USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 927 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 52 ASN : amide:sc= -1.71 K(o=-2,f=-6.9!) USER MOD Set 1.2: A 54 ASN : amide:sc= -0.284 X(o=-2,f=-1.9) USER MOD Set 2.1: A 32 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -58:sc= 0.173 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 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc=-0.00126 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0.0783 USER MOD Single : A 35 HIS : no HD1:sc= -0.525 X(o=-0.53,f=-0.12) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -163:sc= -2.67 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -1.05 X(o=-1.1,f=-0.89) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 29:sc= 0.0982 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= -0.314 X(o=-0.31,f=-0.4) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -120:sc= -0.0091 (180deg=-0.0169) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -0.451 X(o=-0.45,f=-0.45) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -1.52! X(o=-1.5!,f=-1.8) USER MOD Single : A 91 SER OG : rot -170:sc= -0.533 USER MOD Single : A 92 SER OG : rot 8:sc= 0.196 USER MOD Single : A 93 HIS : no HE2:sc= -0.883 K(o=-0.88,f=-0.16) USER MOD Single : A 94 TYR OH : rot 180:sc= -1.04 USER MOD Single : A 97 THR OG1 : rot 34:sc= -0.846 USER MOD Single : A 99 LYS NZ :NH3+ -132:sc= 0.41 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -2.45! C(o=-2.4!,f=-14!) USER MOD Single : A 103 ASN : amide:sc= -5.41! C(o=-5.4!,f=-12!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -129:sc= 0.355 USER MOD Single : A 119 HIS : no HD1:sc= -0.174 X(o=-0.17,f=-0.12) USER MOD Single : A 120 THR OG1 : rot 37:sc= 0.323 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.519 12.984 19.903 1.00 0.00 N ATOM 2 CA GLY A 1 16.567 13.945 20.430 1.00 0.00 C ATOM 3 C GLY A 1 15.433 13.283 21.186 1.00 0.00 C ATOM 4 O GLY A 1 15.212 13.569 22.363 1.00 0.00 O ATOM 0 H1 GLY A 1 18.275 13.487 19.395 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.932 12.439 20.687 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.033 12.337 19.249 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.085 14.639 21.092 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.157 14.534 19.609 1.00 0.00 H new ATOM 8 N SER A 2 14.710 12.396 20.509 1.00 0.00 N ATOM 9 CA SER A 2 13.589 11.696 21.123 1.00 0.00 C ATOM 10 C SER A 2 12.602 12.683 21.737 1.00 0.00 C ATOM 11 O SER A 2 12.099 12.470 22.840 1.00 0.00 O ATOM 12 CB SER A 2 14.091 10.725 22.194 1.00 0.00 C ATOM 13 OG SER A 2 13.076 9.809 22.568 1.00 0.00 O ATOM 0 H SER A 2 14.881 12.146 19.535 1.00 0.00 H new ATOM 0 HA SER A 2 13.075 11.132 20.345 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.957 10.180 21.818 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.422 11.284 23.070 1.00 0.00 H new ATOM 0 HG SER A 2 12.295 10.302 22.896 1.00 0.00 H new ATOM 19 N SER A 3 12.329 13.765 21.015 1.00 0.00 N ATOM 20 CA SER A 3 11.406 14.789 21.489 1.00 0.00 C ATOM 21 C SER A 3 10.110 14.767 20.684 1.00 0.00 C ATOM 22 O SER A 3 9.998 15.422 19.649 1.00 0.00 O ATOM 23 CB SER A 3 12.053 16.172 21.398 1.00 0.00 C ATOM 24 OG SER A 3 11.121 17.193 21.710 1.00 0.00 O ATOM 0 H SER A 3 12.734 13.955 20.099 1.00 0.00 H new ATOM 0 HA SER A 3 11.170 14.575 22.531 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.900 16.227 22.082 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.445 16.328 20.393 1.00 0.00 H new ATOM 0 HG SER A 3 11.560 18.067 21.646 1.00 0.00 H new ATOM 30 N GLY A 4 9.132 14.008 21.169 1.00 0.00 N ATOM 31 CA GLY A 4 7.856 13.914 20.483 1.00 0.00 C ATOM 32 C GLY A 4 8.014 13.629 19.003 1.00 0.00 C ATOM 33 O GLY A 4 9.131 13.467 18.510 1.00 0.00 O ATOM 0 H GLY A 4 9.200 13.457 22.024 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.258 13.125 20.940 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.307 14.846 20.614 1.00 0.00 H new ATOM 37 N SER A 5 6.893 13.566 18.291 1.00 0.00 N ATOM 38 CA SER A 5 6.911 13.293 16.859 1.00 0.00 C ATOM 39 C SER A 5 7.478 14.480 16.086 1.00 0.00 C ATOM 40 O SER A 5 7.181 15.635 16.395 1.00 0.00 O ATOM 41 CB SER A 5 5.501 12.973 16.361 1.00 0.00 C ATOM 42 OG SER A 5 5.084 11.691 16.797 1.00 0.00 O ATOM 0 H SER A 5 5.961 13.700 18.683 1.00 0.00 H new ATOM 0 HA SER A 5 7.554 12.430 16.688 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.804 13.728 16.724 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.478 13.015 15.272 1.00 0.00 H new ATOM 0 HG SER A 5 4.179 11.512 16.467 1.00 0.00 H new ATOM 48 N SER A 6 8.297 14.188 15.081 1.00 0.00 N ATOM 49 CA SER A 6 8.909 15.231 14.266 1.00 0.00 C ATOM 50 C SER A 6 8.034 15.563 13.061 1.00 0.00 C ATOM 51 O SER A 6 7.864 14.745 12.158 1.00 0.00 O ATOM 52 CB SER A 6 10.297 14.791 13.796 1.00 0.00 C ATOM 53 OG SER A 6 11.152 14.537 14.897 1.00 0.00 O ATOM 0 H SER A 6 8.552 13.238 14.811 1.00 0.00 H new ATOM 0 HA SER A 6 9.007 16.126 14.880 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.209 13.893 13.185 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.733 15.565 13.164 1.00 0.00 H new ATOM 0 HG SER A 6 12.032 14.256 14.570 1.00 0.00 H new ATOM 59 N GLY A 7 7.479 16.772 13.056 1.00 0.00 N ATOM 60 CA GLY A 7 6.628 17.192 11.959 1.00 0.00 C ATOM 61 C GLY A 7 5.596 16.145 11.591 1.00 0.00 C ATOM 62 O GLY A 7 5.792 15.345 10.676 1.00 0.00 O ATOM 0 H GLY A 7 7.604 17.467 13.792 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.121 18.118 12.231 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.245 17.411 11.088 1.00 0.00 H new ATOM 66 N PRO A 8 4.468 16.139 12.316 1.00 0.00 N ATOM 67 CA PRO A 8 3.380 15.186 12.079 1.00 0.00 C ATOM 68 C PRO A 8 2.651 15.451 10.767 1.00 0.00 C ATOM 69 O PRO A 8 1.834 14.644 10.325 1.00 0.00 O ATOM 70 CB PRO A 8 2.442 15.416 13.267 1.00 0.00 C ATOM 71 CG PRO A 8 2.709 16.818 13.694 1.00 0.00 C ATOM 72 CD PRO A 8 4.167 17.064 13.422 1.00 0.00 C ATOM 0 HA PRO A 8 3.746 14.163 11.998 1.00 0.00 H new ATOM 0 HB2 PRO A 8 1.399 15.281 12.980 1.00 0.00 H new ATOM 0 HB3 PRO A 8 2.644 14.711 14.073 1.00 0.00 H new ATOM 0 HG2 PRO A 8 2.085 17.520 13.141 1.00 0.00 H new ATOM 0 HG3 PRO A 8 2.481 16.954 14.751 1.00 0.00 H new ATOM 0 HD2 PRO A 8 4.354 18.100 13.141 1.00 0.00 H new ATOM 0 HD3 PRO A 8 4.780 16.855 14.299 1.00 0.00 H new ATOM 80 N ALA A 9 2.952 16.588 10.148 1.00 0.00 N ATOM 81 CA ALA A 9 2.327 16.959 8.884 1.00 0.00 C ATOM 82 C ALA A 9 2.309 15.782 7.915 1.00 0.00 C ATOM 83 O ALA A 9 3.356 15.240 7.559 1.00 0.00 O ATOM 84 CB ALA A 9 3.052 18.144 8.264 1.00 0.00 C ATOM 0 H ALA A 9 3.625 17.268 10.501 1.00 0.00 H new ATOM 0 HA ALA A 9 1.295 17.245 9.088 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.574 18.410 7.321 1.00 0.00 H new ATOM 0 HB2 ALA A 9 3.009 18.994 8.945 1.00 0.00 H new ATOM 0 HB3 ALA A 9 4.093 17.878 8.081 1.00 0.00 H new ATOM 90 N THR A 10 1.112 15.389 7.490 1.00 0.00 N ATOM 91 CA THR A 10 0.958 14.275 6.563 1.00 0.00 C ATOM 92 C THR A 10 0.034 14.644 5.408 1.00 0.00 C ATOM 93 O THR A 10 -1.001 15.281 5.608 1.00 0.00 O ATOM 94 CB THR A 10 0.399 13.027 7.273 1.00 0.00 C ATOM 95 OG1 THR A 10 -0.782 13.369 8.008 1.00 0.00 O ATOM 96 CG2 THR A 10 1.434 12.432 8.216 1.00 0.00 C ATOM 0 H THR A 10 0.235 15.826 7.773 1.00 0.00 H new ATOM 0 HA THR A 10 1.950 14.049 6.173 1.00 0.00 H new ATOM 0 HB THR A 10 0.152 12.285 6.514 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.132 12.570 8.455 1.00 0.00 H new ATOM 0 HG21 THR A 10 1.017 11.552 8.706 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.320 12.146 7.650 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.708 13.171 8.969 1.00 0.00 H new ATOM 104 N ASP A 11 0.414 14.241 4.201 1.00 0.00 N ATOM 105 CA ASP A 11 -0.382 14.529 3.013 1.00 0.00 C ATOM 106 C ASP A 11 -0.831 13.238 2.335 1.00 0.00 C ATOM 107 O ASP A 11 -0.238 12.179 2.538 1.00 0.00 O ATOM 108 CB ASP A 11 0.420 15.384 2.031 1.00 0.00 C ATOM 109 CG ASP A 11 0.672 16.784 2.554 1.00 0.00 C ATOM 110 OD1 ASP A 11 -0.313 17.516 2.790 1.00 0.00 O ATOM 111 OD2 ASP A 11 1.853 17.149 2.728 1.00 0.00 O ATOM 0 H ASP A 11 1.268 13.714 4.019 1.00 0.00 H new ATOM 0 HA ASP A 11 -1.268 15.082 3.324 1.00 0.00 H new ATOM 0 HB2 ASP A 11 1.374 14.899 1.826 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -0.116 15.444 1.084 1.00 0.00 H new ATOM 116 N TRP A 12 -1.882 13.335 1.529 1.00 0.00 N ATOM 117 CA TRP A 12 -2.412 12.175 0.821 1.00 0.00 C ATOM 118 C TRP A 12 -2.874 12.557 -0.581 1.00 0.00 C ATOM 119 O TRP A 12 -3.206 13.714 -0.842 1.00 0.00 O ATOM 120 CB TRP A 12 -3.573 11.560 1.605 1.00 0.00 C ATOM 121 CG TRP A 12 -4.546 12.577 2.119 1.00 0.00 C ATOM 122 CD1 TRP A 12 -5.274 13.463 1.378 1.00 0.00 C ATOM 123 CD2 TRP A 12 -4.896 12.812 3.488 1.00 0.00 C ATOM 124 NE1 TRP A 12 -6.056 14.236 2.204 1.00 0.00 N ATOM 125 CE2 TRP A 12 -5.843 13.855 3.502 1.00 0.00 C ATOM 126 CE3 TRP A 12 -4.504 12.242 4.702 1.00 0.00 C ATOM 127 CZ2 TRP A 12 -6.399 14.338 4.683 1.00 0.00 C ATOM 128 CZ3 TRP A 12 -5.057 12.722 5.873 1.00 0.00 C ATOM 129 CH2 TRP A 12 -5.997 13.762 5.857 1.00 0.00 C ATOM 0 H TRP A 12 -2.384 14.205 1.349 1.00 0.00 H new ATOM 0 HA TRP A 12 -1.613 11.439 0.731 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -4.101 10.854 0.964 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -3.174 10.992 2.445 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -5.241 13.545 0.302 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -6.691 14.973 1.899 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -3.781 11.440 4.724 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -7.123 15.140 4.673 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -4.760 12.289 6.817 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -6.412 14.115 6.789 1.00 0.00 H new ATOM 140 N LEU A 13 -2.893 11.579 -1.479 1.00 0.00 N ATOM 141 CA LEU A 13 -3.316 11.813 -2.856 1.00 0.00 C ATOM 142 C LEU A 13 -4.653 11.135 -3.138 1.00 0.00 C ATOM 143 O LEU A 13 -4.907 10.023 -2.674 1.00 0.00 O ATOM 144 CB LEU A 13 -2.254 11.298 -3.830 1.00 0.00 C ATOM 145 CG LEU A 13 -2.762 10.854 -5.203 1.00 0.00 C ATOM 146 CD1 LEU A 13 -3.355 12.032 -5.959 1.00 0.00 C ATOM 147 CD2 LEU A 13 -1.639 10.213 -6.005 1.00 0.00 C ATOM 0 H LEU A 13 -2.621 10.617 -1.279 1.00 0.00 H new ATOM 0 HA LEU A 13 -3.438 12.887 -2.995 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.512 12.083 -3.976 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.741 10.456 -3.365 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.546 10.111 -5.057 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.711 11.697 -6.933 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -4.188 12.447 -5.391 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.592 12.798 -6.095 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.018 9.903 -6.979 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.833 10.934 -6.142 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.260 9.342 -5.469 1.00 0.00 H new ATOM 159 N SER A 14 -5.503 11.811 -3.904 1.00 0.00 N ATOM 160 CA SER A 14 -6.815 11.274 -4.247 1.00 0.00 C ATOM 161 C SER A 14 -6.682 10.041 -5.135 1.00 0.00 C ATOM 162 O SER A 14 -6.679 10.142 -6.361 1.00 0.00 O ATOM 163 CB SER A 14 -7.655 12.339 -4.956 1.00 0.00 C ATOM 164 OG SER A 14 -8.056 13.356 -4.055 1.00 0.00 O ATOM 0 H SER A 14 -5.307 12.731 -4.299 1.00 0.00 H new ATOM 0 HA SER A 14 -7.314 10.982 -3.323 1.00 0.00 H new ATOM 0 HB2 SER A 14 -7.079 12.777 -5.771 1.00 0.00 H new ATOM 0 HB3 SER A 14 -8.535 11.875 -5.401 1.00 0.00 H new ATOM 0 HG SER A 14 -8.590 14.025 -4.533 1.00 0.00 H new ATOM 170 N ALA A 15 -6.573 8.876 -4.505 1.00 0.00 N ATOM 171 CA ALA A 15 -6.442 7.621 -5.236 1.00 0.00 C ATOM 172 C ALA A 15 -6.872 6.437 -4.377 1.00 0.00 C ATOM 173 O ALA A 15 -7.161 6.593 -3.191 1.00 0.00 O ATOM 174 CB ALA A 15 -5.009 7.436 -5.714 1.00 0.00 C ATOM 0 H ALA A 15 -6.573 8.775 -3.490 1.00 0.00 H new ATOM 0 HA ALA A 15 -7.100 7.664 -6.104 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.926 6.495 -6.258 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.735 8.261 -6.372 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.338 7.419 -4.855 1.00 0.00 H new ATOM 180 N GLU A 16 -6.912 5.255 -4.983 1.00 0.00 N ATOM 181 CA GLU A 16 -7.309 4.046 -4.272 1.00 0.00 C ATOM 182 C GLU A 16 -6.397 2.877 -4.635 1.00 0.00 C ATOM 183 O GLU A 16 -5.497 3.011 -5.465 1.00 0.00 O ATOM 184 CB GLU A 16 -8.762 3.691 -4.595 1.00 0.00 C ATOM 185 CG GLU A 16 -8.951 3.097 -5.981 1.00 0.00 C ATOM 186 CD GLU A 16 -10.391 2.717 -6.262 1.00 0.00 C ATOM 187 OE1 GLU A 16 -10.850 1.689 -5.723 1.00 0.00 O ATOM 188 OE2 GLU A 16 -11.060 3.450 -7.022 1.00 0.00 O ATOM 0 H GLU A 16 -6.674 5.109 -5.964 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.218 4.238 -3.203 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -9.127 2.982 -3.852 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -9.374 4.588 -4.507 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -8.617 3.816 -6.729 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -8.320 2.214 -6.083 1.00 0.00 H new ATOM 195 N THR A 17 -6.635 1.731 -4.005 1.00 0.00 N ATOM 196 CA THR A 17 -5.835 0.539 -4.258 1.00 0.00 C ATOM 197 C