15.782 1.00 0.00 H new ATOM 0 HE1 PHE A 114 15.512 1.977 -14.562 1.00 0.00 H new ATOM 0 HE2 PHE A 114 12.566 2.937 -17.489 1.00 0.00 H new ATOM 0 HZ PHE A 114 14.702 1.870 -16.885 1.00 0.00 H new ATOM 1698 N ILE A 115 11.195 1.095 -12.441 1.00 0.00 N ATOM 1699 CA ILE A 115 11.827 -0.201 -12.233 1.00 0.00 C ATOM 1700 C ILE A 115 12.893 -0.469 -13.290 1.00 0.00 C ATOM 1701 O ILE A 115 12.599 -0.646 -14.472 1.00 0.00 O ATOM 1702 CB ILE A 115 10.794 -1.343 -12.261 1.00 0.00 C ATOM 1703 CG1 ILE A 115 9.546 -0.951 -11.467 1.00 0.00 C ATOM 1704 CG2 ILE A 115 11.402 -2.622 -11.705 1.00 0.00 C ATOM 1705 CD1 ILE A 115 9.769 -0.916 -9.971 1.00 0.00 C ATOM 0 H ILE A 115 10.308 1.056 -12.944 1.00 0.00 H new ATOM 0 HA ILE A 115 12.294 -0.169 -11.249 1.00 0.00 H new ATOM 0 HB ILE A 115 10.502 -1.523 -13.296 1.00 0.00 H new ATOM 0 HG12 ILE A 115 9.207 0.030 -11.799 1.00 0.00 H new ATOM 0 HG13 ILE A 115 8.746 -1.657 -11.691 1.00 0.00 H new ATOM 0 HG21 ILE A 115 10.659 -3.419 -11.732 1.00 0.00 H new ATOM 0 HG22 ILE A 115 12.263 -2.908 -12.309 1.00 0.00 H new ATOM 0 HG23 ILE A 115 11.720 -2.456 -10.676 1.00 0.00 H new ATOM 0 HD11 ILE A 115 8.843 -0.631 -9.472 1.00 0.00 H new ATOM 0 HD12 ILE A 115 10.078 -1.903 -9.626 1.00 0.00 H new ATOM 0 HD13 ILE A 115 10.547 -0.189 -9.736 1.00 0.00 H new ATOM 1717 N PRO A 116 14.162 -0.501 -12.857 1.00 0.00 N ATOM 1718 CA PRO A 116 15.297 -0.749 -13.750 1.00 0.00 C ATOM 1719 C PRO A 116 15.332 -2.186 -14.258 1.00 0.00 C ATOM 1720 O PRO A 116 15.337 -3.133 -13.472 1.00 0.00 O ATOM 1721 CB PRO A 116 16.514 -0.466 -12.864 1.00 0.00 C ATOM 1722 CG PRO A 116 16.033 -0.704 -11.474 1.00 0.00 C ATOM 1723 CD PRO A 116 14.585 -0.298 -11.461 1.00 0.00 C ATOM 0 HA PRO A 116 15.252 -0.131 -14.647 1.00 0.00 H new ATOM 0 HB2 PRO A 116 17.347 -1.124 -13.113 1.00 0.00 H new ATOM 0 HB3 PRO A 116 16.867 0.557 -12.991 1.00 0.00 H new ATOM 0 HG2 PRO A 116 16.147 -1.752 -11.196 1.00 0.00 H new ATOM 0 HG3 PRO A 116 16.609 -0.119 -10.756 1.00 0.00 H new ATOM 0 HD2 PRO A 116 14.002 -0.909 -10.772 1.00 0.00 H new ATOM 0 HD3 PRO A 116 14.461 0.739 -11.150 1.00 0.00 H new ATOM 1731 N ALA A 117 15.355 -2.341 -15.578 1.00 0.00 N ATOM 1732 CA ALA A 117 15.392 -3.663 -16.191 1.00 0.00 C ATOM 1733 C ALA A 117 16.390 -4.571 -15.480 1.00 0.00 C ATOM 1734 O ALA A 117 17.332 -4.097 -14.845 1.00 0.00 O ATOM 1735 CB ALA A 117 15.737 -3.550 -17.669 1.00 0.00 C ATOM 0 H ALA A 117 