THR A 17 -6.701 -0.715 -4.260 1.00 0.00 C ATOM 198 O THR A 17 -7.585 -0.872 -3.418 1.00 0.00 O ATOM 199 CB THR A 17 -4.720 0.378 -3.208 1.00 0.00 C ATOM 200 OG1 THR A 17 -4.179 1.659 -2.866 1.00 0.00 O ATOM 201 CG2 THR A 17 -3.611 -0.523 -3.730 1.00 0.00 C ATOM 0 H THR A 17 -7.376 1.603 -3.315 1.00 0.00 H new ATOM 0 HA THR A 17 -5.382 0.665 -5.242 1.00 0.00 H new ATOM 0 HB THR A 17 -5.153 -0.082 -2.319 1.00 0.00 H new ATOM 0 HG1 THR A 17 -3.472 1.547 -2.197 1.00 0.00 H new ATOM 0 HG21 THR A 17 -2.835 -0.622 -2.971 1.00 0.00 H new ATOM 0 HG22 THR A 17 -4.020 -1.507 -3.961 1.00 0.00 H new ATOM 0 HG23 THR A 17 -3.183 -0.087 -4.632 1.00 0.00 H new ATOM 209 N PHE A 18 -6.442 -1.606 -5.211 1.00 0.00 N ATOM 210 CA PHE A 18 -7.199 -2.847 -5.322 1.00 0.00 C ATOM 211 C PHE A 18 -6.557 -3.953 -4.489 1.00 0.00 C ATOM 212 O PHE A 18 -7.246 -4.706 -3.802 1.00 0.00 O ATOM 213 CB PHE A 18 -7.292 -3.284 -6.786 1.00 0.00 C ATOM 214 CG PHE A 18 -5.997 -3.146 -7.535 1.00 0.00 C ATOM 215 CD1 PHE A 18 -5.616 -1.925 -8.068 1.00 0.00 C ATOM 216 CD2 PHE A 18 -5.161 -4.238 -7.707 1.00 0.00 C ATOM 217 CE1 PHE A 18 -4.426 -1.795 -8.758 1.00 0.00 C ATOM 218 CE2 PHE A 18 -3.969 -4.113 -8.395 1.00 0.00 C ATOM 219 CZ PHE A 18 -3.602 -2.891 -8.923 1.00 0.00 C ATOM 0 H PHE A 18 -5.714 -1.492 -5.916 1.00 0.00 H new ATOM 0 HA PHE A 18 -8.204 -2.665 -4.940 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -7.617 -4.323 -6.827 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -8.057 -2.691 -7.286 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -6.257 -1.065 -7.943 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.444 -5.197 -7.299 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.141 -0.837 -9.168 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -3.325 -4.971 -8.520 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.672 -2.792 -9.464 1.00 0.00 H new ATOM 229 N GLU A 19 -5.232 -4.043 -4.558 1.00 0.00 N ATOM 230 CA GLU A 19 -4.497 -5.057 -3.811 1.00 0.00 C ATOM 231 C GLU A 19 -5.277 -6.368 -3.761 1.00 0.00 C ATOM 232 O GLU A 19 -5.327 -7.033 -2.726 1.00 0.00 O ATOM 233 CB GLU A 19 -4.208 -4.568 -2.391 1.00 0.00 C ATOM 234 CG GLU A 19 -2.936 -5.147 -1.794 1.00 0.00 C ATOM 235 CD GLU A 19 -3.102 -6.588 -1.353 1.00 0.00 C ATOM 236 OE1 GLU A 19 -2.939 -7.490 -2.201 1.00 0.00 O ATOM 237 OE2 GLU A 19 -3.395 -6.813 -0.160 1.00 0.00 O ATOM 0 H GLU A 19 -4.647 -3.427 -5.123 1.00 0.00 H new ATOM 0 HA GLU A 19 -3.552 -5.236 -4.324 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -4.133 -3.481 -2.399 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -5.050 -4.825 -1.749 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -2.134 -5.086 -2.529 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -2.632 -4.542 -0.940 1.00 0.00 H new ATOM 244 N SER A 20 -5.885 -6.732 -4.885 1.00 0.00 N ATOM 245 CA SER A 20 -6.667 -7.960 -4.969 1.00 0.00 C ATOM 246 C SER A 20 -5.825 -9.103 -5.526 1.00 0.00 C ATOM 247 O SER A 20 -6.152 -10.276 -5.345 1.00 0.00 O ATOM 248 CB SER A 20 -7.901 -7.745 -5.846 1.00 0.00 C ATOM 249 OG SER A 20 -8.671 -8.931 -5.944 1.00 0.00 O ATOM 0 H SER A 20 -5.851 -6.194 -5.751 1.00 0.00 H new ATOM 0 HA SER A 20 -6.988 -8.226 -3.962 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.512 -6.945 -5.429 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.592 -7.425 -6.841 1.00 0.00 H new ATOM 0 HG SER A 20 -9.455 -8.766 -6.509 1.00 0.00 H new ATOM 255 N ASP A 21 -4.739 -8.752 -6.206 1.00 0.00 N ATOM 256 CA ASP A 21 -3.848 -9.748 -6.791 1.00 0.00 C ATOM 257 C ASP A 21 -2.392 -9.433 -6.462 1.00 0.00 C ATOM 258 O ASP A 21 -1.484 -10.172 -6.845 1.00 0.00 O ATOM 259 CB ASP A 21 -4.040 -9.808 -8.307 1.00 0.00 C ATOM 260 CG ASP A 21 -3.932 -8.444 -8.959 1.00 0.00 C ATOM 261 OD1 ASP A 21 -2.794 -7.983 -9.184 1.00 0.00 O ATOM 262 OD2 ASP A 21 -4.986 -7.837 -9.244 1.00 0.00 O ATOM 0 H ASP A 21 -4.454 -7.786 -6.366 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.097 -10.719 -6.363 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.293 -10.474 -8.739 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.017 -10.238 -8.530 1.00 0.00 H new ATOM 267 N LEU A 22 -2.175 -8.331 -5.753 1.00 0.00 N ATOM 268 CA LEU A 22 -0.829 -7.917 -5.374 1.00 0.00 C ATOM 269 C LEU A 22 -0.179 -8.950 -4.460 1.00 0.00 C ATOM 270 O LEU A 22 -0.849 -9.842 -3.938 1.00 0.00 O ATOM 271 CB LEU A 22 -0.870 -6.556 -4.676 1.00 0.00 C ATOM 272 CG LEU A 22 -0.824 -5.331 -5.590 1.00 0.00 C ATOM 273 CD1 LEU A 22 0.491 -5.284 -6.353 1.00 0.00 C ATOM 274 CD2 LEU A 22 -2.001 -5.340 -6.554 1.00 0.00 C ATOM 0 H LEU A 22 -2.914 -7.708 -5.429 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.232 -7.835 -6.282 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.780 -6.504 -4.078 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -0.030 -6.500 -3.984 1.00 0.00 H new ATOM 0 HG LEU A 22 -0.894 -4.437 -4.971 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.506 -4.406 -6.998 1.00 0.00 H new ATOM 0 HD12 LEU A 22 1.320 -5.230 -5.647 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.591 -6.183 -6.961 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.952 -4.461 -7.197 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.962 -6.240 -7.167 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.934 -5.325 -5.990 1.00 0.00 H new ATOM 286 N ASP A 23 1.130 -8.823 -4.269 1.00 0.00 N ATOM 287 CA ASP A 23 1.871 -9.745 -3.415 1.00 0.00 C ATOM 288 C ASP A 23 2.407 -9.028 -2.179 1.00 0.00 C ATOM 289 O ASP A 23 3.519 -8.503 -2.189 1.00 0.00 O ATOM 290 CB ASP A 23 3.025 -10.378 -4.193 1.00 0.00 C ATOM 291 CG ASP A 23 2.560 -11.482 -5.122 1.00 0.00 C ATOM 292 OD1 ASP A 23 2.010 -11.161 -6.197 1.00 0.00 O ATOM 293 OD2 ASP A 23 2.747 -12.667 -4.775 1.00 0.00 O ATOM 0 H ASP A 23 1.700 -8.091 -4.694 1.00 0.00 H new ATOM 0 HA ASP A 23 1.188 -10.530 -3.090 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.533 -9.608 -4.774 1.00 0.00 H new ATOM 0 HB3 ASP A 23 3.755 -10.781 -3.491 1.00 0.00 H new ATOM 298 N GLU A 24 1.606 -9.011 -1.118 1.00 0.00 N ATOM 299 CA GLU A 24 2.000 -8.357 0.125 1.00 0.00 C ATOM 300 C GLU A 24 2.199 -9.381 1.239 1.00 0.00 C ATOM 301 O GLU A 24 2.107 -9.054 2.423 1.00 0.00 O ATOM 302 CB GLU A 24 0.946 -7.330 0.543 1.00 0.00 C ATOM 303 CG GLU A 24 1.448 -6.324 1.565 1.00 0.00 C ATOM 304 CD GLU A 24 0.349 -5.413 2.076 1.00 0.00 C ATOM 305 OE1 GLU A 24 -0.010 -4.456 1.357 1.00 0.00 O ATOM 306 OE2 GLU A 24 -0.153 -5.656 3.193 1.00 0.00 O ATOM 0 H GLU A 24 0.682 -9.442 -1.094 1.00 0.00 H new ATOM 0 HA GLU A 24 2.947 -7.845 -0.048 1.00 0.00 H new ATOM 0 HB2 GLU A 24 0.601 -6.795 -0.342 1.00 0.00 H new ATOM 0 HB3 GLU A 24 0.084 -7.854 0.955 1.00 0.00 H new ATOM 0 HG2 GLU A 24 1.893 -6.857 2.405 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.237 -5.720 1.117 1.00 0.00 H new ATOM 313 N THR A 25 2.473 -10.623 0.852 1.00 0.00 N ATOM 314 CA THR A 25 2.684 -11.695 1.816 1.00 0.00 C ATOM 315 C THR A 25 4.170 -11.951 2.037 1.00 0.00 C ATOM 316 O THR A 25 4.551 -12.750 2.893 1.00 0.00 O ATOM 317 CB THR A 25 2.012 -13.003 1.357 1.00 0.00 C ATOM 318 OG1 THR A 25 2.627 -13.473 0.152 1.00 0.00 O ATOM 319 CG2 THR A 25 0.523 -12.794 1.124 1.00 0.00 C ATOM 0 H THR A 25 2.554 -10.911 -0.123 1.00 0.00 H new ATOM 0 HA THR A 25 2.231 -11.371 2.753 1.00 0.00 H new ATOM 0 HB THR A 25 2.140 -13.747 2.144 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.195 -14.306 -0.132 1.00 0.00 H new ATOM 0 HG21 THR A 25 0.070 -13.731 0.801 1.00 0.00 H new ATOM 0 HG22 THR A 25 0.053 -12.464 2.050 1.00 0.00 H new ATOM 0 HG23 THR A 25 0.378 -12.036 0.354 1.00 0.00 H new ATOM 327 N ARG A 26 5.005 -11.268 1.262 1.00 0.00 N ATOM 328 CA ARG A 26 6.451 -11.422 1.374 1.00 0.00 C ATOM 329 C ARG A 26 7.152 -10.071 1.266 1.00 0.00 C ATOM 330 O ARG A 26 6.666 -9.159 0.597 1.00 0.00 O ATOM 331 CB ARG A 26 6.970 -12.366 0.288 1.00 0.00 C ATOM 332 CG ARG A 26 6.732 -11.859 -1.125 1.00 0.00 C ATOM 333 CD ARG A 26 7.070 -12.918 -2.161 1.00 0.00 C ATOM 334 NE ARG A 26 6.317 -12.734 -3.399 1.00 0.00 N ATOM 335 CZ ARG A 26 6.202 -13.668 -4.336 1.00 0.00 C ATOM 336 NH1 ARG A 26 6.789 -14.847 -4.177 1.00 0.00 N ATOM 337 NH2 ARG A 26 5.500 -13.425 -5.435 1.00 0.00 N ATOM 0 H ARG A 26 4.706 -10.602 0.549 1.00 0.00 H new ATOM 0 HA ARG A 26 6.671 -11.849 2.353 1.00 0.00 H new ATOM 0 HB2 ARG A 26 8.039 -12.521 0.434 1.00 0.00 H new ATOM 0 HB3 ARG A 26 6.488 -13.337 0.402 1.00 0.00 H new ATOM 0 HG2 ARG A 26 5.689 -11.561 -1.235 1.00 0.00 H new ATOM 0 HG3 ARG A 26 7.338 -10.970 -1.301 1.00 0.00 H new ATOM 0 HD2 ARG A 26 8.138 -12.885 -2.378 1.00 0.00 H new ATOM 0 HD3 ARG A 26 6.858 -13.906 -1.752 1.00 0.00 H new ATOM 0 HE ARG A 26 5.854 -11.838 -3.552 1.00 0.00 H new ATOM 0 HH11 ARG A 26 7.330 -15.038 -3.334 1.00 0.00 H new ATOM 0 HH12 ARG A 26 6.699 -15.563 -4.898 1.00 0.00 H new ATOM 0 HH21 ARG A 26 5.048 -12.520 -5.561 1.00 0.00 H new ATOM 0 HH22 ARG A 26 5.413 -14.144 -6.154 1.00 0.00 H new ATOM 351 N VAL A 27 8.297 -9.950 1.930 1.00 0.00 N ATOM 352 CA VAL A 27 9.066 -8.711 1.908 1.00 0.00 C ATOM 353 C VAL A 27 9.752 -8.513 0.561 1.00 0.00 C ATOM 354 O VAL A 27 10.071 -9.468 -0.147 1.00 0.00 O ATOM 355 CB VAL A 27 10.130 -8.691 3.022 1.00 0.00 C ATOM 356 CG1 VAL A 27 9.469 -8.697 4.392 1.00 0.00 C ATOM 357 CG2 VAL A 27 11.078 -9.870 2.873 1.00 0.00 C ATOM 0 H VAL A 27 8.713 -10.695 2.490 1.00 0.00 H new ATOM 0 HA VAL A 27 8.360 -7.898 2.075 1.00 0.00 H new ATOM 0 HB VAL A 27 10.711 -7.773 2.930 1.00 0.00 H new ATOM 0 HG11 VAL A 27 10.236 -8.683 5.166 1.00 0.00 H new ATOM 0 HG12 VAL A 27 8.834 -7.817 4.494 1.00 0.00 H new ATOM 0 HG13 VAL A 27 8.862 -9.596 4.499 1.00 0.00 H new ATOM 0 HG21 VAL A 27 11.823 -9.840 3.668 1.00 0.00 H new ATOM 0 HG22 VAL A 27 10.514 -10.801 2.938 1.00 0.00 H new ATOM 0 HG23 VAL A 27 11.577 -9.815 1.906 1.00 0.00 H new ATOM 367 N PRO A 28 9.985 -7.243 0.197 1.00 0.00 N ATOM 368 CA PRO A 28 10.637 -6.890 -1.068 1.00 0.00 C ATOM 369 C PRO A 28 12.114 -7.269 -1.084 1.00 0.00 C ATOM 370 O PRO A 28 12.896 -6.789 -0.264 1.00 0.00 O ATOM 371 CB PRO A 28 10.475 -5.369 -1.137 1.00 0.00 C ATOM 372 CG PRO A 28 10.343 -4.937 0.282 1.00 0.00 C ATOM 373 CD PRO A 28 9.631 -6.055 0.992 1.00 0.00 C ATOM 0 HA PRO A 28 10.199 -7.419 -1.914 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.335 -4.901 -1.615 1.00 0.00 H new ATOM 0 HB3 PRO A 28 9.596 -5.091 -1.719 1.00 0.00 H new ATOM 0 HG2 PRO A 28 11.321 -4.753 0.726 1.00 0.00 H new ATOM 0 HG3 PRO A 28 9.780 -4.007 0.356 1.00 0.00 H new ATOM 0 HD2 PRO A 28 9.962 -6.150 2.026 1.00 0.00 H new ATOM 0 HD3 PRO A 28 8.553 -5.894 1.016 1.00 0.00 H new ATOM 381 N GLU A 29 12.488 -8.132 -2.024 1.00 0.00 N ATOM 382 CA GLU A 29 13.872 -8.575 -2.145 1.00 0.00 C ATOM 383 C GLU A 29 14.762 -7.445 -2.655 1.00 0.00 C ATOM 384 O GLU A 29 14.273 -6.431 -3.153 1.00 0.00 O ATOM 385 CB GLU A 29 13.965 -9.777 -3.088 1.00 0.00 C ATOM 386 CG GLU A 29 12.920 -10.846 -2.816 1.00 0.00 C ATOM 387 CD GLU A 29 12.545 -11.626 -4.062 1.00 0.00 C ATOM 388 OE1 GLU A 29 13.370 -11.683 -4.997 1.00 0.00 O ATOM 389 OE2 GLU A 29 11.426 -12.178 -4.101 1.00 0.00 O ATOM 0 H GLU A 29 11.853 -8.537 -2.712 1.00 0.00 H new ATOM 0 HA GLU A 29 14.220 -8.870 -1.155 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.859 -9.431 -4.116 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.957 -10.220 -3.001 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.298 -11.535 -2.061 1.00 0.00 H new ATOM 0 HG3 GLU A 29 12.027 -10.378 -2.402 1.00 0.00 H new ATOM 396 N VAL A 30 16.072 -7.628 -2.525 1.00 0.00 N ATOM 397 CA VAL A 30 17.032 -6.625 -2.972 1.00 0.00 C ATOM 398 C VAL A 30 16.536 -5.910 -4.224 1.00 0.00 C ATOM 399 O VAL A 30 16.083 -6.531 -5.185 1.00 0.00 O ATOM 400 CB VAL A 30 18.407 -7.255 -3.264 1.00 0.00 C ATOM 401 CG1 VAL A 30 18.266 -8.418 -4.234 1.00 0.00 C ATOM 402 CG2 VAL A 30 19.366 -6.209 -3.810 1.00 0.00 C ATOM 0 H VAL A 30 16.493 -8.461 -2.114 1.00 0.00 H new ATOM 0 HA VAL A 30 17.136 -5.903 -2.162 1.00 0.00 H new ATOM 0 HB VAL A 30 18.817 -7.639 -2.330 1.00 0.00 H new ATOM 0 HG11 VAL A 30 19.247 -8.851 -4.429 1.00 0.00 H new ATOM 0 HG12 VAL A 30 17.615 -9.177 -3.800 1.00 0.00 H new ATOM 0 HG13 VAL A 30 17.835 -8.061 -5.169 1.00 0.00 H new ATOM 0 HG21 VAL A 30 20.333 -6.671 -4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 30 18.964 -5.793 -4.734 1.00 0.00 H new ATOM 0 HG23 VAL A 30 19.490 -5.412 -3.077 1.00 0.00 H new ATOM 412 N PRO A 31 16.624 -4.572 -4.214 1.00 0.00 N ATOM 413 CA PRO A 31 16.190 -3.742 -5.342 1.00 0.00 C ATOM 414 C PRO A 31 17.101 -3.890 -6.555 1.00 0.00 C ATOM 415 O PRO A 31 18.163 -4.507 -6.474 1.00 0.00 O ATOM 416 CB PRO A 31 16.268 -2.318 -4.785 1.00 0.00 C ATOM 417 CG PRO A 31 17.284 -2.391 -3.698 1.00 0.00 C ATOM 418 CD PRO A 31 17.153 -3.765 -3.101 1.00 0.00 C ATOM 0 HA PRO A 31 15.198 -4.022 -5.696 1.00 0.00 H new ATOM 0 HB2 PRO A 31 16.564 -1.607 -5.556 1.00 0.00 H new ATOM 0 HB3 PRO A 31 15.302 -1.989 -4.402 1.00 0.00 H new ATOM 0 HG2 PRO A 31 18.288 -2.230 -4.091 1.00 0.00 H new ATOM 0 HG3 PRO A 31 17.108 -1.621 -2.947 1.00 0.00 H new ATOM 0 HD2 PRO A 31 18.113 -4.144 -2.751 1.00 0.00 H new ATOM 0 HD3 PRO A 31 16.478 -3.769 -2.246 1.00 0.00 H new ATOM 426 N SER A 32 16.680 -3.320 -7.679 1.00 0.00 N ATOM 427 CA SER A 32 17.458 -3.392 -8.911 1.00 0.00 C ATOM 428 C SER A 32 18.912 -3.007 -8.658 1.00 0.00 C ATOM 429 O SER A 32 19.833 -3.720 -9.057 1.00 0.00 O ATOM 430 CB SER A 32 16.853 -2.474 -9.975 1.00 0.00 C ATOM 431 OG SER A 32 17.847 -2.006 -10.870 1.00 0.00 O ATOM 0 H SER A 32 15.805 -2.803 -7.763 1.00 0.00 H new ATOM 0 HA SER A 32 17.430 -4.421 -9.270 1.00 0.00 H new ATOM 0 HB2 SER A 32 16.084 -3.012 -10.530 1.00 0.00 H new ATOM 0 HB3 SER A 32 16.365 -1.627 -9.494 1.00 0.00 H new ATOM 0 HG SER A 32 17.435 -1.423 -11.541 1.00 0.00 H new ATOM 437 N SER A 33 19.111 -1.874 -7.993 1.00 0.00 N ATOM 438 CA SER A 33 20.453 -1.390 -7.690 1.00 0.00 C ATOM 439 C SER A 33 20.396 -0.142 -6.814 1.00 0.00 C ATOM 440 O SER A 33 19.319 0.299 -6.410 1.00 0.00 O ATOM 441 CB SER A 33 21.212 -1.086 -8.982 1.00 0.00 C ATOM 442 OG SER A 33 22.612 -1.067 -8.759 1.00 0.00 O ATOM 0 H SER A 33 18.360 -1.273 -7.653 1.00 0.00 H new ATOM 0 HA SER A 33 20.980 -2.172 -7.143 1.00 0.00 H new ATOM 0 HB2 SER A 33 20.971 -1.837 -9.734 1.00 0.00 H new ATOM 0 HB3 SER A 33 20.891 -0.123 -9.378 1.00 0.00 H new ATOM 0 HG SER A 33 23.075 -0.872 -9.601 1.00 0.00 H new ATOM 448 N LEU A 34 21.562 0.423 -6.524 1.00 0.00 N ATOM 449 CA LEU A 34 21.648 1.621 -5.696 1.00 0.00 C ATOM 450 C LEU A 34 22.846 2.475 -6.096 1.00 0.00 C ATOM 451 O LEU A 34 23.996 2.069 -5.925 1.00 0.00 O ATOM 452 CB LEU A 34 21.750 1.238 -4.219 1.00 0.00 C ATOM 453 CG LEU A 34 22.531 2.204 -3.327 1.00 0.00 C ATOM 454 CD1 LEU A 34 21.728 3.472 -3.083 1.00 0.00 C ATOM 455 CD2 LEU A 34 22.894 1.538 -2.008 1.00 0.00 C ATOM 0 H LEU A 34 22.462 0.071 -6.850 1.00 0.00 H new ATOM 0 HA LEU A 34 20.741 2.206 -5.851 1.00 0.00 H new ATOM 0 HB2 LEU A 34 20.741 1.141 -3.819 1.00 0.00 H new ATOM 0 HB3 LEU A 34 22.216 0.255 -4.151 1.00 0.00 H new ATOM 0 HG LEU A 34 23.454 2.476 -3.839 1.00 0.00 H new ATOM 0 HD11 LEU A 34 22.299 4.148 -2.446 1.00 0.00 H new ATOM 0 HD12 LEU A 34 21.520 3.960 -4.035 1.00 0.00 H new ATOM 0 HD13 LEU A 34 20.788 3.219 -2.592 1.00 0.00 H new ATOM 0 HD21 LEU A 34 23.449 2.240 -1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 34 21.984 1.236 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 34 23.510 0.659 -2.201 1.00 0.00 H new ATOM 467 N HIS A 35 22.570 3.662 -6.628 1.00 0.00 N ATOM 468 CA HIS A 35 23.626 4.575 -7.050 1.00 0.00 C ATOM 469 C HIS A 35 23.900 5.622 -5.975 1.00 0.00 C ATOM 470 O HIS A 35 22.997 6.024 -5.240 1.00 0.00 O ATOM 471 CB HIS A 35 23.242 5.262 -8.361 1.00 0.00 C ATOM 472 CG HIS A 35 24.195 6.341 -8.773 1.00 0.00 C ATOM 473 ND1 HIS A 35 23.794 7.628 -9.063 1.00 0.00 N ATOM 474 CD2 HIS A 35 25.537 6.320 -8.942 1.00 0.00 C ATOM 475 CE1 HIS A 35 24.849 8.352 -9.394 1.00 0.00 C ATOM 476 NE2 HIS A 35 25.919 7.581 -9.328 1.00 0.00 N ATOM 0 H HIS A 35 21.624 4.014 -6.777 1.00 0.00 H new ATOM 0 HA HIS A 35 24.534 3.993 -7.206 1.00 0.00 H new ATOM 0 HB2 HIS A 35 23.189 4.514 -9.152 1.00 0.00 H new ATOM 0 HB3 HIS A 35 22.244 5.689 -8.259 1.00 0.00 H new ATOM 0 HD2 HIS A 35 26.187 5.469 -8.800 1.00 0.00 H new ATOM 0 HE1 HIS A 35 24.838 9.396 -9.671 1.00 0.00 H new ATOM 0 HE2 HIS A 35 26.874 7.875 -9.531 1.00 0.00 H new ATOM 485 N VAL A 36 25.152 6.061 -5.887 1.00 0.00 N ATOM 486 CA VAL A 36 25.545 7.061 -4.902 1.00 0.00 C ATOM 487 C VAL A 36 26.552 8.044 -5.489 1.00 0.00 C ATOM 488 O VAL A 36 27.404 7.668 -6.294 1.00 0.00 O ATOM 489 CB VAL A 36 26.154 6.406 -3.649 1.00 0.00 C ATOM 490 CG1 VAL A 36 25.080 5.684 -2.849 1.00 0.00 C ATOM 491 CG2 VAL A 36 27.273 5.452 -4.037 1.00 0.00 C ATOM 0 H VAL A 36 25.912 5.739 -6.487 1.00 0.00 H new ATOM 0 HA VAL A 36 24.640 7.598 -4.618 1.00 0.00 H new ATOM 0 HB VAL A 36 26.577 7.189 -3.020 1.00 0.00 H new ATOM 0 HG11 VAL A 36 25.529 5.227 -1.967 1.00 0.00 H new ATOM 0 HG12 VAL A 36 24.316 6.397 -2.539 1.00 0.00 H new ATOM 0 HG13 VAL A 36 24.625 4.910 -3.467 1.00 0.00 H new ATOM 0 HG21 VAL A 36 27.692 4.998 -3.139 1.00 0.00 H new ATOM 0 HG22 VAL A 36 26.877 4.672 -4.687 1.00 0.00 H new ATOM 0 HG23 VAL A 36 28.053 6.001 -4.564 1.00 0.00 H new ATOM 501 N ARG A 37 26.448 9.304 -5.079 1.00 0.00 N ATOM 502 CA ARG A 37 27.350 10.341 -5.565 1.00 0.00 C ATOM 503 C ARG A 37 27.948 11.129 -4.403 1.00 0.00 C ATOM 504 O ARG A 37 27.274 11.922 -3.745 1.00 0.00 O ATOM 505 CB ARG A 37 26.610 11.289 -6.510 1.00 0.00 C ATOM 506 CG ARG A 37 27.310 12.624 -6.706 1.00 0.00 C ATOM 507 CD ARG A 37 28.563 12.476 -7.555 1.00 0.00 C ATOM 508 NE ARG A 37 28.249 12.141 -8.941 1.00 0.00 N ATOM 509 CZ ARG A 37 29.100 12.304 -9.948 1.00 0.00 C ATOM 510 NH1 ARG A 37 30.312 12.794 -9.723 1.00 0.00 N ATOM 511 NH2 ARG A 37 28.741 11.976 -11.182 1.00 0.00 N ATOM 0 H ARG A 37 25.749 9.631 -4.412 1.00 0.00 H new ATOM 0 HA ARG A 37 28.161 9.856 -6.109 1.00 0.00 H new ATOM 0 HB2 ARG A 37 26.493 10.804 -7.479 1.00 0.00 H new ATOM 0 HB3 ARG A 37 25.608 11.468 -6.120 1.00 0.00 H new ATOM 0 HG2 ARG A 37 26.627 13.328 -7.182 1.00 0.00 H new ATOM 0 HG3 ARG A 37 27.574 13.044 -5.735 1.00 0.00 H new ATOM 0 HD2 ARG A 37 29.132 13.405 -7.527 1.00 0.00 H new ATOM 0 HD3 ARG A 37 29.199 11.700 -7.130 1.00 0.00 H new ATOM 0 HE ARG A 37 27.325 11.761 -9.147 1.00 0.00 H new ATOM 0 HH11 ARG A 37 30.592 13.046 -8.775 1.00 0.00 H new ATOM 0 HH12 ARG A 37 30.964 12.918 -10.498 1.00 0.00 H new ATOM 0 HH21 ARG A 37 27.810 11.598 -11.359 1.00 0.00 H new ATOM 0 HH22 ARG A 37 29.396 12.102 -11.954 1.00 0.00 H new ATOM 525 N PRO A 38 29.245 10.906 -4.142 1.00 0.00 N ATOM 526 CA PRO A 38 29.963 11.585 -3.059 1.00 0.00 C ATOM 527 C PRO A 38 30.174 13.068 -3.344 1.00 0.00 C ATOM 528 O PRO A 38 30.685 13.441 -4.401 1.00 0.00 O ATOM 529 CB PRO A 38 31.306 10.854 -3.010 1.00 0.00 C ATOM 530 CG PRO A 38 31.489 10.306 -4.383 1.00 0.00 C ATOM 531 CD PRO A 38 30.111 9.975 -4.884 1.00 0.00 C ATOM 0 HA PRO A 38 29.410 11.552 -2.120 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.116 11.532 -2.743 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.297 10.059 -2.264 1.00 0.00 H new ATOM 0 HG2 PRO A 38 31.976 11.034 -5.032 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.122 9.419 -4.368 1.00 0.00 H new ATOM 0 HD2 PRO A 38 30.029 10.122 -5.961 1.00 0.00 H new ATOM 0 HD3 PRO A 38 29.849 8.936 -4.683 1.00 0.00 H new ATOM 539 N LEU A 39 29.778 13.910 -2.395 1.00 0.00 N ATOM 540 CA LEU A 39 29.925 15.354 -2.545 1.00 0.00 C ATOM 541 C LEU A 39 30.760 15.937 -1.409 1.00 0.00 C ATOM 542 O LEU A 39 30.824 15.371 -0.318 1.00 0.00 O ATOM 543 CB LEU A 39 28.551 16.025 -2.578 1.00 0.00 C ATOM 544 CG LEU A 39 27.915 16.185 -3.960 1.00 0.00 C ATOM 545 CD1 LEU A 39 27.142 14.931 -4.339 1.00 0.00 C ATOM 546 CD2 LEU A 39 27.006 17.404 -3.991 1.00 0.00 C ATOM 0 H LEU A 39 29.353 13.618 -1.515 1.00 0.00 H new ATOM 0 HA LEU A 39 30.440 15.546 -3.486 1.00 0.00 H new ATOM 0 HB2 LEU A 39 27.871 15.447 -1.952 1.00 0.00 H new ATOM 0 HB3 LEU A 39 28.640 17.012 -2.125 1.00 0.00 H new ATOM 0 HG LEU A 39 28.710 16.332 -4.691 1.00 0.00 H new ATOM 0 HD11 LEU A 39 26.696 15.062 -5.325 1.00 0.00 H new ATOM 0 HD12 LEU A 39 27.820 14.078 -4.358 1.00 0.00 H new ATOM 0 HD13 LEU A 39 26.355 14.753 -3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 39 26.562 17.502 -4.982 1.00 0.00 H new ATOM 0 HD22 LEU A 39 26.216 17.287 -3.249 1.00 0.00 H new ATOM 0 HD23 LEU A 39 27.588 18.297 -3.764 1.00 0.00 H new ATOM 558 N VAL A 40 31.398 17.073 -1.673 1.00 0.00 N ATOM 559 CA VAL A 40 32.227 17.734 -0.673 1.00 0.00 C ATOM 560 C VAL A 40 31.690 17.493 0.733 1.00 0.00 C ATOM 561 O VAL A 40 32.298 16.776 1.528 1.00 0.00 O ATOM 562 CB VAL A 40 32.309 19.251 -0.926 1.00 0.00 C ATOM 563 CG1 VAL A 40 33.398 19.878 -0.069 1.00 0.00 C ATOM 564 CG2 VAL A 40 32.553 19.532 -2.401 1.00 0.00 C ATOM 0 H VAL A 40 31.356 17.554 -2.571 1.00 0.00 H new ATOM 0 HA VAL A 40 33.225 17.305 -0.756 1.00 0.00 H new ATOM 0 HB VAL A 40 31.356 19.700 -0.646 1.00 0.00 H new ATOM 0 HG11 VAL A 40 33.441 20.950 -0.262 1.00 0.00 H new ATOM 0 HG12 VAL A 40 33.176 19.707 0.984 1.00 0.00 H new ATOM 0 HG13 VAL A 40 34.359 19.427 -0.315 1.00 0.00 H new ATOM 0 HG21 VAL A 40 32.608 20.609 -2.562 1.00 0.00 H new ATOM 0 HG22 VAL A 40 33.491 19.070 -2.709 1.00 0.00 H new ATOM 0 HG23 VAL A 40 31.735 19.119 -2.990 1.00 0.00 H new ATOM 574 N THR A 41 30.544 18.097 1.034 1.00 0.00 N ATOM 575 CA THR A 41 29.924 17.949 2.345 1.00 0.00 C ATOM 576 C THR A 41 28.536 17.329 2.229 1.00 0.00 C ATOM 577 O THR A 41 27.699 17.488 3.117 1.00 0.00 O ATOM 578 CB THR A 41 29.809 19.304 3.068 1.00 0.00 C ATOM 579 OG1 THR A 41 29.504 20.338 2.126 1.00 0.00 O ATOM 580 CG2 THR A 41 31.102 19.640 3.796 1.00 0.00 C ATOM 0 H THR A 41 30.027 18.693 0.388 1.00 0.00 H new ATOM 0 HA THR A 41 30.567 17.289 2.926 1.00 0.00 H new ATOM 0 HB THR A 41 29.005 19.233 3.801 1.00 0.00 H new ATOM 0 HG1 THR A 41 29.431 21.196 2.594 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.997 20.601 4.299 1.00 0.00 H new ATOM 0 HG22 THR A 41 31.316 18.866 4.533 1.00 0.00 H new ATOM 0 HG23 THR A 41 31.920 19.694 3.078 1.00 0.00 H new ATOM 588 N SER A 42 28.300 16.620 1.130 1.00 0.00 N ATOM 589 CA SER A 42 27.011 15.977 0.897 1.00 0.00 C ATOM 590 C SER A 42 27.189 14.659 0.150 1.00 0.00 C ATOM 591 O SER A 42 28.309 14.263 -0.174 1.00 0.00 O ATOM 592 CB SER A 42 26.090 16.906 0.104 1.00 0.00 C ATOM 593 OG SER A 42 26.757 17.440 -1.027 1.00 0.00 O ATOM 0 H SER A 42 28.984 16.476 0.387 1.00 0.00 H new ATOM 0 HA SER A 42 26.557 15.767 1.865 1.00 0.00 H new ATOM 0 HB2 SER A 42 25.204 16.358 -0.217 1.00 0.00 H new ATOM 0 HB3 SER A 42 25.747 17.718 0.745 1.00 0.00 H new ATOM 0 HG SER A 42 26.264 18.219 -1.360 1.00 0.00 H new ATOM 599 N ILE A 43 26.076 13.984 -0.119 1.00 0.00 N ATOM 600 CA ILE A 43 26.108 12.711 -0.828 1.00 0.00 C ATOM 601 C ILE A 43 24.744 12.381 -1.425 1.00 0.00 C ATOM 602 O ILE A 43 23.818 11.997 -0.711 1.00 0.00 O ATOM 603 CB ILE A 43 26.542 11.561 0.099 1.00 0.00 C ATOM 604 CG1 ILE A 43 27.936 11.834 0.669 1.00 0.00 C ATOM 605 CG2 ILE A 43 26.522 10.238 -0.652 1.00 0.00 C ATOM 606 CD1 ILE A 43 28.511 10.669 1.444 1.00 0.00 C ATOM 0 H ILE A 43 25.142 14.298 0.143 1.00 0.00 H new ATOM 0 HA ILE A 43 26.838 12.815 -1.630 1.00 0.00 H new ATOM 0 HB ILE A 43 25.837 11.497 0.928 1.00 0.00 H new ATOM 0 HG12 ILE A 43 28.611 12.084 -0.149 1.00 0.00 H new ATOM 0 HG13 ILE A 43 27.889 12.706 1.321 1.00 0.00 H new ATOM 0 HG21 ILE A 43 26.831 9.435 0.017 1.00 0.00 H new ATOM 0 HG22 ILE A 43 25.513 10.040 -1.014 1.00 0.00 H new ATOM 0 HG23 ILE A 43 27.207 10.289 -1.498 1.00 0.00 H new ATOM 0 HD11 ILE A 43 29.500 10.934 1.818 1.00 0.00 H new ATOM 0 HD12 ILE A 43 27.857 10.432 2.283 1.00 0.00 H new ATOM 0 HD13 ILE A 43 28.591 9.801 0.790 1.00 0.00 H new ATOM 618 N VAL A 44 24.628 12.531 -2.741 1.00 0.00 N ATOM 619 CA VAL A 44 23.379 12.245 -3.436 1.00 0.00 C ATOM 620 C VAL A 44 23.173 10.744 -3.602 1.00 0.00 C ATOM 621 O VAL A 44 23.711 10.130 -4.523 1.00 0.00 O ATOM 622 CB VAL A 44 23.343 12.914 -4.823 1.00 0.00 C ATOM 623 CG1 VAL A 44 21.908 13.077 -5.300 1.00 0.00 C ATOM 624 CG2 VAL A 44 24.057 14.256 -4.786 1.00 0.00 C ATOM 0 H VAL A 44 25.384 12.849 -3.347 1.00 0.00 H new ATOM 0 HA VAL A 44 22.575 12.653 -2.823 1.00 0.00 H new ATOM 0 HB VAL A 44 23.865 12.270 -5.531 1.00 0.00 H new ATOM 0 HG11 VAL A 44 21.902 13.551 -6.281 1.00 0.00 H new ATOM 0 HG12 VAL A 44 21.434 12.098 -5.367 1.00 0.00 H new ATOM 0 HG13 VAL A 44 21.358 13.699 -4.593 1.00 0.00 H new ATOM 0 HG21 VAL A 44 24.022 14.714 -5.774 1.00 0.00 H new ATOM 0 HG22 VAL A 44 23.566 14.910 -4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 44 25.096 14.107 -4.492 1.00 0.00 H new ATOM 634 N VAL A 45 22.389 10.157 -2.703 1.00 0.00 N ATOM 635 CA VAL A 45 22.110 8.726 -2.750 1.00 0.00 C ATOM 636 C VAL A 45 20.866 8.437 -3.582 1.00 0.00 C ATOM 637 O VAL A 45 19.740 8.627 -3.121 1.00 0.00 O ATOM 638 CB VAL A 45 21.916 8.146 -1.336 1.00 0.00 C ATOM 639 CG1 VAL A 45 21.631 6.653 -1.407 1.00 0.00 C ATOM 640 CG2 VAL A 45 23.138 8.424 -0.474 1.00 0.00 C ATOM 0 H VAL A 45 21.936 10.650 -1.934 1.00 0.00 H new ATOM 0 HA VAL A 45 22.973 8.249 -3.215 1.00 0.00 H new ATOM 0 HB VAL A 45 21.057 8.634 -0.876 1.00 0.00 H new ATOM 0 HG11 VAL A 45 21.497 6.260 -0.399 1.00 0.00 H new ATOM 0 HG12 VAL A 45 20.724 6.483 -1.987 1.00 0.00 H new ATOM 0 HG13 VAL A 45 22.468 6.145 -1.886 1.00 0.00 H new ATOM 0 HG21 VAL A 45 22.984 8.007 0.521 1.00 0.00 H new ATOM 0 HG22 VAL A 45 24.016 7.964 -0.928 1.00 0.00 H new ATOM 0 HG23 VAL A 45 23.292 9.500 -0.397 1.00 0.00 H new ATOM 650 N SER A 46 21.076 7.974 -4.810 1.00 0.00 N ATOM 651 CA SER A 46 19.971 7.660 -5.708 1.00 0.00 C ATOM 652 C SER A 46 19.824 6.152 -5.883 1.00 0.00 C ATOM 653 O SER A 46 20.790 5.456 -6.198 1.00 0.00 O ATOM 654 CB SER A 46 20.189 8.324 -7.069 1.00 0.00 C ATOM 655 OG SER A 46 19.378 7.724 -8.065 1.00 0.00 O ATOM 0 H SER A 46 22.001 7.808 -5.206 1.00 0.00 H new ATOM 0 HA SER A 46 19.054 8.047 -5.265 1.00 0.00 H new ATOM 0 HB2 SER A 46 19.958 9.387 -7.000 1.00 0.00 H new ATOM 0 HB3 SER A 46 21.238 8.243 -7.353 1.00 0.00 H new ATOM 0 HG SER A 46 19.535 8.167 -8.925 1.00 0.00 H new ATOM 661 N TRP A 47 18.611 5.654 -5.676 1.00 0.00 N ATOM 662 CA TRP A 47 18.336 4.228 -5.810 1.00 0.00 C ATOM 663 C TRP A 47 17.176 3.985 -6.769 1.00 0.00 C ATOM 664 O TRP A 47 16.603 4.926 -7.318 1.00 0.00 O ATOM 665 CB TRP A 47 18.021 3.618 -4.443 1.00 0.00 C ATOM 666 CG TRP A 47 16.798 4.198 -3.801 1.00 0.00 C ATOM 667 CD1 TRP A 47 15.525 3.708 -3.871 1.00 0.00 C ATOM 668 CD2 TRP A 47 16.731 5.379 -2.995 1.00 0.00 C ATOM 669 NE1 TRP A 47 14.671 4.513 -3.156 1.00 0.00 N ATOM 670 CE2 TRP A 47 15.387 5.544 -2.608 1.00 0.00 C ATOM 671 CE3 TRP A 47 17.677 6.311 -2.559 1.00 0.00 C ATOM 672 CZ2 TRP A 47 14.968 6.604 -1.809 1.00 0.00 C ATOM 673 CZ3 TRP A 47 17.259 7.363 -1.766 1.00 0.00 C ATOM 674 CH2 TRP A 47 15.915 7.502 -1.397 1.00 0.00 C ATOM 0 H TRP A 47 17.801 6.217 -5.415 1.00 0.00 H new ATOM 0 HA TRP A 47 19.226 3.748 -6.218 1.00 0.00 H new ATOM 0 HB2 TRP A 47 17.888 2.542 -4.555 1.00 0.00 H new ATOM 0 HB3 TRP A 47 18.875 3.766 -3.782 1.00 0.00 H new ATOM 0 HD1 TRP A 47 15.233 2.819 -4.409 1.00 0.00 H new ATOM 0 HE1 TRP A 47 13.667 4.366 -3.051 1.00 0.00 H new ATOM 0 HE3 TRP A 47 18.716 6.211 -2.837 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 13.932 6.714 -1.524 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 17.981 8.090 -1.425 1.00 0.00 H new ATOM 0 HH2 TRP A 47 15.620 8.334 -0.775 1.00 0.00 H new ATOM 685 N THR A 48 16.833 2.715 -6.966 1.00 0.00 N ATOM 686 CA THR A 48 15.742 2.349 -7.860 1.00 0.00 C ATOM 687 C THR A 48 14.883 1.245 -7.254 1.00 0.00 C ATOM 688 O THR A 48 15.353 0.418 -6.473 1.00 0.00 O ATOM 689 CB THR A 48 16.270 1.881 -9.229 1.00 0.00 C ATOM 690 OG1 THR A 48 17.452 1.092 -9.055 1.00 0.00 O ATOM 691 CG2 THR A 48 16.576 3.070 -10.127 1.00 0.00 C ATOM 0 H THR A 48 17.295 1.924 -6.518 1.00 0.00 H new ATOM 0 HA THR A 48 15.134 3.243 -8.001 1.00 0.00 H new ATOM 0 HB THR A 48 15.497 1.277 -9.704 1.00 0.00 H new ATOM 0 HG1 THR A 48 17.780 0.797 -9.930 1.00 0.00 H new ATOM 0 HG21 THR A 48 16.947 2.714 -11.088 1.00 0.00 H new ATOM 0 HG22 THR A 48 15.668 3.652 -10.282 1.00 0.00 H new ATOM 0 HG23 THR A 48 17.333 3.697 -9.655 1.00 0.00 H new ATOM 699 N PRO A 49 13.593 1.228 -7.623 1.00 0.00 N ATOM 700 CA PRO A 49 12.642 0.229 -7.128 1.00 0.00 C ATOM 701 C PRO A 49 12.921 -1.163 -7.686 1.00 0.00 C ATOM 702 O PRO A 49 13.552 -1.325 -8.730 1.00 0.00 O ATOM 703 CB PRO A 49 11.291 0.745 -7.631 1.00 0.00 C ATOM 704 CG PRO A 49 11.622 1.566 -8.829 1.00 0.00 C ATOM 705 CD PRO A 49 12.965 2.183 -8.551 1.00 0.00 C ATOM 0 HA PRO A 49 12.695 0.118 -6.045 1.00 0.00 H new ATOM 0 HB2 PRO A 49 10.623 -0.078 -7.887 1.00 0.00 H new ATOM 0 HB3 PRO A 49 10.786 1.340 -6.870 1.00 0.00 H new ATOM 0 HG2 PRO A 49 11.654 0.950 -9.727 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.867 2.334 -8.996 1.00 0.00 H new ATOM 0 HD2 PRO A 49 13.550 2.301 -9.463 1.00 0.00 H new ATOM 0 HD3 PRO A 49 12.868 3.173 -8.105 1.00 0.00 H new ATOM 713 N PRO A 50 12.439 -2.194 -6.975 1.00 0.00 N ATOM 714 CA PRO A 50 12.623 -3.590 -7.381 1.00 0.00 C ATOM 715 C PRO A 50 11.815 -3.944 -8.625 1.00 0.00 C ATOM 716 O PRO A 50 10.587 -3.876 -8.618 1.00 0.00 O ATOM 717 CB PRO A 50 12.116 -4.381 -6.172 1.00 0.00 C ATOM 718 CG PRO A 50 11.152 -3.466 -5.498 1.00 0.00 C ATOM 719 CD PRO A 50 11.676 -2.075 -5.721 1.00 0.00 C ATOM 0 HA PRO A 50 13.659 -3.804 -7.644 1.00 0.00 H new ATOM 0 HB2 PRO A 50 11.633 -5.308 -6.480 1.00 0.00 H new ATOM 0 HB3 PRO A 50 12.935 -4.654 -5.506 1.00 0.00 H new ATOM 0 HG2 PRO A 50 10.151 -3.578 -5.915 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.080 -3.690 -4.434 1.00 0.00 H new ATOM 0 HD2 PRO A 50 10.867 -1.350 -5.810 1.00 0.00 H new ATOM 0 HD3 PRO A 50 12.308 -1.747 -4.896 1.00 0.00 H new ATOM 727 N GLU A 51 12.514 -4.321 -9.691 1.00 0.00 N ATOM 728 CA GLU A 51 11.860 -4.685 -10.942 1.00 0.00 C ATOM 729 C GLU A 51 10.570 -5.456 -10.678 1.00 0.00 C ATOM 730 O GLU A 51 9.638 -5.419 -11.479 1.00 0.00 O ATOM 731 CB GLU A 51 12.801 -5.524 -11.810 1.00 0.00 C ATOM 732 CG GLU A 51 13.704 -4.695 -12.707 1.00 0.00 C ATOM 733 CD GLU A 51 12.931 -3.707 -13.560 1.00 0.00 C ATOM 734 OE1 GLU A 51 11.931 -4.118 -14.185 1.00 0.00 O ATOM 735 OE2 GLU A 51 13.326 -2.524 -13.602 1.00 0.00 O ATOM 0 H GLU A 51 13.532 -4.382 -9.713 1.00 0.00 H new ATOM 0 HA GLU A 51 11.611 -3.766 -11.473 1.00 0.00 H new ATOM 0 HB2 GLU A 51 13.419 -6.147 -11.163 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.207 -6.197 -12.429 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.423 -4.154 -12.092 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.275 -5.360 -13.355 1.00 0.00 H new ATOM 742 N ASN A 52 10.527 -6.155 -9.549 1.00 0.00 N ATOM 743 CA ASN A 52 9.352 -6.936 -9.178 1.00 0.00 C ATOM 744 C ASN A 52 8.318 -6.064 -8.474 1.00 0.00 C ATOM 745 O ASN A 52 8.354 -5.905 -7.254 1.00 0.00 O ATOM 746 CB ASN A 52 9.754 -8.102 -8.273 1.00 0.00 C ATOM 747 CG ASN A 52 8.702 -9.193 -8.233 1.00 0.00 C ATOM 748 OD1 ASN A 52 7.565 -8.959 -7.822 1.00 0.00 O ATOM 749 ND2 ASN A 52 9.076 -10.393 -8.660 1.00 0.00 N ATOM 0 H ASN A 52 11.292 -6.197 -8.875 1.00 0.00 H new ATOM 0 HA ASN A 52 8.906 -7.330 -10.091 1.00 0.00 H new ATOM 0 HB2 ASN A 52 10.696 -8.523 -8.624 1.00 0.00 H new ATOM 0 HB3 ASN A 52 9.927 -7.731 -7.263 1.00 0.00 H new ATOM 0 HD21 ASN A 52 8.411 -11.166 -8.656 1.00 0.00 H new ATOM 0 HD22 ASN A 52 10.029 -10.542 -8.992 1.00 0.00 H new ATOM 756 N GLN A 53 7.398 -5.502 -9.251 1.00 0.00 N ATOM 757 CA GLN A 53 6.354 -4.645 -8.701 1.00 0.00 C ATOM 758 C GLN A 53 5.350 -5.461 -7.892 1.00 0.00 C ATOM 759 O GLN A 53 4.774 -4.970 -6.922 1.00 0.00 O ATOM 760 CB GLN A 53 5.634 -3.897 -9.824 1.00 0.00 C ATOM 761 CG GLN A 53 6.271 -2.561 -10.170 1.00 0.00 C ATOM 762 CD GLN A 53 7.767 -2.546 -9.925 1.00 0.00 C ATOM 763 OE1 GLN A 53 8.553 -2.930 -10.791 1.00 0.00 O ATOM 764 NE2 GLN A 53 8.168 -2.101 -8.740 1.00 0.00 N ATOM 0 H GLN A 53 7.354 -5.624 -10.263 1.00 0.00 H new ATOM 0 HA GLN A 53 6.826 -3.921 -8.037 1.00 0.00 H new ATOM 0 HB2 GLN A 53 5.618 -4.524 -10.715 1.00 0.00 H new ATOM 0 HB3 GLN A 53 4.597 -3.731 -9.532 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.076 -2.330 -11.217 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.802 -1.775 -9.578 1.00 0.00 H new ATOM 0 HE21 GLN A 53 7.481 -1.792 -8.052 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.163 -2.068 -8.518 1.00 0.00 H new ATOM 773 N ASN A 54 5.145 -6.710 -8.300 1.00 0.00 N ATOM 774 CA ASN A 54 4.210 -7.594 -7.614 1.00 0.00 C ATOM 775 C ASN A 54 4.343 -7.457 -6.100 1.00 0.00 C ATOM 776 O ASN A 54 3.348 -7.470 -5.375 1.00 0.00 O ATOM 777 CB ASN A 54 4.450 -9.046 -8.030 1.00 0.00 C ATOM 778 CG ASN A 54 4.566 -9.206 -9.533 1.00 0.00 C ATOM 779 OD1 ASN A 54 5.577 -9.690 -10.041 1.00 0.00 O ATOM 780 ND2 ASN A 54 3.528 -8.797 -10.253 1.00 0.00 N ATOM 0 H ASN A 54 5.614 -7.132 -9.102 1.00 0.00 H new ATOM 0 HA ASN A 54 3.199 -7.305 -7.899 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.362 -9.410 -7.557 1.00 0.00 H new ATOM 0 HB3 ASN A 54 3.632 -9.666 -7.664 1.00 0.00 H new ATOM 0 HD21 ASN A 54 3.549 -8.878 -11.270 1.00 0.00 H new ATOM 0 HD22 ASN A 54 2.710 -8.402 -9.790 1.00 0.00 H new ATOM 787 N ILE A 55 5.579 -7.327 -5.630 1.00 0.00 N ATOM 788 CA ILE A 55 5.842 -7.187 -4.203 1.00 0.00 C ATOM 789 C ILE A 55 5.530 -5.774 -3.723 1.00 0.00 C ATOM 790 O ILE A 55 6.147 -4.805 -4.166 1.00 0.00 O ATOM 791 CB ILE A 55 7.308 -7.520 -3.866 1.00 0.00 C ATOM 792 CG1 ILE A 55 7.711 -8.851 -4.503 1.00 0.00 C ATOM 793 CG2 ILE A 55 7.507 -7.567 -2.358 1.00 0.00 C ATOM 794 CD1 ILE A 55 9.162 -9.215 -4.276 1.00 0.00 C ATOM 0 H ILE A 55 6.414 -7.316 -6.216 1.00 0.00 H new ATOM 0 HA ILE A 55 5.190 -7.894 -3.690 1.00 0.00 H new ATOM 0 HB ILE A 55 7.946 -6.736 -4.273 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.079 -9.643 -4.101 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.520 -8.804 -5.575 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.548 -7.803 -2.136 1.00 0.00 H new ATOM 0 HG22 ILE A 55 7.255 -6.598 -1.927 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.861 -8.333 -1.929 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.377 -10.170 -4.755 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.802 -8.443 -4.703 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.354 -9.295 -3.206 1.00 0.00 H new ATOM 806 N VAL A 56 4.569 -5.664 -2.811 1.00 0.00 N ATOM 807 CA VAL A 56 4.176 -4.369 -2.268 1.00 0.00 C ATOM 808 C VAL A 56 5.297 -3.760 -1.434 1.00 0.00 C ATOM 809 O VAL A 56 5.881 -4.426 -0.578 1.00 0.00 O ATOM 810 CB VAL A 56 2.910 -4.486 -1.398 1.00 0.00 C ATOM 811 CG1 VAL A 56 2.719 -3.231 -0.560 1.00 0.00 C ATOM 812 CG2 VAL A 56 1.689 -4.748 -2.268 1.00 0.00 C ATOM 0 H VAL A 56 4.049 -6.456 -2.433 1.00 0.00 H new ATOM 0 HA VAL A 56 3.965 -3.720 -3.118 1.00 0.00 H new ATOM 0 HB VAL A 56 3.033 -5.330 -0.720 1.00 0.00 H new ATOM 0 HG11 VAL A 56 1.820 -3.333 0.048 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.583 -3.093 0.090 1.00 0.00 H new ATOM 0 HG13 VAL A 56 2.617 -2.367 -1.217 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.803 -4.828 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 56 1.560 -3.926 -2.972 1.00 0.00 H new ATOM 0 HG23 VAL A 56 1.828 -5.678 -2.819 1.00 0.00 H new ATOM 822 N VAL A 57 5.594 -2.490 -1.688 1.00 0.00 N ATOM 823 CA VAL A 57 6.645 -1.789 -0.960 1.00 0.00 C ATOM 824 C VAL A 57 6.106 -0.526 -0.297 1.00 0.00 C ATOM 825 O VAL A 57 5.342 0.226 -0.901 1.00 0.00 O ATOM 826 CB VAL A 57 7.814 -1.410 -1.888 1.00 0.00 C ATOM 827 CG1 VAL A 57 8.914 -0.712 -1.104 1.00 0.00 C ATOM 828 CG2 VAL A 57 8.353 -2.643 -2.597 1.00 0.00 C ATOM 0 H VAL A 57 5.121 -1.925 -2.393 1.00 0.00 H new ATOM 0 HA VAL A 57 7.008 -2.472 -0.192 1.00 0.00 H new ATOM 0 HB VAL A 57 7.445 -0.717 -2.644 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.731 -0.452 -1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 57 8.517 0.195 -0.648 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.284 -1.378 -0.324 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.178 -2.356 -3.249 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.707 -3.362 -1.858 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.561 -3.095 -3.193 1.00 0.00 H new ATOM 838 N ARG A 58 6.510 -0.300 0.948 1.00 0.00 N ATOM 839 CA ARG A 58 6.068 0.872 1.694 1.00 0.00 C ATOM 840 C ARG A 58 7.140 1.957 1.688 1.00 0.00 C ATOM 841 O ARG A 58 6.834 3.147 1.756 1.00 0.00 O ATOM 842 CB ARG A 58 5.725 0.486 3.135 1.00 0.00 C ATOM 843 CG ARG A 58 4.452 -0.334 3.259 1.00 0.00 C ATOM 844 CD ARG A 58 3.218 0.553 3.289 1.00 0.00 C ATOM 845 NE ARG A 58 2.130 -0.046 4.058 1.00 0.00 N ATOM 846 CZ ARG A 58 0.965 0.554 4.274 1.00 0.00 C ATOM 847 NH1 ARG A 58 0.737 1.763 3.781 1.00 0.00 N ATOM 848 NH2 ARG A 58 0.025 -0.057 4.984 1.00 0.00 N ATOM 0 H ARG A 58 7.143 -0.913 1.462 1.00 0.00 H new ATOM 0 HA ARG A 58 5.175 1.266 1.208 1.00 0.00 H new ATOM 0 HB2 ARG A 58 6.555 -0.081 3.558 1.00 0.00 H new ATOM 0 HB3 ARG A 58 5.622 1.393 3.731 1.00 0.00 H new ATOM 0 HG2 ARG A 58 4.382 -1.028 2.421 1.00 0.00 H new ATOM 0 HG3 ARG A 58 4.492 -0.934 4.168 1.00 0.00 H new ATOM 0 HD2 ARG A 58 3.477 1.520 3.721 1.00 0.00 H new ATOM 0 HD3 ARG A 58 2.881 0.739 2.269 1.00 0.00 H new ATOM 0 HE ARG A 58 2.273 -0.976 4.451 1.00 0.00 H new ATOM 0 HH11 ARG A 58 1.457 2.235 3.234 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -0.159 2.221 3.948 1.00 0.00 H new ATOM 0 HH21 ARG A 58 0.197 -0.988 5.364 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -0.870 0.404 5.150 1.00 0.00 H new ATOM 862 N GLY A 59 8.399 1.538 1.607 1.00 0.00 N ATOM 863 CA GLY A 59 9.498 2.486 1.595 1.00 0.00 C ATOM 864 C GLY A 59 10.851 1.805 1.641 1.00 0.00 C ATOM 865 O GLY A 59 10.937 0.577 1.655 1.00 0.00 O ATOM 0 H GLY A 59 8.678 0.559 1.549 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.434 3.100 0.697 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.404 3.158 2.448 1.00 0.00 H new ATOM 869 N TYR A 60 11.913 2.604 1.662 1.00 0.00 N ATOM 870 CA TYR A 60 13.269 2.072 1.703 1.00 0.00 C ATOM 871 C TYR A 60 14.067 2.698 2.843 1.00 0.00 C ATOM 872 O TYR A 60 13.672 3.720 3.403 1.00 0.00 O ATOM 873 CB TYR A 60 13.979 2.324 0.371 1.00 0.00 C ATOM 874 CG TYR A 60 13.133 1.994 -0.838 1.00 0.00 C ATOM 875 CD1 TYR A 60 12.921 0.675 -1.222 1.00 0.00 C ATOM 876 CD2 TYR A 60 12.546 2.999 -1.596 1.00 0.00 C ATOM 877 CE1 TYR A 60 12.150 0.368 -2.326 1.00 0.00 C ATOM 878 CE2 TYR A 60 11.771 2.701 -2.701 1.00 0.00 C ATOM 879 CZ TYR A 60 11.577 1.385 -3.062 1.00 0.00 C ATOM 880 OH TYR A 60 10.807 1.084 -4.162 1.00 0.00 O ATOM 0 H TYR A 60 11.860 3.623 1.651 1.00 0.00 H new ATOM 0 HA TYR A 60 13.205 0.998 1.876 1.00 0.00 H new ATOM 0 HB2 TYR A 60 14.277 3.371 0.320 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.893 1.730 0.338 1.00 0.00 H new ATOM 0 HD1 TYR A 60 13.367 -0.123 -0.647 1.00 0.00 H new ATOM 0 HD2 TYR A 60 12.698 4.031 -1.317 1.00 0.00 H new ATOM 0 HE1 TYR A 60 11.996 -0.662 -2.612 1.00 0.00 H new ATOM 0 HE2 TYR A 60 11.320 3.495 -3.278 1.00 0.00 H new ATOM 0 HH TYR A 60 10.477 1.913 -4.567 1.00 0.00 H new ATOM 890 N ALA A 61 15.192 2.076 3.180 1.00 0.00 N ATOM 891 CA ALA A 61 16.047 2.572 4.251 1.00 0.00 C ATOM 892 C ALA A 61 17.487 2.730 3.775 1.00 0.00 C ATOM 893 O ALA A 61 18.072 1.801 3.218 1.00 0.00 O ATOM 894 CB ALA A 61 15.985 1.638 5.451 1.00 0.00 C ATOM 0 H ALA A 61 15.532 1.228 