15.349 -1.568 -16.243 1.00 0.00 H new ATOM 0 HA ALA A 117 14.402 -4.109 -16.093 1.00 0.00 H new ATOM 0 HB1 ALA A 117 15.761 -4.545 -18.114 1.00 0.00 H new ATOM 0 HB2 ALA A 117 14.983 -2.945 -18.173 1.00 0.00 H new ATOM 0 HB3 ALA A 117 16.714 -3.079 -17.780 1.00 0.00 H new ATOM 1741 N HIS A 118 16.178 -5.878 -15.591 1.00 0.00 N ATOM 1742 CA HIS A 118 17.060 -6.853 -14.959 1.00 0.00 C ATOM 1743 C HIS A 118 18.326 -7.057 -15.786 1.00 0.00 C ATOM 1744 O HIS A 118 18.292 -7.685 -16.844 1.00 0.00 O ATOM 1745 CB HIS A 118 16.334 -8.186 -14.777 1.00 0.00 C ATOM 1746 CG HIS A 118 17.259 -9.352 -14.602 1.00 0.00 C ATOM 1747 ND1 HIS A 118 16.916 -10.642 -14.947 1.00 0.00 N ATOM 1748 CD2 HIS A 118 18.521 -9.416 -14.117 1.00 0.00 C ATOM 1749 CE1 HIS A 118 17.927 -11.450 -14.679 1.00 0.00 C ATOM 1750 NE2 HIS A 118 18.913 -10.730 -14.176 1.00 0.00 N ATOM 0 H HIS A 118 15.403 -6.287 -16.113 1.00 0.00 H new ATOM 0 HA HIS A 118 17.346 -6.467 -13.980 1.00 0.00 H new ATOM 0 HB2 HIS A 118 15.679 -8.118 -13.908 1.00 0.00 H new ATOM 0 HB3 HIS A 118 15.697 -8.365 -15.643 1.00 0.00 H new ATOM 0 HD2 HIS A 118 19.110 -8.588 -13.752 1.00 0.00 H new ATOM 0 HE1 HIS A 118 17.944 -12.517 -14.843 1.00 0.00 H new ATOM 0 HE2 HIS A 118 19.819 -11.092 -13.879 1.00 0.00 H new ATOM 1759 N SER A 119 19.440 -6.523 -15.296 1.00 0.00 N ATOM 1760 CA SER A 119 20.715 -6.643 -15.992 1.00 0.00 C ATOM 1761 C SER A 119 21.873 -6.699 -15.000 1.00 0.00 C ATOM 1762 O SER A 119 21.997 -5.843 -14.125 1.00 0.00 O ATOM 1763 CB SER A 119 20.909 -5.468 -16.953 1.00 0.00 C ATOM 1764 OG SER A 119 21.284 -4.294 -16.253 1.00 0.00 O ATOM 0 H SER A 119 19.485 -6.003 -14.420 1.00 0.00 H new ATOM 0 HA SER A 119 20.703 -7.572 -16.562 1.00 0.00 H new ATOM 0 HB2 SER A 119 21.675 -5.717 -17.688 1.00 0.00 H new ATOM 0 HB3 SER A 119 19.986 -5.288 -17.503 1.00 0.00 H new ATOM 0 HG SER A 119 21.659 -4.539 -15.381 1.00 0.00 H new ATOM 1770 N GLY A 120 22.719 -7.714 -15.144 1.00 0.00 N ATOM 1771 CA GLY A 120 23.855 -7.865 -14.254 1.00 0.00 C ATOM 1772 C GLY A 120 23.785 -9.138 -13.434 1.00 0.00 C ATOM 1773 O GLY A 120 22.709 -9.596 -13.050 1.00 0.00 O ATOM 0 H GLY A 120 22.638 -8.435 -15.861 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.774 -7.864 -14.840 1.00 0.00 H new ATOM 0 HA3 GLY A 120 23.904 -7.007 -13.584 1.00 0.00 H new ATOM 1777 N PRO A 121 24.955 -9.732 -13.155 1.00 0.00 N ATOM 1778 CA PRO A 121 25.048 -10.969 -12.374 1.00 0.00 C ATOM 1779 C PRO A 121 24.695 -10.755 -10.906 1.00 0.00 C ATOM 1780 O PRO A 121 24.288 -9.664 -10.508 1.00 0.00 O ATOM 1781 CB PRO A 121 26.519 -11.369 -12.517 1.00 0.00 C ATOM 1782 CG PRO A 121 27.234 -10.091 -12.791 1.00 0.00 C ATOM 1783 CD PRO A 121 26.277 -9.241 -13.581 1.00 0.00 C ATOM 0 HA PRO A 121 24.349 -11.728 -12.727 1.00 0.00 H new ATOM 0 HB2 PRO A 121 26.890 -11.844 -11.609 1.00 0.00 H new ATOM 0 HB3 PRO A 121 26.658 -12.083 -13.329 1.00 0.00 H new ATOM 0 HG2 PRO A 121 27.519 -9.597 -11.862 1.00 0.00 H new ATOM 0 HG3 PRO A 121 28.151 -10.270 -13.352 1.00 0.00 H new ATOM 0 HD2 PRO A 121 26.403 -8.181 -13.359 1.00 0.00 H new ATOM 0 HD3 PRO A 121 26.424 -9.362 -14.654 1.00 0.00 H new ATOM 1791 N SER A 122 24.854 -11.804 -10.105 1.00 0.00 N ATOM 1792 CA SER A 122 24.549 -11.732 -8.681 1.00 0.00 C ATOM 1793 C SER A 122 25.745 -12.178 -7.846 1.00 0.00 C ATOM 1794 O SER A 122 26.137 -13.344 -7.876 1.00 0.00 O ATOM 1795 CB SER A 122 23.332 -12.600 -8.355 1.00 0.00 C ATOM 1796 OG SER A 122 22.139 -12.012 -8.843 1.00 0.00 O ATOM 0 H SER A 122 25.192 -12.714 -10.418 1.00 0.00 H new ATOM 0 HA SER A 122 24.323 -10.695 -8.434 1.00 0.00 H new ATOM 0 HB2 SER A 122 23.459 -13.589 -8.794 1.00 0.00 H new ATOM 0 HB3 SER A 122 23.258 -12.737 -7.276 1.00 0.00 H new ATOM 0 HG SER A 122 21.377 -12.587 -8.623 1.00 0.00 H new ATOM 1802 N SER A 123 26.320 -11.240 -7.100 1.00 0.00 N ATOM 1803 CA SER A 123 27.474 -11.534 -6.259 1.00 0.00 C ATOM 1804 C SER A 123 27.116 -12.552 -5.181 1.00 0.00 C ATOM 1805 O SER A 123 25.941 -12.810 -4.921 1.00 0.00 O ATOM 1806 CB SER A 123 27.999 -10.251 -5.610 1.00 0.00 C ATOM 1807 OG SER A 123 26.966 -9.571 -4.917 1.00 0.00 O ATOM 0 H SER A 123 26.006 -10.270 -7.061 1.00 0.00 H new ATOM 0 HA SER A 123 28.254 -11.959 -6.891 1.00 0.00 H new ATOM 0 HB2 SER A 123 28.807 -10.493 -4.919 1.00 0.00 H new ATOM 0 HB3 SER A 123 28.419 -9.598 -6.375 1.00 0.00 H new ATOM 0 HG SER A 123 27.327 -8.756 -4.510 1.00 0.00 H new ATOM 1813 N GLY A 124 28.138 -13.129 -4.557 1.00 0.00 N ATOM 1814 CA GLY A 124 27.911 -14.113 -3.514 1.00 0.00 C ATOM 1815 C GLY A 124 28.589 -13.743 -2.210 1.00 0.00 C ATOM 1816 O GLY A 124 29.500 -12.916 -2.189 1.00 0.00 O ATOM 0 H GLY A 124 29.119 -12.933 -4.755 1.00 0.00 H new ATOM 0 HA2 GLY A 124 26.839 -14.218 -3.345 1.00 0.00 H new ATOM 0 HA3 GLY A 124 28.278 -15.083 -3.848 1.00 0.00 H new TER 1820 GLY A 124