2.727 1.00 0.00 H new ATOM 0 HA ALA A 61 15.681 3.554 4.550 1.00 0.00 H new ATOM 0 HB1 ALA A 61 16.628 2.021 6.243 1.00 0.00 H new ATOM 0 HB2 ALA A 61 14.959 1.579 5.813 1.00 0.00 H new ATOM 0 HB3 ALA A 61 16.324 0.645 5.157 1.00 0.00 H new ATOM 900 N ILE A 62 18.053 3.911 3.998 1.00 0.00 N ATOM 901 CA ILE A 62 19.424 4.190 3.592 1.00 0.00 C ATOM 902 C ILE A 62 20.340 4.326 4.804 1.00 0.00 C ATOM 903 O ILE A 62 20.221 5.272 5.581 1.00 0.00 O ATOM 904 CB ILE A 62 19.512 5.476 2.749 1.00 0.00 C ATOM 905 CG1 ILE A 62 18.616 5.365 1.514 1.00 0.00 C ATOM 906 CG2 ILE A 62 20.953 5.746 2.342 1.00 0.00 C ATOM 907 CD1 ILE A 62 18.058 6.693 1.051 1.00 0.00 C ATOM 0 H ILE A 62 17.583 4.690 4.458 1.00 0.00 H new ATOM 0 HA ILE A 62 19.751 3.345 2.986 1.00 0.00 H new ATOM 0 HB ILE A 62 19.163 6.313 3.354 1.00 0.00 H new ATOM 0 HG12 ILE A 62 19.186 4.916 0.701 1.00 0.00 H new ATOM 0 HG13 ILE A 62 17.789 4.690 1.734 1.00 0.00 H new ATOM 0 HG21 ILE A 62 20.998 6.658 1.747 1.00 0.00 H new ATOM 0 HG22 ILE A 62 21.567 5.864 3.235 1.00 0.00 H new ATOM 0 HG23 ILE A 62 21.327 4.909 1.752 1.00 0.00 H new ATOM 0 HD11 ILE A 62 17.432 6.538 0.172 1.00 0.00 H new ATOM 0 HD12 ILE A 62 17.460 7.134 1.848 1.00 0.00 H new ATOM 0 HD13 ILE A 62 18.879 7.364 0.799 1.00 0.00 H new ATOM 919 N GLY A 63 21.255 3.374 4.957 1.00 0.00 N ATOM 920 CA GLY A 63 22.179 3.406 6.076 1.00 0.00 C ATOM 921 C GLY A 63 23.556 3.899 5.676 1.00 0.00 C ATOM 922 O GLY A 63 24.151 3.394 4.724 1.00 0.00 O ATOM 0 H GLY A 63 21.373 2.581 4.326 1.00 0.00 H new ATOM 0 HA2 GLY A 63 21.778 4.052 6.857 1.00 0.00 H new ATOM 0 HA3 GLY A 63 22.264 2.406 6.502 1.00 0.00 H new ATOM 926 N TYR A 64 24.062 4.889 6.403 1.00 0.00 N ATOM 927 CA TYR A 64 25.376 5.453 6.117 1.00 0.00 C ATOM 928 C TYR A 64 26.203 5.581 7.392 1.00 0.00 C ATOM 929 O TYR A 64 25.661 5.751 8.484 1.00 0.00 O ATOM 930 CB TYR A 64 25.231 6.822 5.450 1.00 0.00 C ATOM 931 CG TYR A 64 24.675 7.887 6.367 1.00 0.00 C ATOM 932 CD1 TYR A 64 23.356 7.836 6.803 1.00 0.00 C ATOM 933 CD2 TYR A 64 25.466 8.944 6.798 1.00 0.00 C ATOM 934 CE1 TYR A 64 22.842 8.808 7.640 1.00 0.00 C ATOM 935 CE2 TYR A 64 24.962 9.919 7.636 1.00 0.00 C ATOM 936 CZ TYR A 64 23.649 9.847 8.055 1.00 0.00 C ATOM 937 OH TYR A 64 23.143 10.817 8.889 1.00 0.00 O ATOM 0 H TYR A 64 23.582 5.318 7.195 1.00 0.00 H new ATOM 0 HA TYR A 64 25.894 4.777 5.436 1.00 0.00 H new ATOM 0 HB2 TYR A 64 26.206 7.143 5.083 1.00 0.00 H new ATOM 0 HB3 TYR A 64 24.580 6.726 4.581 1.00 0.00 H new ATOM 0 HD1 TYR A 64 22.722 7.023 6.482 1.00 0.00 H new ATOM 0 HD2 TYR A 64 26.494 9.005 6.472 1.00 0.00 H new ATOM 0 HE1 TYR A 64 21.814 8.755 7.967 1.00 0.00 H new ATOM 0 HE2 TYR A 64 25.592 10.734 7.962 1.00 0.00 H new ATOM 0 HH TYR A 64 23.842 11.475 9.087 1.00 0.00 H new ATOM 947 N GLY A 65 27.522 5.499 7.245 1.00 0.00 N ATOM 948 CA GLY A 65 28.405 5.608 8.392 1.00 0.00 C ATOM 949 C GLY A 65 29.814 5.142 8.085 1.00 0.00 C ATOM 950 O GLY A 65 30.008 4.119 7.428 1.00 0.00 O ATOM 0 H GLY A 65 27.995 5.359 6.352 1.00 0.00 H new ATOM 0 HA2 GLY A 65 28.433 6.645 8.727 1.00 0.00 H new ATOM 0 HA3 GLY A 65 28.002 5.018 9.215 1.00 0.00 H new ATOM 954 N ILE A 66 30.801 5.895 8.560 1.00 0.00 N ATOM 955 CA ILE A 66 32.200 5.553 8.331 1.00 0.00 C ATOM 956 C ILE A 66 32.546 4.208 8.960 1.00 0.00 C ATOM 957 O ILE A 66 32.680 4.095 10.177 1.00 0.00 O ATOM 958 CB ILE A 66 33.142 6.630 8.899 1.00 0.00 C ATOM 959 CG1 ILE A 66 32.752 8.011 8.369 1.00 0.00 C ATOM 960 CG2 ILE A 66 34.587 6.310 8.546 1.00 0.00 C ATOM 961 CD1 ILE A 66 33.098 9.141 9.313 1.00 0.00 C ATOM 0 H ILE A 66 30.658 6.745 9.105 1.00 0.00 H new ATOM 0 HA ILE A 66 32.339 5.493 7.251 1.00 0.00 H new ATOM 0 HB ILE A 66 33.047 6.638 9.985 1.00 0.00 H new ATOM 0 HG12 ILE A 66 33.252 8.179 7.415 1.00 0.00 H new ATOM 0 HG13 ILE A 66 31.680 8.027 8.174 1.00 0.00 H new ATOM 0 HG21 ILE A 66 35.241 7.081 8.955 1.00 0.00 H new ATOM 0 HG22 ILE A 66 34.859 5.342 8.968 1.00 0.00 H new ATOM 0 HG23 ILE A 66 34.698 6.277 7.462 1.00 0.00 H new ATOM 0 HD11 ILE A 66 32.793 10.090 8.872 1.00 0.00 H new ATOM 0 HD12 ILE A 66 32.577 8.997 10.260 1.00 0.00 H new ATOM 0 HD13 ILE A 66 34.174 9.152 9.489 1.00 0.00 H new ATOM 973 N GLY A 67 32.692 3.188 8.119 1.00 0.00 N ATOM 974 CA GLY A 67 33.024 1.863 8.610 1.00 0.00 C ATOM 975 C GLY A 67 31.864 0.895 8.495 1.00 0.00 C ATOM 976 O GLY A 67 32.026 -0.223 8.007 1.00 0.00 O ATOM 0 H GLY A 67 32.586 3.256 7.107 1.00 0.00 H new ATOM 0 HA2 GLY A 67 33.875 1.474 8.050 1.00 0.00 H new ATOM 0 HA3 GLY A 67 33.333 1.932 9.653 1.00 0.00 H new ATOM 980 N SER A 68 30.690 1.323 8.948 1.00 0.00 N ATOM 981 CA SER A 68 29.499 0.484 8.899 1.00 0.00 C ATOM 982 C SER A 68 28.244 1.332 8.717 1.00 0.00 C ATOM 983 O SER A 68 28.115 2.424 9.272 1.00 0.00 O ATOM 984 CB SER A 68 29.384 -0.350 10.177 1.00 0.00 C ATOM 985 OG SER A 68 30.087 -1.574 10.052 1.00 0.00 O ATOM 0 H SER A 68 30.538 2.247 9.353 1.00 0.00 H new ATOM 0 HA SER A 68 29.591 -0.185 8.044 1.00 0.00 H new ATOM 0 HB2 SER A 68 29.779 0.215 11.021 1.00 0.00 H new ATOM 0 HB3 SER A 68 28.334 -0.550 10.391 1.00 0.00 H new ATOM 0 HG SER A 68 30.835 -1.460 9.429 1.00 0.00 H new ATOM 991 N PRO A 69 27.294 0.819 7.921 1.00 0.00 N ATOM 992 CA PRO A 69 26.032 1.512 7.646 1.00 0.00 C ATOM 993 C PRO A 69 25.119 1.559 8.867 1.00 0.00 C ATOM 994 O PRO A 69 24.412 2.542 9.089 1.00 0.00 O ATOM 995 CB PRO A 69 25.398 0.668 6.538 1.00 0.00 C ATOM 996 CG PRO A 69 25.983 -0.691 6.714 1.00 0.00 C ATOM 997 CD PRO A 69 27.380 -0.477 7.227 1.00 0.00 C ATOM 0 HA PRO A 69 26.191 2.554 7.369 1.00 0.00 H new ATOM 0 HB2 PRO A 69 24.312 0.646 6.629 1.00 0.00 H new ATOM 0 HB3 PRO A 69 25.627 1.073 5.552 1.00 0.00 H new ATOM 0 HG2 PRO A 69 25.395 -1.281 7.417 1.00 0.00 H new ATOM 0 HG3 PRO A 69 25.993 -1.237 5.771 1.00 0.00 H new ATOM 0 HD2 PRO A 69 27.686 -1.275 7.903 1.00 0.00 H new ATOM 0 HD3 PRO A 69 28.107 -0.451 6.415 1.00 0.00 H new ATOM 1005 N HIS A 70 25.140 0.490 9.658 1.00 0.00 N ATOM 1006 CA HIS A 70 24.315 0.411 10.858 1.00 0.00 C ATOM 1007 C HIS A 70 24.319 1.739 11.609 1.00 0.00 C ATOM 1008 O HIS A 70 23.387 2.045 12.352 1.00 0.00 O ATOM 1009 CB HIS A 70 24.815 -0.708 11.773 1.00 0.00 C ATOM 1010 CG HIS A 70 24.391 -2.075 11.334 1.00 0.00 C ATOM 1011 ND1 HIS A 70 23.283 -2.720 11.843 1.00 0.00 N ATOM 1012 CD2 HIS A 70 24.932 -2.921 10.426 1.00 0.00 C ATOM 1013 CE1 HIS A 70 23.163 -3.904 11.269 1.00 0.00 C ATOM 1014 NE2 HIS A 70 24.150 -4.050 10.404 1.00 0.00 N ATOM 0 H HIS A 70 25.719 -0.333 9.489 1.00 0.00 H new ATOM 0 HA HIS A 70 23.292 0.190 10.552 1.00 0.00 H new ATOM 0 HB2 HIS A 70 25.903 -0.671 11.817 1.00 0.00 H new ATOM 0 HB3 HIS A 70 24.449 -0.530 12.784 1.00 0.00 H new ATOM 0 HD2 HIS A 70 25.814 -2.742 9.830 1.00 0.00 H new ATOM 0 HE1 HIS A 70 22.389 -4.629 11.473 1.00 0.00 H new ATOM 0 HE2 HIS A 70 24.306 -4.868 9.815 1.00 0.00 H new ATOM 1023 N ALA A 71 25.373 2.523 11.409 1.00 0.00 N ATOM 1024 CA ALA A 71 25.497 3.818 12.066 1.00 0.00 C ATOM 1025 C ALA A 71 24.140 4.500 12.196 1.00 0.00 C ATOM 1026 O ALA A 71 23.704 4.829 13.299 1.00 0.00 O ATOM 1027 CB ALA A 71 26.466 4.707 11.301 1.00 0.00 C ATOM 0 H ALA A 71 26.153 2.284 10.797 1.00 0.00 H new ATOM 0 HA ALA A 71 25.888 3.652 13.070 1.00 0.00 H new ATOM 0 HB1 ALA A 71 26.549 5.671 11.803 1.00 0.00 H new ATOM 0 HB2 ALA A 71 27.446 4.231 11.265 1.00 0.00 H new ATOM 0 HB3 ALA A 71 26.098 4.857 10.286 1.00 0.00 H new ATOM 1033 N GLN A 72 23.477 4.709 11.063 1.00 0.00 N ATOM 1034 CA GLN A 72 22.169 5.354 11.052 1.00 0.00 C ATOM 1035 C GLN A 72 21.293 4.787 9.940 1.00 0.00 C ATOM 1036 O GLN A 72 21.773 4.074 9.058 1.00 0.00 O ATOM 1037 CB GLN A 72 22.324 6.865 10.875 1.00 0.00 C ATOM 1038 CG GLN A 72 22.949 7.557 12.076 1.00 0.00 C ATOM 1039 CD GLN A 72 22.056 7.522 13.300 1.00 0.00 C ATOM 1040 OE1 GLN A 72 20.933 8.028 13.279 1.00 0.00 O ATOM 1041 NE2 GLN A 72 22.550 6.922 14.377 1.00 0.00 N ATOM 0 H GLN A 72 23.824 4.441 10.142 1.00 0.00 H new ATOM 0 HA GLN A 72 21.685 5.155 12.008 1.00 0.00 H new ATOM 0 HB2 GLN A 72 22.937 7.058 9.995 1.00 0.00 H new ATOM 0 HB3 GLN A 72 21.344 7.302 10.683 1.00 0.00 H new ATOM 0 HG2 GLN A 72 23.900 7.079 12.311 1.00 0.00 H new ATOM 0 HG3 GLN A 72 23.168 8.594 11.820 1.00 0.00 H new ATOM 0 HE21 GLN A 72 23.485 6.516 14.351 1.00 0.00 H new ATOM 0 HE22 GLN A 72 21.994 6.867 15.230 1.00 0.00 H new ATOM 1050 N THR A 73 20.004 5.109 9.987 1.00 0.00 N ATOM 1051 CA THR A 73 19.059 4.631 8.985 1.00 0.00 C ATOM 1052 C THR A 73 18.134 5.751 8.522 1.00 0.00 C ATOM 1053 O THR A 73 17.501 6.422 9.338 1.00 0.00 O ATOM 1054 CB THR A 73 18.208 3.467 9.525 1.00 0.00 C ATOM 1055 OG1 THR A 73 19.050 2.361 9.867 1.00 0.00 O ATOM 1056 CG2 THR A 73 17.177 3.028 8.496 1.00 0.00 C ATOM 0 H THR A 73 19.590 5.699 10.709 1.00 0.00 H new ATOM 0 HA THR A 73 19.648 4.278 8.139 1.00 0.00 H new ATOM 0 HB THR A 73 17.684 3.812 10.416 1.00 0.00 H new ATOM 0 HG1 THR A 73 18.501 1.626 10.211 1.00 0.00 H new ATOM 0 HG21 THR A 73 16.588 2.205 8.900 1.00 0.00 H new ATOM 0 HG22 THR A 73 16.519 3.864 8.261 1.00 0.00 H new ATOM 0 HG23 THR A 73 17.685 2.700 7.589 1.00 0.00 H new ATOM 1064 N ILE A 74 18.060 5.948 7.210 1.00 0.00 N ATOM 1065 CA ILE A 74 17.211 6.986 6.641 1.00 0.00 C ATOM 1066 C ILE A 74 16.044 6.379 5.869 1.00 0.00 C ATOM 1067 O ILE A 74 16.223 5.826 4.783 1.00 0.00 O ATOM 1068 CB ILE A 74 18.006 7.912 5.702 1.00 0.00 C ATOM 1069 CG1 ILE A 74 19.113 8.630 6.476 1.00 0.00 C ATOM 1070 CG2 ILE A 74 17.077 8.919 5.040 1.00 0.00 C ATOM 1071 CD1 ILE A 74 20.084 9.377 5.589 1.00 0.00 C ATOM 0 H ILE A 74 18.578 5.402 6.521 1.00 0.00 H new ATOM 0 HA ILE A 74 16.827 7.572 7.476 1.00 0.00 H new ATOM 0 HB ILE A 74 18.468 7.305 4.923 1.00 0.00 H new ATOM 0 HG12 ILE A 74 18.659 9.332 7.176 1.00 0.00 H new ATOM 0 HG13 ILE A 74 19.663 7.899 7.069 1.00 0.00 H new ATOM 0 HG21 ILE A 74 17.654 9.566 4.379 1.00 0.00 H new ATOM 0 HG22 ILE A 74 16.321 8.390 4.460 1.00 0.00 H new ATOM 0 HG23 ILE A 74 16.590 9.523 5.806 1.00 0.00 H new ATOM 0 HD11 ILE A 74 20.841 9.862 6.205 1.00 0.00 H new ATOM 0 HD12 ILE A 74 20.566 8.677 4.906 1.00 0.00 H new ATOM 0 HD13 ILE A 74 19.546 10.132 5.015 1.00 0.00 H new ATOM 1083 N LYS A 75 14.847 6.487 6.435 1.00 0.00 N ATOM 1084 CA LYS A 75 13.648 5.953 5.800 1.00 0.00 C ATOM 1085 C LYS A 75 12.736 7.079 5.324 1.00 0.00 C ATOM 1086 O LYS A 75 12.538 8.070 6.027 1.00 0.00 O ATOM 1087 CB LYS A 75 12.891 5.046 6.774 1.00 0.00 C ATOM 1088 CG LYS A 75 13.800 4.228 7.675 1.00 0.00 C ATOM 1089 CD LYS A 75 13.009 3.482 8.736 1.00 0.00 C ATOM 1090 CE LYS A 75 12.608 2.094 8.259 1.00 0.00 C ATOM 1091 NZ LYS A 75 13.710 1.108 8.437 1.00 0.00 N ATOM 0 H LYS A 75 14.681 6.940 7.334 1.00 0.00 H new ATOM 0 HA LYS A 75 13.956 5.368 4.933 1.00 0.00 H new ATOM 0 HB2 LYS A 75 12.236 5.659 7.393 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.252 4.370 6.206 1.00 0.00 H new ATOM 0 HG2 LYS A 75 14.365 3.516 7.073 1.00 0.00 H new ATOM 0 HG3 LYS A 75 14.525 4.885 8.155 1.00 0.00 H new ATOM 0 HD2 LYS A 75 13.606 3.398 9.644 1.00 0.00 H new ATOM 0 HD3 LYS A 75 12.116 4.052 8.993 1.00 0.00 H new ATOM 0 HE2 LYS A 75 11.729 1.760 8.810 1.00 0.00 H new ATOM 0 HE3 LYS A 75 12.326 2.138 7.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 13.972 0.710 7.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 14.535 1.582 8.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 13.393 0.343 9.066 1.00 0.00 H new ATOM 1105 N VAL A 76 12.182 6.919 4.126 1.00 0.00 N ATOM 1106 CA VAL A 76 11.289 7.921 3.557 1.00 0.00 C ATOM 1107 C VAL A 76 10.024 7.277 3.000 1.00 0.00 C ATOM 1108 O VAL A 76 8.963 7.331 3.622 1.00 0.00 O ATOM 1109 CB VAL A 76 11.982 8.719 2.437 1.00 0.00 C ATOM 1110 CG1 VAL A 76 12.648 9.965 3.001 1.00 0.00 C ATOM 1111 CG2 VAL A 76 12.994 7.847 1.709 1.00 0.00 C ATOM 0 H VAL A 76 12.336 6.105 3.531 1.00 0.00 H new ATOM 0 HA VAL A 76 11.021 8.602 4.365 1.00 0.00 H new ATOM 0 HB VAL A 76 11.225 9.035 1.719 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.132 10.516 2.194 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.896 10.598 3.472 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.394 9.675 3.741 1.00 0.00 H new ATOM 0 HG21 VAL A 76 13.474 8.427 0.921 1.00 0.00 H new ATOM 0 HG22 VAL A 76 13.749 7.499 2.414 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.485 6.989 1.269 1.00 0.00 H new ATOM 1121 N ASP A 77 10.145 6.668 1.826 1.00 0.00 N ATOM 1122 CA ASP A 77 9.012 6.012 1.185 1.00 0.00 C ATOM 1123 C ASP A 77 9.447 5.298 -0.091 1.00 0.00 C ATOM 1124 O ASP A 77 10.635 5.250 -0.412 1.00 0.00 O ATOM 1125 CB ASP A 77 7.918 7.032 0.865 1.00 0.00 C ATOM 1126 CG ASP A 77 6.947 7.219 2.014 1.00 0.00 C ATOM 1127 OD1 ASP A 77 6.255 6.243 2.370 1.00 0.00 O ATOM 1128 OD2 ASP A 77 6.878 8.342 2.556 1.00 0.00 O ATOM 0 H ASP A 77 11.017 6.615 1.299 1.00 0.00 H new ATOM 0 HA ASP A 77 8.615 5.270 1.878 1.00 0.00 H new ATOM 0 HB2 ASP A 77 8.378 7.990 0.622 1.00 0.00 H new ATOM 0 HB3 ASP A 77 7.371 6.708 -0.020 1.00 0.00 H new ATOM 1133 N TYR A 78 8.480 4.744 -0.812 1.00 0.00 N ATOM 1134 CA TYR A 78 8.764 4.029 -2.051 1.00 0.00 C ATOM 1135 C TYR A 78 8.861 4.995 -3.228 1.00 0.00 C ATOM 1136 O TYR A 78 9.488 4.694 -4.244 1.00 0.00 O ATOM 1137 CB TYR A 78 7.679 2.985 -2.322 1.00 0.00 C ATOM 1138 CG TYR A 78 6.281 3.560 -2.358 1.00 0.00 C ATOM 1139 CD1 TYR A 78 5.519 3.660 -1.201 1.00 0.00 C ATOM 1140 CD2 TYR A 78 5.722 4.005 -3.550 1.00 0.00 C ATOM 1141 CE1 TYR A 78 4.241 4.184 -1.229 1.00 0.00 C ATOM 1142 CE2 TYR A 78 4.445 4.532 -3.588 1.00 0.00 C ATOM 1143 CZ TYR A 78 3.709 4.619 -2.425 1.00 0.00 C ATOM 1144 OH TYR A 78 2.437 5.143 -2.458 1.00 0.00 O ATOM 0 H TYR A 78 7.492 4.776 -0.560 1.00 0.00 H new ATOM 0 HA TYR A 78 9.724 3.525 -1.938 1.00 0.00 H new ATOM 0 HB2 TYR A 78 7.886 2.496 -3.274 1.00 0.00 H new ATOM 0 HB3 TYR A 78 7.727 2.215 -1.552 1.00 0.00 H new ATOM 0 HD1 TYR A 78 5.933 3.322 -0.263 1.00 0.00 H new ATOM 0 HD2 TYR A 78 6.296 3.938 -4.463 1.00 0.00 H new ATOM 0 HE1 TYR A 78 3.662 4.253 -0.320 1.00 0.00 H new ATOM 0 HE2 TYR A 78 4.026 4.874 -4.523 1.00 0.00 H new ATOM 0 HH TYR A 78 2.214 5.403 -3.376 1.00 0.00 H new ATOM 1154 N LYS A 79 8.237 6.159 -3.082 1.00 0.00 N ATOM 1155 CA LYS A 79 8.253 7.173 -4.130 1.00 0.00 C ATOM 1156 C LYS A 79 9.635 7.806 -4.253 1.00 0.00 C ATOM 1157 O LYS A 79 10.145 7.993 -5.357 1.00 0.00 O ATOM 1158 CB LYS A 79 7.209 8.253 -3.839 1.00 0.00 C ATOM 1159 CG LYS A 79 5.778 7.744 -3.879 1.00 0.00 C ATOM 1160 CD LYS A 79 4.794 8.866 -4.163 1.00 0.00 C ATOM 1161 CE LYS A 79 3.370 8.459 -3.818 1.00 0.00 C ATOM 1162 NZ LYS A 79 2.414 9.588 -3.988 1.00 0.00 N ATOM 0 H LYS A 79 7.714 6.424 -2.248 1.00 0.00 H new ATOM 0 HA LYS A 79 8.010 6.687 -5.075 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.406 8.681 -2.856 1.00 0.00 H new ATOM 0 HB3 LYS A 79 7.320 9.058 -4.565 1.00 0.00 H new ATOM 0 HG2 LYS A 79 5.686 6.975 -4.646 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.531 7.275 -2.927 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.071 9.749 -3.587 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.850 9.142 -5.216 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.066 7.627 -4.453 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.333 8.104 -2.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 1.454 9.270 -3.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 2.689 10.373 -3.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 2.430 9.911 -4.977 1.00 0.00 H new ATOM 1176 N GLN A 80 10.235 8.133 -3.113 1.00 0.00 N ATOM 1177 CA GLN A 80 11.558 8.744 -3.094 1.00 0.00 C ATOM 1178 C GLN A 80 12.539 7.945 -3.946 1.00 0.00 C ATOM 1179 O GLN A 80 12.713 6.742 -3.747 1.00 0.00 O ATOM 1180 CB GLN A 80 12.076 8.846 -1.659 1.00 0.00 C ATOM 1181 CG GLN A 80 11.515 10.033 -0.892 1.00 0.00 C ATOM 1182 CD GLN A 80 11.497 11.304 -1.717 1.00 0.00 C ATOM 1183 OE1 GLN A 80 12.544 11.813 -2.119 1.00 0.00 O ATOM 1184 NE2 GLN A 80 10.303 11.825 -1.976 1.00 0.00 N ATOM 0 H GLN A 80 9.826 7.985 -2.191 1.00 0.00 H new ATOM 0 HA GLN A 80 11.473 9.746 -3.514 1.00 0.00 H new ATOM 0 HB2 GLN A 80 11.827 7.929 -1.126 1.00 0.00 H new ATOM 0 HB3 GLN A 80 13.163 8.918 -1.678 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.501 9.803 -0.564 1.00 0.00 H new ATOM 0 HG3 GLN A 80 12.111 10.195 0.006 1.00 0.00 H new ATOM 0 HE21 GLN A 80 9.461 11.370 -1.623 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.228 12.680 -2.528 1.00 0.00 H new ATOM 1193 N ARG A 81 13.178 8.621 -4.896 1.00 0.00 N ATOM 1194 CA ARG A 81 14.140 7.973 -5.779 1.00 0.00 C ATOM 1195 C ARG A 81 15.566 8.183 -5.277 1.00 0.00 C ATOM 1196 O ARG A 81 16.416 7.302 -5.405 1.00 0.00 O ATOM 1197 CB ARG A 81 14.004 8.516 -7.202 1.00 0.00 C ATOM 1198 CG ARG A 81 14.377 7.507 -8.277 1.00 0.00 C ATOM 1199 CD ARG A 81 14.951 8.191 -9.507 1.00 0.00 C ATOM 1200 NE ARG A 81 14.695 7.430 -10.727 1.00 0.00 N ATOM 1201 CZ ARG A 81 15.003 7.864 -11.944 1.00 0.00 C ATOM 1202 NH1 ARG A 81 15.577 9.049 -12.102 1.00 0.00 N ATOM 1203 NH2 ARG A 81 14.739 7.113 -13.005 1.00 0.00 N ATOM 0 H ARG A 81 13.047 9.617 -5.073 1.00 0.00 H new ATOM 0 HA ARG A 81 13.928 6.904 -5.784 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.976 8.841 -7.361 1.00 0.00 H new ATOM 0 HB3 ARG A 81 14.637 9.397 -7.308 1.00 0.00 H new ATOM 0 HG2 ARG A 81 15.106 6.801 -7.878 1.00 0.00 H new ATOM 0 HG3 ARG A 81 13.496 6.930 -8.558 1.00 0.00 H new ATOM 0 HD2 ARG A 81 14.518 9.187 -9.603 1.00 0.00 H new ATOM 0 HD3 ARG A 81 16.026 8.322 -9.380 1.00 0.00 H new ATOM 0 HE ARG A 81 14.255 6.514 -10.640 1.00 0.00 H new ATOM 0 HH11 ARG A 81 15.783 9.629 -11.288 1.00 0.00 H new ATOM 0 HH12 ARG A 81 15.813 9.381 -13.037 1.00 0.00 H new ATOM 0 HH21 ARG A 81 14.299 6.201 -12.887 1.00 0.00 H new ATOM 0 HH22 ARG A 81 14.976 7.448 -13.939 1.00 0.00 H new ATOM 1217 N TYR A 82 15.820 9.356 -4.707 1.00 0.00 N ATOM 1218 CA TYR A 82 17.143 9.684 -4.189 1.00 0.00 C ATOM 1219 C TYR A 82 17.038 10.544 -2.933 1.00 0.00 C ATOM 1220 O TYR A 82 16.008 11.168 -2.679 1.00 0.00 O ATOM 1221 CB TYR A 82 17.964 10.413 -5.254 1.00 0.00 C ATOM 1222 CG TYR A 82 17.688 11.898 -5.320 1.00 0.00 C ATOM 1223 CD1 TYR A 82 16.605 12.392 -6.036 1.00 0.00 C ATOM 1224 CD2 TYR A 82 18.509 12.807 -4.665 1.00 0.00 C ATOM 1225 CE1 TYR A 82 16.349 13.748 -6.100 1.00 0.00 C ATOM 1226 CE2 TYR A 82 18.261 14.165 -4.722 1.00 0.00 C ATOM 1227 CZ TYR A 82 17.180 14.630 -5.441 1.00 0.00 C ATOM 1228 OH TYR A 82 16.928 15.982 -5.501 1.00 0.00 O ATOM 0 H TYR A 82 15.127 10.096 -4.592 1.00 0.00 H new ATOM 0 HA TYR A 82 17.645 8.752 -3.928 1.00 0.00 H new ATOM 0 HB2 TYR A 82 19.024 10.258 -5.053 1.00 0.00 H new ATOM 0 HB3 TYR A 82 17.756 9.970 -6.228 1.00 0.00 H new ATOM 0 HD1 TYR A 82 15.952 11.704 -6.552 1.00 0.00 H new ATOM 0 HD2 TYR A 82 19.356 12.446 -4.101 1.00 0.00 H new ATOM 0 HE1 TYR A 82 15.503 14.115 -6.663 1.00 0.00 H new ATOM 0 HE2 TYR A 82 18.910 14.858 -4.207 1.00 0.00 H new ATOM 0 HH TYR A 82 17.606 16.464 -4.983 1.00 0.00 H new ATOM 1238 N TYR A 83 18.113 10.572 -2.153 1.00 0.00 N ATOM 1239 CA TYR A 83 18.143 11.354 -0.922 1.00 0.00 C ATOM 1240 C TYR A 83 19.490 12.050 -0.752 1.00 0.00 C ATOM 1241 O TYR A 83 20.545 11.435 -0.911 1.00 0.00 O ATOM 1242 CB TYR A 83 17.864 10.456 0.284 1.00 0.00 C ATOM 1243 CG TYR A 83 17.719 11.216 1.583 1.00 0.00 C ATOM 1244 CD1 TYR A 83 16.499 11.766 1.957 1.00 0.00 C ATOM 1245 CD2 TYR A 83 18.802 11.384 2.437 1.00 0.00 C ATOM 1246 CE1 TYR A 83 16.362 12.461 3.142 1.00 0.00 C ATOM 1247 CE2 TYR A 83 18.674 12.077 3.626 1.00 0.00 C ATOM 1248 CZ TYR A 83 17.452 12.614 3.974 1.00 0.00 C ATOM 1249 OH TYR A 83 17.320 13.305 5.156 1.00 0.00 O ATOM 0 H TYR A 83 18.974 10.063 -2.351 1.00 0.00 H new ATOM 0 HA TYR A 83 17.366 12.116 -0.986 1.00 0.00 H new ATOM 0 HB2 TYR A 83 16.952 9.889 0.101 1.00 0.00 H new ATOM 0 HB3 TYR A 83 18.674 9.733 0.384 1.00 0.00 H new ATOM 0 HD1 TYR A 83 15.643 11.648 1.309 1.00 0.00 H new ATOM 0 HD2 TYR A 83 19.760 10.966 2.167 1.00 0.00 H new ATOM 0 HE1 TYR A 83 15.406 12.883 3.416 1.00 0.00 H new ATOM 0 HE2 TYR A 83 19.526 12.197 4.279 1.00 0.00 H new ATOM 0 HH TYR A 83 18.181 13.320 5.624 1.00 0.00 H new ATOM 1259 N THR A 84 19.447 13.338 -0.427 1.00 0.00 N ATOM 1260 CA THR A 84 20.662 14.119 -0.235 1.00 0.00 C ATOM 1261 C THR A 84 21.098 14.109 1.226 1.00 0.00 C ATOM 1262 O THR A 84 20.436 14.693 2.084 1.00 0.00 O ATOM 1263 CB THR A 84 20.470 15.578 -0.692 1.00 0.00 C ATOM 1264 OG1 THR A 84 20.105 15.614 -2.076 1.00 0.00 O ATOM 1265 CG2 THR A 84 21.742 16.384 -0.476 1.00 0.00 C ATOM 0 H THR A 84 18.583 13.863 -0.291 1.00 0.00 H new ATOM 0 HA THR A 84 21.436 13.654 -0.845 1.00 0.00 H new ATOM 0 HB THR A 84 19.672 16.021 -0.095 1.00 0.00 H new ATOM 0 HG1 THR A 84 19.983 16.545 -2.358 1.00 0.00 H new ATOM 0 HG21 THR A 84 21.583 17.411 -0.806 1.00 0.00 H new ATOM 0 HG22 THR A 84 22.000 16.379 0.583 1.00 0.00 H new ATOM 0 HG23 THR A 84 22.556 15.941 -1.050 1.00 0.00 H new ATOM 1273 N ILE A 85 22.214 13.443 1.501 1.00 0.00 N ATOM 1274 CA ILE A 85 22.738 13.359 2.858 1.00 0.00 C ATOM 1275 C ILE A 85 23.685 14.517 3.155 1.00 0.00 C ATOM 1276 O ILE A 85 24.813 14.550 2.664 1.00 0.00 O ATOM 1277 CB ILE A 85 23.480 12.030 3.094 1.00 0.00 C ATOM 1278 CG1 ILE A 85 22.615 10.851 2.645 1.00 0.00 C ATOM 1279 CG2 ILE A 85 23.859 11.888 4.561 1.00 0.00 C ATOM 1280 CD1 ILE A 85 23.333 9.521 2.697 1.00 0.00 C ATOM 0 H ILE A 85 22.773 12.954 0.802 1.00 0.00 H new ATOM 0 HA ILE A 85 21.882 13.412 3.530 1.00 0.00 H new ATOM 0 HB ILE A 85 24.395 12.031 2.501 1.00 0.00 H new ATOM 0 HG12 ILE A 85 21.728 10.801 3.276 1.00 0.00 H new ATOM 0 HG13 ILE A 85 22.272 11.030 1.626 1.00 0.00 H new ATOM 0 HG21 ILE A 85 24.383 10.944 4.712 1.00 0.00 H new ATOM 0 HG22 ILE A 85 24.509 12.714 4.850 1.00 0.00 H new ATOM 0 HG23 ILE A 85 22.957 11.905 5.173 1.00 0.00 H new ATOM 0 HD11 ILE A 85 22.660 8.731 2.365 1.00 0.00 H new ATOM 0 HD12 ILE A 85 24.205 9.553 2.044 1.00 0.00 H new ATOM 0 HD13 ILE A 85 23.653 9.320 3.719 1.00 0.00 H new ATOM 1292 N GLU A 86 23.218 15.464 3.962 1.00 0.00 N ATOM 1293 CA GLU A 86 24.025 16.624 4.325 1.00 0.00 C ATOM 1294 C GLU A 86 24.582 16.479 5.738 1.00 0.00 C ATOM 1295 O GLU A 86 24.214 15.561 6.470 1.00 0.00 O ATOM 1296 CB GLU A 86 23.193 17.904 4.221 1.00 0.00 C ATOM 1297 CG GLU A 86 22.735 18.219 2.807 1.00 0.00 C ATOM 1298 CD GLU A 86 22.143 19.610 2.682 1.00 0.00 C ATOM 1299 OE1 GLU A 86 22.787 20.573 3.149 1.00 0.00 O ATOM 1300 OE2 GLU A 86 21.035 19.735 2.119 1.00 0.00 O ATOM 0 H GLU A 86 22.286 15.451 4.377 1.00 0.00 H new ATOM 0 HA GLU A 86 24.861 16.685 3.629 1.00 0.00 H new ATOM 0 HB2 GLU A 86 22.319 17.812 4.865 1.00 0.00 H new ATOM 0 HB3 GLU A 86 23.781 18.741 4.599 1.00 0.00 H new ATOM 0 HG2 GLU A 86 23.581 18.126 2.126 1.00 0.00 H new ATOM 0 HG3 GLU A 86 21.993 17.483 2.497 1.00 0.00 H new ATOM 1307 N ASN A 87 25.471 17.392 6.114 1.00 0.00 N ATOM 1308 CA ASN A 87 26.080 17.366 7.439 1.00 0.00 C ATOM 1309 C ASN A 87 27.129 16.262 7.534 1.00 0.00 C ATOM 1310 O ASN A 87 27.214 15.556 8.540 1.00 0.00 O ATOM 1311 CB ASN A 87 25.009 17.161 8.511 1.00 0.00 C ATOM 1312 CG ASN A 87 23.763 17.985 8.250 1.00 0.00 C ATOM 1313 OD1 ASN A 87 23.691 19.156 8.623 1.00 0.00 O ATOM 1314 ND2 ASN A 87 22.775 17.376 7.606 1.00 0.00 N ATOM 0 H ASN A 87 25.786 18.159 5.520 1.00 0.00 H new ATOM 0 HA ASN A 87 26.571 18.325 7.605 1.00 0.00 H new ATOM 0 HB2 ASN A 87 24.740 16.106 8.555 1.00 0.00 H new ATOM 0 HB3 ASN A 87 25.419 17.426 9.485 1.00 0.00 H new ATOM 0 HD21 ASN A 87 21.912 17.880 7.402 1.00 0.00 H new ATOM 0 HD22 ASN A 87 22.879 16.404 7.315 1.00 0.00 H new ATOM 1321 N LEU A 88 27.926 16.119 6.481 1.00 0.00 N ATOM 1322 CA LEU A 88 28.971 15.101 6.445 1.00 0.00 C ATOM 1323 C LEU A 88 30.348 15.740 6.295 1.00 0.00 C ATOM 1324 O LEU A 88 30.470 16.878 5.841 1.00 0.00 O ATOM 1325 CB LEU A 88 28.721 14.126 5.293 1.00 0.00 C ATOM 1326 CG LEU A 88 27.286 13.619 5.143 1.00 0.00 C ATOM 1327 CD1 LEU A 88 27.099 12.938 3.796 1.00 0.00 C ATOM 1328 CD2 LEU A 88 26.936 12.667 6.277 1.00 0.00 C ATOM 0 H LEU A 88 27.869 16.695 5.641 1.00 0.00 H new ATOM 0 HA LEU A 88 28.945 14.555 7.388 1.00 0.00 H new ATOM 0 HB2 LEU A 88 29.013 14.612 4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 88 29.378 13.266 5.423 1.00 0.00 H new ATOM 0 HG LEU A 88 26.612 14.474 5.192 1.00 0.00 H new ATOM 0 HD11 LEU A 88 26.072 12.584 3.707 1.00 0.00 H new ATOM 0 HD12 LEU A 88 27.308 13.649 2.997 1.00 0.00 H new ATOM 0 HD13 LEU A 88 27.783 12.093 3.718 1.00 0.00 H new ATOM 0 HD21 LEU A 88 25.911 12.316 6.154 1.00 0.00 H new ATOM 0 HD22 LEU A 88 27.616 11.815 6.260 1.00 0.00 H new ATOM 0 HD23 LEU A 88 27.030 13.187 7.230 1.00 0.00 H new ATOM 1340 N ASP A 89 31.382 15.000 6.679 1.00 0.00 N ATOM 1341 CA ASP A 89 32.752 15.492 6.584 1.00 0.00 C ATOM 1342 C ASP A 89 33.372 15.119 5.241 1.00 0.00 C ATOM 1343 O ASP A 89 33.233 13.996 4.757 1.00 0.00 O ATOM 1344 CB ASP A 89 33.599 14.928 7.726 1.00 0.00 C ATOM 1345 CG ASP A 89 34.879 15.712 7.939 1.00 0.00 C ATOM 1346 OD1 ASP A 89 34.818 16.788 8.570 1.00 0.00 O ATOM 1347 OD2 ASP A 89 35.942 15.250 7.474 1.00 0.00 O ATOM 0 H ASP A 89 31.298 14.057 7.059 1.00 0.00 H new ATOM 0 HA ASP A 89 32.728 16.579 6.662 1.00 0.00 H new ATOM 0 HB2 ASP A 89 33.014 14.935 8.646 1.00 0.00 H new ATOM 0 HB3 ASP A 89 33.845 13.888 7.513 1.00 0.00 H new ATOM 1352 N PRO A 90 34.073 16.082 4.625 1.00 0.00 N ATOM 1353 CA PRO A 90 34.728 15.878 3.329 1.00 0.00 C ATOM 1354 C PRO A 90 35.922 14.935 3.426 1.00 0.00 C ATOM 1355 O PRO A 90 36.374 14.600 4.521 1.00 0.00 O ATOM 1356 CB PRO A 90 35.187 17.285 2.939 1.00 0.00 C ATOM 1357 CG PRO A 90 35.334 18.008 4.233 1.00 0.00 C ATOM 1358 CD PRO A 90 34.280 17.444 5.145 1.00 0.00 C ATOM 0 HA PRO A 90 34.060 15.416 2.602 1.00 0.00 H new ATOM 0 HB2 PRO A 90 36.129 17.257 2.392 1.00 0.00 H new ATOM 0 HB3 PRO A 90 34.458 17.774 2.293 1.00 0.00 H new ATOM 0 HG2 PRO A 90 36.330 17.862 4.651 1.00 0.00 H new ATOM 0 HG3 PRO A 90 35.199 19.081 4.098 1.00 0.00 H new ATOM 0 HD2 PRO A 90 34.612 17.432 6.183 1.00 0.00 H new ATOM 0 HD3 PRO A 90 33.362 18.031 5.110 1.00 0.00 H new ATOM 1366 N SER A 91 36.430 14.511 2.273 1.00 0.00 N ATOM 1367 CA SER A 91 37.571 13.604 2.228 1.00 0.00 C ATOM 1368 C SER A 91 37.387 12.451 3.210 1.00 0.00 C ATOM 1369 O SER A 91 38.253 12.187 4.044 1.00 0.00 O ATOM 1370 CB SER A 91 38.863 14.359 2.547 1.00 0.00 C ATOM 1371 OG SER A 91 39.458 14.872 1.368 1.00 0.00 O ATOM 0 H SER A 91 36.069 14.781 1.358 1.00 0.00 H new ATOM 0 HA SER A 91 37.638 13.194 1.220 1.00 0.00 H new ATOM 0 HB2 SER A 91 38.650 15.176 3.236 1.00 0.00 H new ATOM 0 HB3 SER A 91 39.563 13.692 3.051 1.00 0.00 H new ATOM 0 HG SER A 91 40.354 15.210 1.574 1.00 0.00 H new ATOM 1377 N SER A 92 36.252 11.767 3.104 1.00 0.00 N ATOM 1378 CA SER A 92 35.951 10.644 3.984 1.00 0.00 C ATOM 1379 C SER A 92 35.108 9.598 3.261 1.00 0.00 C ATOM 1380 O SER A 92 34.130 9.927 2.590 1.00 0.00 O ATOM 1381 CB SER A 92 35.216 11.132 5.234 1.00 0.00 C ATOM 1382 OG SER A 92 36.105 11.778 6.129 1.00 0.00 O ATOM 0 H SER A 92 35.526 11.971 2.417 1.00 0.00 H new ATOM 0 HA SER A 92 36.893 10.184 4.281 1.00 0.00 H new ATOM 0 HB2 SER A 92 34.421 11.820 4.947 1.00 0.00 H new ATOM 0 HB3 SER A 92 34.742 10.287 5.734 1.00 0.00 H new ATOM 0 HG SER A 92 36.978 11.892 5.698 1.00 0.00 H new ATOM 1388 N HIS A 93 35.496 8.334 3.403 1.00 0.00 N ATOM 1389 CA HIS A 93 34.777 7.238 2.764 1.00 0.00 C ATOM 1390 C HIS A 93 33.580 6.809 3.608 1.00 0.00 C ATOM 1391 O HIS A 93 33.707 6.576 4.810 1.00 0.00 O ATOM 1392 CB HIS A 93 35.711 6.048 2.542 1.00 0.00 C ATOM 1393 CG HIS A 93 35.018 4.835 2.001 1.00 0.00 C ATOM 1394 ND1 HIS A 93 35.478 3.552 2.207 1.00 0.00 N ATOM 1395 CD2 HIS A 93 33.892 4.715 1.260 1.00 0.00 C ATOM 1396 CE1 HIS A 93 34.666 2.695 1.615 1.00 0.00 C ATOM 1397 NE2 HIS A 93 33.694 3.376 1.033 1.00 0.00 N ATOM 0 H HIS A 93 36.304 8.044 3.954 1.00 0.00 H new ATOM 0 HA HIS A 93 34.412 7.589 1.799 1.00 0.00 H new ATOM 0 HB2 HIS A 93 36.503 6.342 1.853 1.00 0.00 H new ATOM 0 HB3 HIS A 93 36.190 5.791 3.487 1.00 0.00 H new ATOM 0 HD1 HIS A 93 36.315 3.303 2.734 1.00 0.00 H new ATOM 0 HD2 HIS A 93 33.266 5.523 0.912 1.00 0.00 H new ATOM 0 HE1 HIS A 93 34.777 1.621 1.608 1.00 0.00 H new ATOM 1406 N TYR A 94 32.419 6.707 2.970 1.00 0.00 N ATOM 1407 CA TYR A 94 31.199 6.309 3.662 1.00 0.00 C ATOM 1408 C TYR A 94 30.560 5.099 2.987 1.00 0.00 C ATOM 1409 O TYR A 94 30.565 4.982 1.762 1.00 0.00 O ATOM 1410 CB TYR A 94 30.205 7.472 3.697 1.00 0.00 C ATOM 1411 CG TYR A 94 30.507 8.493 4.770 1.00 0.00 C ATOM 1412 CD1 TYR A 94 31.590 9.355 4.652 1.00 0.00 C ATOM 1413 CD2 TYR A 94 29.707 8.597 5.902 1.00 0.00 C ATOM 1414 CE1 TYR A 94 31.869 10.290 5.631 1.00 0.00 C ATOM 1415 CE2 TYR A 94 29.978 9.530 6.885 1.00 0.00 C ATOM 1416 CZ TYR A 94 31.060 10.373 6.745 1.00 0.00 C ATOM 1417 OH TYR A 94 31.334 11.304 7.721 1.00 0.00 O ATOM 0 H TYR A 94 32.297 6.894 1.975 1.00 0.00 H new ATOM 0 HA TYR A 94 31.463 6.035 4.683 1.00 0.00 H new ATOM 0 HB2 TYR A 94 30.203 7.967 2.726 1.00 0.00 H new ATOM 0 HB3 TYR A 94 29.201 7.077 3.855 1.00 0.00 H new ATOM 0 HD1 TYR A 94 32.225 9.294 3.780 1.00 0.00 H new ATOM 0 HD2 TYR A 94 28.859 7.938 6.015 1.00 0.00 H new ATOM 0 HE1 TYR A 94 32.716 10.952 5.524 1.00 0.00 H new ATOM 0 HE2 TYR A 94 29.346 9.598 7.758 1.00 0.00 H new ATOM 0 HH TYR A 94 30.669 11.232 8.437 1.00 0.00 H new ATOM 1427 N VAL A 95 30.009 4.201 3.797 1.00 0.00 N ATOM 1428 CA VAL A 95 29.363 3.000 3.281 1.00 0.00 C ATOM 1429 C VAL A 95 27.845 3.143 3.294 1.00 0.00 C ATOM 1430 O VAL A 95 27.225 3.186 4.357 1.00 0.00 O ATOM 1431 CB VAL A 95 29.757 1.755 4.098 1.00 0.00 C ATOM 1432 CG1 VAL A 95 29.110 0.508 3.516 1.00 0.00 C ATOM 1433 CG2 VAL A 95 31.271 1.607 4.146 1.00 0.00 C ATOM 0 H VAL A 95 29.997 4.282 4.814 1.00 0.00 H new ATOM 0 HA VAL A 95 29.704 2.874 2.254 1.00 0.00 H new ATOM 0 HB VAL A 95 29.394 1.881 5.118 1.00 0.00 H new ATOM 0 HG11 VAL A 95 29.400 -0.361 4.106 1.00 0.00 H new ATOM 0 HG12 VAL A 95 28.026 0.617 3.538 1.00 0.00 H new ATOM 0 HG13 VAL A 95 29.440 0.374 2.486 1.00 0.00 H new ATOM 0 HG21 VAL A 95 31.532 0.722 4.727 1.00 0.00 H new ATOM 0 HG22 VAL A 95 31.659 1.503 3.133 1.00 0.00 H new ATOM 0 HG23 VAL A 95 31.708 2.490 4.613 1.00 0.00 H new ATOM 1443 N ILE A 96 27.253 3.216 2.106 1.00 0.00 N ATOM 1444 CA ILE A 96 25.808 3.353 1.981 1.00 0.00 C ATOM 1445 C ILE A 96 25.154 2.012 1.662 1.00 0.00 C ATOM 1446 O ILE A 96 25.591 1.294 0.763 1.00 0.00 O ATOM 1447 CB ILE A 96 25.431 4.368 0.886 1.00 0.00 C ATOM 1448 CG1 ILE A 96 25.812 5.785 1.321 1.00 0.00 C ATOM 1449 CG2 ILE A 96 23.944 4.285 0.576 1.00 0.00 C ATOM 1450 CD1 ILE A 96 27.267 6.120 1.081 1.00 0.00 C ATOM 0 H ILE A 96 27.752 3.182 1.217 1.00 0.00 H new ATOM 0 HA ILE A 96 25.441 3.714 2.942 1.00 0.00 H new ATOM 0 HB ILE A 96 25.985 4.125 -0.021 1.00 0.00 H new ATOM 0 HG12 ILE A 96 25.189 6.501 0.784 1.00 0.00 H new ATOM 0 HG13 ILE A 96 25.591 5.903 2.382 1.00 0.00 H new ATOM 0 HG21 ILE A 96 23.693 5.008 -0.200 1.00 0.00 H new ATOM 0 HG22 ILE A 96 23.700 3.281 0.228 1.00 0.00 H new ATOM 0 HG23 ILE A 96 23.372 4.506 1.477 1.00 0.00 H new ATOM 0 HD11 ILE A 96 27.465 7.139 1.413 1.00 0.00 H new ATOM 0 HD12 ILE A 96 27.897 5.428 1.640 1.00 0.00 H new ATOM 0 HD13 ILE A 96 27.489 6.035 0.017 1.00 0.00 H new ATOM 1462 N THR A 97 24.103 1.681 2.405 1.00 0.00 N ATOM 1463 CA THR A 97 23.388 0.428 2.202 1.00 0.00 C ATOM 1464 C THR A 97 21.883 0.659 2.128 1.00 0.00 C ATOM 1465 O THR A 97 21.275 1.166 3.072 1.00 0.00 O ATOM 1466 CB THR A 97 23.686 -0.579 3.330 1.00 0.00 C ATOM 1467 OG1 THR A 97 23.420 0.020 4.603 1.00 0.00 O ATOM 1468 CG2 THR A 97 25.134 -1.041 3.273 1.00 0.00 C ATOM 0 H THR A 97 23.728 2.264 3.153 1.00 0.00 H new ATOM 0 HA THR A 97 23.737 0.016 1.255 1.00 0.00 H new ATOM 0 HB THR A 97 23.039 -1.446 3.195 1.00 0.00 H new ATOM 0 HG1 THR A 97 22.661 0.635 4.523 1.00 0.00 H new ATOM 0 HG21 THR A 97 25.321 -1.751 4.078 1.00 0.00 H new ATOM 0 HG22 THR A 97 25.325 -1.522 2.314 1.00 0.00 H new ATOM 0 HG23 THR A 97 25.795 -0.182 3.386 1.00 0.00 H new ATOM 1476 N LEU A 98 21.286 0.283 1.002 1.00 0.00 N ATOM 1477 CA LEU A 98 19.850 0.449 0.805 1.00 0.00 C ATOM 1478 C LEU A 98 19.134 -0.897 0.858 1.00 0.00 C ATOM 1479 O LEU A 98 19.624 -1.895 0.329 1.00 0.00 O ATOM 1480 CB LEU A 98 19.575 1.133 -0.535 1.00 0.00 C ATOM 1481 CG LEU A 98 18.124 1.105 -1.017 1.00 0.00 C ATOM 1482 CD1 LEU A 98 17.317 2.205 -0.345 1.00 0.00 C ATOM 1483 CD2 LEU A 98 18.063 1.246 -2.531 1.00 0.00 C ATOM 0 H LEU A 98 21.774 -0.139 0.212 1.00 0.00 H new ATOM 0 HA LEU A 98 19.468 1.075 1.611 1.00 0.00 H new ATOM 0 HB2 LEU A 98 19.892 2.173 -0.461 1.00 0.00 H new ATOM 0 HB3 LEU A 98 20.199 0.663 -1.295 1.00 0.00 H new ATOM 0 HG LEU A 98 17.688 0.144 -0.743 1.00 0.00 H new ATOM 0 HD11 LEU A 98 16.287 2.170 -0.700 1.00 0.00 H new ATOM 0 HD12 LEU A 98 17.333 2.060 0.735 1.00 0.00 H new ATOM 0 HD13 LEU A 98 17.751 3.175 -0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 98 17.023 1.224 -2.857 1.00 0.00 H new ATOM 0 HD22 LEU A 98 18.516 2.192 -2.827 1.00 0.00 H new ATOM 0 HD23 LEU A 98 18.606 0.423 -2.995 1.00 0.00 H new ATOM 1495 N LYS A 99 17.971 -0.917 1.500 1.00 0.00 N ATOM 1496 CA LYS A 99 17.184 -2.139 1.620 1.00 0.00 C ATOM 1497 C LYS A 99 15.695 -1.845 1.466 1.00 0.00 C ATOM 1498 O LYS A 99 15.225 -0.769 1.833 1.00 0.00 O ATOM 1499 CB LYS A 99 17.446 -2.808 2.972 1.00 0.00 C ATOM 1500 CG LYS A 99 16.965 -1.990 4.158 1.00 0.00 C ATOM 1501 CD LYS A 99 16.862 -2.838 5.414 1.00 0.00 C ATOM 1502 CE LYS A 99 18.218 -3.015 6.080 1.00 0.00 C ATOM 1503 NZ LYS A 99 18.107 -3.730 7.382 1.00 0.00 N ATOM 0 H LYS A 99 17.552 -0.101 1.945 1.00 0.00 H new ATOM 0 HA LYS A 99 17.487 -2.816 0.821 1.00 0.00 H new ATOM 0 HB2 LYS A 99 16.954 -3.780 2.988 1.00 0.00 H new ATOM 0 HB3 LYS A 99 18.516 -2.990 3.077 1.00 0.00 H new ATOM 0 HG2 LYS A 99 17.652 -1.162 4.332 1.00 0.00 H new ATOM 0 HG3 LYS A 99 15.992 -1.555 3.931 1.00 0.00 H new ATOM 0 HD2 LYS A 99 16.170 -2.370 6.114 1.00 0.00 H new ATOM 0 HD3 LYS A 99 16.449 -3.815 5.162 1.00 0.00 H new ATOM 0 HE2 LYS A 99 18.879 -3.571 5.415 1.00 0.00 H new ATOM 0 HE3 LYS A 99 18.675 -2.038 6.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 18.646 -3.215 8.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 17.108 -3.783 7.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 18.490 -4.692 7.284 1.00 0.00 H new ATOM 1517 N ALA A 100 14.959 -2.809 0.923 1.00 0.00 N ATOM 1518 CA ALA A 100 13.524 -2.654 0.725 1.00 0.00 C ATOM 1519 C ALA A 100 12.739 -3.300 1.862 1.00 0.00 C ATOM 1520 O ALA A 100 12.967 -4.459 2.207 1.00 0.00 O ATOM 1521 CB ALA A 100 13.108 -3.252 -0.611 1.00 0.00 C ATOM 0 H ALA A 100 15.333 -3.706 0.612 1.00 0.00 H new ATOM 0 HA ALA A 100 13.297 -1.588 0.721 1.00 0.00 H new ATOM 0 HB1 ALA A 100 12.033 -3.129 -0.746 1.00 0.00 H new ATOM 0 HB2 ALA A 100 13.635 -2.743 -1.418 1.00 0.00 H new ATOM 0 HB3 ALA A 100 13.357 -4.313 -0.628 1.00 0.00 H new ATOM 1527 N PHE A 101 11.815 -2.541 2.442 1.00 0.00 N ATOM 1528 CA PHE A 101 10.998 -3.039 3.543 1.00 0.00 C ATOM 1529 C PHE A 101 9.541 -2.621 3.371 1.00 0.00 C ATOM 1530 O PHE A 101 9.249 -1.476 3.027 1.00 0.00 O ATOM 1531 CB PHE A 101 11.535 -2.521 4.879 1.00 0.00 C ATOM 1532 CG PHE A 101 11.245 -1.067 5.119 1.00 0.00 C ATOM 1533 CD1 PHE A 101 12.089 -0.088 4.622 1.00 0.00 C ATOM 1534 CD2 PHE A 101 10.127 -0.680 5.840 1.00 0.00 C ATOM 1535 CE1 PHE A 101 11.825 1.251 4.842 1.00 0.00 C ATOM 1536 CE2 PHE A 101 9.857 0.657 6.063 1.00 0.00 C ATOM 1537 CZ PHE A 101 10.707 1.624 5.562 1.00 0.00 C ATOM 0 H PHE A 101 11.613 -1.579 2.168 1.00 0.00 H new ATOM 0 HA PHE A 101 11.048 -4.128 3.537 1.00 0.00 H new ATOM 0 HB2 PHE A 101 11.101 -3.108 5.688 1.00 0.00 H new ATOM 0 HB3 PHE A 101 12.613 -2.679 4.914 1.00 0.00 H new ATOM 0 HD1 PHE A 101 12.963 -0.374 4.056 1.00 0.00 H new ATOM 0 HD2 PHE A 101 9.459 -1.432 6.232 1.00 0.00 H new ATOM 0 HE1 PHE A 101 12.492 2.005 4.451 1.00 0.00 H new ATOM 0 HE2 PHE A 101 8.983 0.945 6.628 1.00 0.00 H new ATOM 0 HZ PHE A 101 10.498 2.670 5.733 1.00 0.00 H new ATOM 1547 N ASN A 102 8.630 -3.558 3.612 1.00 0.00 N ATOM 1548 CA ASN A 102 7.203 -3.288 3.482 1.00 0.00 C ATOM 1549 C ASN A 102 6.464 -3.639 4.770 1.00 0.00 C ATOM 1550 O ASN A 102 7.080 -3.999 5.772 1.00 0.00 O ATOM 1551 CB ASN A 102 6.616 -4.081 2.312 1.00 0.00 C ATOM 1552 CG ASN A 102 6.716 -5.580 2.522 1.00 0.00 C ATOM 1553 OD1 ASN A 102 7.384 -6.046 3.445 1.00 0.00 O ATOM 1554 ND2 ASN A 102 6.050 -6.343 1.663 1.00 0.00 N ATOM 0 H ASN A 102 8.855 -4.511 3.898 1.00 0.00 H new ATOM 0 HA ASN A 102 7.077 -2.223 3.289 1.00 0.00 H new ATOM 0 HB2 ASN A 102 5.570 -3.805 2.178 1.00 0.00 H new ATOM 0 HB3 ASN A 102 7.138 -3.810 1.394 1.00 0.00 H new ATOM 0 HD21 ASN A 102 6.080 -7.359 1.754 1.00 0.00 H new ATOM 0 HD22 ASN A 102 5.509 -5.913 0.913 1.00 0.00 H new ATOM 1561 N ASN A 103 5.140 -3.533 4.734 1.00 0.00 N ATOM 1562 CA ASN A 103 4.316 -3.839 5.898 1.00 0.00 C ATOM 1563 C ASN A 103 4.595 -5.251 6.405 1.00 0.00 C ATOM 1564 O ASN A 103 4.365 -5.558 7.575 1.00 0.00 O ATOM 1565 CB ASN A 103 2.833 -3.693 5.552 1.00 0.00 C ATOM 1566 CG ASN A 103 2.493 -4.288 4.199 1.00 0.00 C ATOM 1567 OD1 ASN A 103 2.557 -5.503 4.009 1.00 0.00 O ATOM 1568 ND2 ASN A 103 2.130 -3.432 3.251 1.00 0.00 N ATOM 0 H ASN A 103 4.614 -3.237 3.911 1.00 0.00 H new ATOM 0 HA ASN A 103 4.569 -3.131 6.688 1.00 0.00 H new ATOM 0 HB2 ASN A 103 2.234 -4.180 6.321 1.00 0.00 H new ATOM 0 HB3 ASN A 103 2.563 -2.637 5.559 1.00 0.00 H new ATOM 0 HD21 ASN A 103 1.890 -3.773 2.320 1.00 0.00 H new ATOM 0 HD22 ASN A 103 2.091 -2.433 3.454 1.00 0.00 H new ATOM 1575 N VAL A 104 5.092 -6.106 5.517 1.00 0.00 N ATOM 1576 CA VAL A 104 5.404 -7.484 5.874 1.00 0.00 C ATOM 1577 C VAL A 104 6.710 -7.568 6.655 1.00 0.00 C ATOM 1578 O VAL A 104 6.817 -8.310 7.630 1.00 0.00 O ATOM 1579 CB VAL A 104 5.507 -8.378 4.624 1.00 0.00 C ATOM 1580 CG1 VAL A 104 5.795 -9.819 5.020 1.00 0.00 C ATOM 1581 CG2 VAL A 104 4.233 -8.288 3.798 1.00 0.00 C ATOM 0 H VAL A 104 5.287 -5.868 4.545 1.00 0.00 H new ATOM 0 HA VAL A 104 4.587 -7.841 6.501 1.00 0.00 H new ATOM 0 HB VAL A 104 6.335 -8.022 4.012 1.00 0.00 H new ATOM 0 HG11 VAL A 104 5.864 -10.436 4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.737 -9.865 5.566 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.990 -10.190 5.654 1.00 0.00 H new ATOM 0 HG21 VAL A 104 4.324 -8.926 2.919 1.00 0.00 H new ATOM 0 HG22 VAL A 104 3.385 -8.617 4.399 1.00 0.00 H new ATOM 0 HG23 VAL A 104 4.076 -7.256 3.483 1.00 0.00 H new ATOM 1591 N GLY A 105 7.704 -6.799 6.219 1.00 0.00 N ATOM 1592 CA GLY A 105 8.991 -6.800 6.889 1.00 0.00 C ATOM 1593 C GLY A 105 10.071 -6.118 6.071 1.00 0.00 C ATOM 1594 O GLY A 105 9.780 -5.247 5.252 1.00 0.00 O ATOM 0 H GLY A 105 7.640 -6.176 5.414 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.897 -6.297 7.852 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.290 -7.828 7.094 1.00 0.00 H new ATOM 1598 N GLU A 106 11.320 -6.513 6.296 1.00 0.00 N ATOM 1599 CA GLU A 106 12.446 -5.931 5.575 1.00 0.00 C ATOM 1600 C GLU A 106 13.013 -6.920 4.562 1.00 0.00 C ATOM 1601 O GLU A 106 12.526 -8.043 4.434 1.00 0.00 O ATOM 1602 CB GLU A 106 13.541 -5.503 6.555 1.00 0.00 C ATOM 1603 CG GLU A 106 13.006 -4.851 7.819 1.00 0.00 C ATOM 1604 CD GLU A 106 14.110 -4.413 8.761 1.00 0.00 C ATOM 1605 OE1 GLU A 106 15.155 -3.937 8.271 1.00 0.00 O ATOM 1606 OE2 GLU A 106 13.928 -4.545 9.990 1.00 0.00 O ATOM 0 H GLU A 106 11.578 -7.233 6.971 1.00 0.00 H new ATOM 0 HA GLU A 106 12.086 -5.054 5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 106 14.133 -6.376 6.829 1.00 0.00 H new ATOM 0 HB3 GLU A 106 14.213 -4.807 6.054 1.00 0.00 H new ATOM 0 HG2 GLU A 106 12.400 -3.986 7.549 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.350 -5.552 8.335 1.00 0.00 H new ATOM 1613 N GLY A 107 14.047 -6.495 3.842 1.00 0.00 N ATOM 1614 CA GLY A 107 14.664 -7.354 2.849 1.00 0.00 C ATOM 1615 C GLY A 107 16.169 -7.437 3.009 1.00 0.00 C ATOM 1616 O GLY A 107 16.683 -7.416 4.127 1.00 0.00 O ATOM 0 H GLY A 107 14.468 -5.570 3.929 1.00 0.00 H new ATOM 0 HA2 GLY A 107 14.238 -8.355 2.924 1.00 0.00 H new ATOM 0 HA3 GLY A 107 14.428 -6.980 1.853 1.00 0.00 H new ATOM 1620 N ILE A 108 16.877 -7.535 1.888 1.00 0.00 N ATOM 1621 CA ILE A 108 18.332 -7.623 1.910 1.00 0.00 C ATOM 1622 C ILE A 108 18.968 -6.317 1.446 1.00 0.00 C ATOM 1623 O ILE A 108 18.768 -5.866 0.318 1.00 0.00 O ATOM 1624 CB ILE A 108 18.839 -8.772 1.019 1.00 0.00 C ATOM 1625 CG1 ILE A 108 17.855 -9.035 -0.122 1.00 0.00 C ATOM 1626 CG2 ILE A 108 19.047 -10.032 1.847 1.00 0.00 C ATOM 1627 CD1 ILE A 108 16.700 -9.930 0.270 1.00 0.00 C ATOM 0 H ILE A 108 16.467 -7.555 0.954 1.00 0.00 H new ATOM 0 HA ILE A 108 18.621 -7.819 2.942 1.00 0.00 H new ATOM 0 HB ILE A 108 19.797 -8.481 0.587 1.00 0.00 H new ATOM 0 HG12 ILE A 108 17.462 -8.083 -0.478 1.00 0.00 H new ATOM 0 HG13 ILE A 108 18.390 -9.490 -0.955 1.00 0.00 H new ATOM 0 HG21 ILE A 108 19.405 -10.835 1.203 1.00 0.00 H new ATOM 0 HG22 ILE A 108 19.782 -9.837 2.628 1.00 0.00 H new ATOM 0 HG23 ILE A 108 18.102 -10.327 2.304 1.00 0.00 H new ATOM 0 HD11 ILE A 108 16.043 -10.073 -0.588 1.00 0.00 H new ATOM 0 HD12 ILE A 108 17.083 -10.896 0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 108 16.140 -9.467 1.082 1.00 0.00 H new ATOM 1639 N PRO A 109 19.755 -5.694 2.336 1.00 0.00 N ATOM 1640 CA PRO A 109 20.439 -4.432 2.040 1.00 0.00 C ATOM 1641 C PRO A 109 21.561 -4.605 1.022 1.00 0.00 C ATOM 1642 O PRO A 109 22.006 -5.723 0.758 1.00 0.00 O ATOM 1643 CB PRO A 109 21.009 -4.011 3.398 1.00 0.00 C ATOM 1644 CG PRO A 109 21.160 -5.284 4.156 1.00 0.00 C ATOM 1645 CD PRO A 109 20.038 -6.174 3.699 1.00 0.00 C ATOM 0 HA PRO A 109 19.766 -3.697 1.598 1.00 0.00 H new ATOM 0 HB2 PRO A 109 21.966 -3.502 3.285 1.00 0.00 H new ATOM 0 HB3 PRO A 109 20.339 -3.321 3.912 1.00 0.00 H new ATOM 0 HG2 PRO A 109 22.128 -5.744 3.958 1.00 0.00 H new ATOM 0 HG3 PRO A 109 21.105 -5.107 5.230 1.00 0.00 H new ATOM 0 HD2 PRO A 109 20.331 -7.224 3.702 1.00 0.00 H new ATOM 0 HD3 PRO A 109 19.165 -6.085 4.346 1.00 0.00 H new ATOM 1653 N LEU A 110 22.015 -3.493 0.454 1.00 0.00 N ATOM 1654 CA LEU A 110 23.087 -3.522 -0.535 1.00 0.00 C ATOM 1655 C LEU A 110 24.374 -2.939 0.039 1.00 0.00 C ATOM 1656 O LEU A 110 24.426 -2.554 1.207 1.00 0.00 O ATOM 1657 CB LEU A 110 22.674 -2.744 -1.786 1.00 0.00 C ATOM 1658 CG LEU A 110 21.537 -3.350 -2.609 1.00 0.00 C ATOM 1659 CD1 LEU A 110 20.746 -2.258 -3.312 1.00 0.00 C ATOM 1660 CD2 LEU A 110 22.083 -4.350 -3.618 1.00 0.00 C ATOM 0 H LEU A 110 21.658 -2.560 0.661 1.00 0.00 H new ATOM 0 HA LEU A 110 23.271 -4.562 -0.805 1.00 0.00 H new ATOM 0 HB2 LEU A 110 22.381 -1.739 -1.484 1.00 0.00 H new ATOM 0 HB3 LEU A 110 23.547 -2.641 -2.430 1.00 0.00 H new ATOM 0 HG LEU A 110 20.865 -3.878 -1.932 1.00 0.00 H new ATOM 0 HD11 LEU A 110 19.941 -2.708 -3.893 1.00 0.00 H new ATOM 0 HD12 LEU A 110 20.323 -1.580 -2.570 1.00 0.00 H new ATOM 0 HD13 LEU A 110 21.406 -1.702 -3.977 1.00 0.00 H new ATOM 0 HD21 LEU A 110 21.260 -4.771 -4.195 1.00 0.00 H new ATOM 0 HD22 LEU A 110 22.777 -3.846 -4.291 1.00 0.00 H new ATOM 0 HD23 LEU A 110 22.604 -5.150 -3.092 1.00 0.00 H new ATOM 1672 N TYR A 111 25.410 -2.876 -0.790 1.00 0.00 N ATOM 1673 CA TYR A 111 26.697 -2.340 -0.365 1.00 0.00 C ATOM 1674 C TYR A 111 27.286 -1.425 -1.435 1.00 0.00 C ATOM 1675 O TYR A 111 27.526 -1.849 -2.565 1.00 0.00 O ATOM 1676 CB TYR A 111 27.671 -3.478 -0.059 1.00 0.00 C ATOM 1677 CG TYR A 111 27.568 -3.999 1.357 1.00 0.00 C ATOM 1678 CD1 TYR A 111 26.398 -4.591 1.817 1.00 0.00 C ATOM 1679 CD2 TYR A 111 28.641 -3.900 2.234 1.00 0.00 C ATOM 1680 CE1 TYR A 111 26.300 -5.067 3.110 1.00 0.00 C ATOM 1681 CE2 TYR A 111 28.552 -4.375 3.529 1.00 0.00 C ATOM 1682 CZ TYR A 111 27.379 -4.957 3.962 1.00 0.00 C ATOM 1683 OH TYR A 111 27.285 -5.431 5.250 1.00 0.00 O ATOM 0 H TYR A 111 25.383 -3.190 -1.760 1.00 0.00 H new ATOM 0 HA TYR A 111 26.537 -1.754 0.540 1.00 0.00 H new ATOM 0 HB2 TYR A 111 27.488 -4.298 -0.753 1.00 0.00 H new ATOM 0 HB3 TYR A 111 28.689 -3.131 -0.237 1.00 0.00 H new ATOM 0 HD1 TYR A 111 25.551 -4.680 1.153 1.00 0.00 H new ATOM 0 HD2 TYR A 111 29.561 -3.444 1.898 1.00 0.00 H new ATOM 0 HE1 TYR A 111 25.383 -5.523 3.452 1.00 0.00 H new ATOM 0 HE2 TYR A 111 29.396 -4.291 4.198 1.00 0.00 H new ATOM 0 HH TYR A 111 28.132 -5.277 5.718 1.00 0.00 H new ATOM 1693 N GLU A 112 27.518 -0.169 -1.068 1.00 0.00 N ATOM 1694 CA GLU A 112 28.079 0.806 -1.996 1.00 0.00 C ATOM 1695 C GLU A 112 29.249 1.552 -1.360 1.00 0.00 C ATOM 1696 O GLU A 112 29.547 1.370 -0.179 1.00 0.00 O ATOM 1697 CB GLU A 112 27.004 1.802 -2.437 1.00 0.00 C ATOM 1698 CG GLU A 112 26.170 1.316 -3.610 1.00 0.00 C ATOM 1699 CD GLU A 112 27.015 0.728 -4.723 1.00 0.00 C ATOM 1700 OE1 GLU A 112 27.572 1.511 -5.521 1.00 0.00 O ATOM 1701 OE2 GLU A 112 27.119 -0.514 -4.797 1.00 0.00 O ATOM 0 H GLU A 112 27.326 0.197 -0.136 1.00 0.00 H new ATOM 0 HA GLU A 112 28.445 0.268 -2.870 1.00 0.00 H new ATOM 0 HB2 GLU A 112 26.345 2.009 -1.594 1.00 0.00 H new ATOM 0 HB3 GLU A 112 27.482 2.744 -2.707 1.00 0.00 H new ATOM 0 HG2 GLU A 112 25.462 0.564 -3.261 1.00 0.00 H new ATOM 0 HG3 GLU A 112 25.585 2.147 -4.004 1.00 0.00 H new ATOM 1708 N SER A 113 29.908 2.393 -2.151 1.00 0.00 N ATOM 1709 CA SER A 113 31.047 3.164 -1.668 1.00 0.00 C ATOM 1710 C SER A 113 31.005 4.590 -2.206 1.00 0.00 C ATOM 1711 O SER A 113 30.775 4.810 -3.395 1.00 0.00 O ATOM 1712 CB SER A 113 32.357 2.489 -2.079 1.00 0.00 C ATOM 1713 OG SER A 113 32.398 2.264 -3.477 1.00 0.00 O ATOM 0 H SER A 113 29.672 2.558 -3.130 1.00 0.00 H new ATOM 0 HA SER A 113 30.993 3.204 -0.580 1.00 0.00 H new ATOM 0 HB2 SER A 113 33.200 3.114 -1.783 1.00 0.00 H new ATOM 0 HB3 SER A 113 32.462 1.541 -1.552 1.00 0.00 H new ATOM 0 HG SER A 113 33.246 1.833 -3.714 1.00 0.00 H new ATOM 1719 N ALA A 114 31.230 5.557 -1.322 1.00 0.00 N ATOM 1720 CA ALA A 114 31.220 6.962 -1.707 1.00 0.00 C ATOM 1721 C ALA A 114 32.263 7.754 -0.924 1.00 0.00 C ATOM 1722 O ALA A 114 32.233 7.791 0.306 1.00 0.00 O ATOM 1723 CB ALA A 114 29.836 7.558 -1.497 1.00 0.00 C ATOM 0 H ALA A 114 31.421 5.392 -0.334 1.00 0.00 H new ATOM 0 HA ALA A 114 31.473 7.024 -2.765 1.00 0.00 H new ATOM 0 HB1 ALA A 114 29.844 8.608 -1.789 1.00 0.00 H new ATOM 0 HB2 ALA A 114 29.111 7.018 -2.106 1.00 0.00 H new ATOM 0 HB3 ALA A 114 29.560 7.476 -0.446 1.00 0.00 H new ATOM 1729 N VAL A 115 33.185 8.384 -1.645 1.00 0.00 N ATOM 1730 CA VAL A 115 34.237 9.175 -1.018 1.00 0.00 C ATOM 1731 C VAL A 115 34.023 10.665 -1.261 1.00 0.00 C ATOM 1732 O VAL A 115 34.218 11.159 -2.372 1.00 0.00 O ATOM 1733 CB VAL A 115 35.628 8.775 -1.542 1.00 0.00 C ATOM 1734 CG1 VAL A 115 36.709 9.627 -0.894 1.00 0.00 C ATOM 1735 CG2 VAL A 115 35.885 7.296 -1.296 1.00 0.00 C ATOM 0 H VAL A 115 33.225 8.362 -2.664 1.00 0.00 H new ATOM 0 HA VAL A 115 34.189 8.974 0.052 1.00 0.00 H new ATOM 0 HB VAL A 115 35.656 8.952 -2.617 1.00 0.00 H new ATOM 0 HG11 VAL A 115 37.685 9.329 -1.277 1.00 0.00 H new ATOM 0 HG12 VAL A 115 36.533 10.677 -1.127 1.00 0.00 H new ATOM 0 HG13 VAL A 115 36.685 9.486 0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 115 36.873 7.031 -1.673 1.00 0.00 H new ATOM 0 HG22 VAL A 115 35.838 7.091 -0.226 1.00 0.00 H new ATOM 0 HG23 VAL A 115 35.129 6.705 -1.812 1.00 0.00 H new ATOM 1745 N THR A 116 33.621 11.378 -0.213 1.00 0.00 N ATOM 1746 CA THR A 116 33.380 12.812 -0.312 1.00 0.00 C ATOM 1747 C THR A 116 34.628 13.548 -0.788 1.00 0.00 C ATOM 1748 O THR A 116 35.725 13.323 -0.278 1.00 0.00 O ATOM 1749 CB THR A 116 32.935 13.402 1.039 1.00 0.00 C ATOM 1750 OG1 THR A 116 33.863 13.031 2.065 1.00 0.00 O ATOM 1751 CG2 THR A 116 31.542 12.915 1.409 1.00 0.00 C ATOM 0 H THR A 116 33.456 10.985 0.714 1.00 0.00 H new ATOM 0 HA THR A 116 32.581 12.948 -1.040 1.00 0.00 H new ATOM 0 HB THR A 116 32.911 14.488 0.946 1.00 0.00 H new ATOM 0 HG1 THR A 116 33.376 12.647 2.824 1.00 0.00 H new ATOM 0 HG21 THR A 116 31.249 13.345 2.367 1.00 0.00 H new ATOM 0 HG22 THR A 116 30.833 13.223 0.641 1.00 0.00 H new ATOM 0 HG23 THR A 116 31.545 11.828 1.485 1.00 0.00 H new ATOM 1759 N ARG A 117 34.452 14.428 -1.769 1.00 0.00 N ATOM 1760 CA ARG A 117 35.565 15.196 -2.314 1.00 0.00 C ATOM 1761 C ARG A 117 36.188 16.086 -1.242 1.00 0.00 C ATOM 1762 O ARG A 117 35.527 16.516 -0.296 1.00 0.00 O ATOM 1763 CB ARG A 117 35.093 16.052 -3.491 1.00 0.00 C ATOM 1764 CG ARG A 117 34.808 15.251 -4.751 1.00 0.00 C ATOM 1765 CD ARG A 117 34.936 16.111 -5.998 1.00 0.00 C ATOM 1766 NE ARG A 117 36.328 16.422 -6.308 1.00 0.00 N ATOM 1767 CZ ARG A 117 36.698 17.409 -7.117 1.00 0.00 C ATOM 1768 NH1 ARG A 117 35.783 18.175 -7.695 1.00 0.00 N ATOM 1769 NH2 ARG A 117 37.986 17.631 -7.350 1.00 0.00 N ATOM 0 H ARG A 117 33.550 14.626 -2.202 1.00 0.00 H new ATOM 0 HA ARG A 117 36.322 14.494 -2.664 1.00 0.00 H new ATOM 0 HB2 ARG A 117 34.190 16.589 -3.200 1.00 0.00 H new ATOM 0 HB3 ARG A 117 35.853 16.802 -3.711 1.00 0.00 H new ATOM 0 HG2 ARG A 117 35.500 14.411 -4.814 1.00 0.00 H new ATOM 0 HG3 ARG A 117 33.803 14.832 -4.698 1.00 0.00 H new ATOM 0 HD2 ARG A 117 34.483 15.593 -6.844 1.00 0.00 H new ATOM 0 HD3 ARG A 117 34.380 17.038 -5.858 1.00 0.00 H new ATOM 0 HE ARG A 117 37.057 15.850 -5.880 1.00 0.00 H new ATOM 0 HH11 ARG A 117 34.792 18.007 -7.519 1.00 0.00 H new ATOM 0 HH12 ARG A 117 36.070 18.932 -8.316 1.00 0.00 H new ATOM 0 HH21 ARG A 117 38.693 17.044 -6.908 1.00 0.00 H new ATOM 0 HH22 ARG A 117 38.269 18.389 -7.971 1.00 0.00 H new ATOM 1783 N PRO A 118 37.490 16.369 -1.391 1.00 0.00 N ATOM 1784 CA PRO A 118 38.231 17.209 -0.446 1.00 0.00 C ATOM 1785 C PRO A 118 37.806 18.672 -0.513 1.00 0.00 C ATOM 1786 O PRO A 118 37.894 19.306 -1.565 1.00 0.00 O ATOM 1787 CB PRO A 118 39.686 17.054 -0.898 1.00 0.00 C ATOM 1788 CG PRO A 118 39.598 16.700 -2.342 1.00 0.00 C ATOM 1789 CD PRO A 118 38.340 15.890 -2.495 1.00 0.00 C ATOM 0 HA PRO A 118 38.057 16.910 0.588 1.00 0.00 H new ATOM 0 HB2 PRO A 118 40.247 17.977 -0.750 1.00 0.00 H new ATOM 0 HB3 PRO A 118 40.196 16.276 -0.330 1.00 0.00 H new ATOM 0 HG2 PRO A 118 39.563 17.596 -2.962 1.00 0.00 H new ATOM 0 HG3 PRO A 118 40.471 16.128 -2.657 1.00 0.00 H new ATOM 0 HD2 PRO A 118 37.871 16.056 -3.465 1.00 0.00 H new ATOM 0 HD3 PRO A 118 38.538 14.821 -2.415 1.00 0.00 H new ATOM 1797 N HIS A 119 37.344 19.202 0.615 1.00 0.00 N ATOM 1798 CA HIS A 119 36.905 20.591 0.683 1.00 0.00 C ATOM 1799 C HIS A 119 38.028 21.537 0.267 1.00 0.00 C ATOM 1800 O HIS A 119 39.195 21.314 0.594 1.00 0.00 O ATOM 1801 CB HIS A 119 36.435 20.930 2.098 1.00 0.00 C ATOM 1802 CG HIS A 119 35.382 21.995 2.140 1.00 0.00 C ATOM 1803 ND1 HIS A 119 35.638 23.318 1.846 1.00 0.00 N ATOM 1804 CD2 HIS A 119 34.065 21.926 2.442 1.00 0.00 C ATOM 1805 CE1 HIS A 119 34.524 24.017 1.967 1.00 0.00 C ATOM 1806 NE2 HIS A 119 33.554 23.196 2.328 1.00 0.00 N ATOM 0 H HIS A 119 37.264 18.691 1.494 1.00 0.00 H new ATOM 0 HA HIS A 119 36.072 20.718 -0.009 1.00 0.00 H new ATOM 0 HB2 HIS A 119 36.046 20.027 2.569 1.00 0.00 H new ATOM 0 HB3 HIS A 119 37.292 21.254 2.689 1.00 0.00 H new ATOM 0 HD2 HIS A 119 33.517 21.038 2.721 1.00 0.00 H new ATOM 0 HE1 HIS A 119 34.423 25.079 1.799 1.00 0.00 H new ATOM 0 HE2 HIS A 119 32.584 23.462 2.495 1.00 0.00 H new ATOM 1815 N THR A 120 37.669 22.592 -0.457 1.00 0.00 N ATOM 1816 CA THR A 120 38.646 23.570 -0.919 1.00 0.00 C ATOM 1817 C THR A 120 38.091 24.987 -0.827 1.00 0.00 C ATOM 1818 O THR A 120 37.086 25.313 -1.458 1.00 0.00 O ATOM 1819 CB THR A 120 39.074 23.292 -2.372 1.00 0.00 C ATOM 1820 OG1 THR A 120 37.922 23.240 -3.221 1.00 0.00 O ATOM 1821 CG2 THR A 120 39.842 21.983 -2.469 1.00 0.00 C ATOM 0 H THR A 120 36.708 22.791 -0.736 1.00 0.00 H new ATOM 0 HA THR A 120 39.516 23.480 -0.268 1.00 0.00 H new ATOM 0 HB THR A 120 39.727 24.102 -2.696 1.00 0.00 H new ATOM 0 HG1 THR A 120 37.265 23.903 -2.922 1.00 0.00 H new ATOM 0 HG21 THR A 120 40.134 21.808 -3.505 1.00 0.00 H new ATOM 0 HG22 THR A 120 40.734 22.037 -1.845 1.00 0.00 H new ATOM 0 HG23 THR A 120 39.209 21.164 -2.127 1.00 0.00 H new ATOM 1829 N SER A 121 38.753 25.826 -0.036 1.00 0.00 N ATOM 1830 CA SER A 121 38.324 27.209 0.141 1.00 0.00 C ATOM 1831 C SER A 121 39.181 28.155 -0.695 1.00 0.00 C ATOM 1832 O SER A 121 40.185 28.684 -0.219 1.00 0.00 O ATOM 1833 CB SER A 121 38.399 27.603 1.617 1.00 0.00 C ATOM 1834 OG SER A 121 38.037 28.961 1.801 1.00 0.00 O ATOM 0 H SER A 121 39.588 25.572 0.492 1.00 0.00 H new ATOM 0 HA SER A 121 37.291 27.289 -0.197 1.00 0.00 H new ATOM 0 HB2 SER A 121 37.737 26.964 2.201 1.00 0.00 H new ATOM 0 HB3 SER A 121 39.410 27.439 1.990 1.00 0.00 H new ATOM 0 HG SER A 121 38.091 29.188 2.753 1.00 0.00 H new ATOM 1840 N GLY A 122 38.776 28.363 -1.944 1.00 0.00 N ATOM 1841 CA GLY A 122 39.517 29.245 -2.826 1.00 0.00 C ATOM 1842 C GLY A 122 38.722 29.637 -4.056 1.00 0.00 C ATOM 1843 O GLY A 122 38.645 28.894 -5.035 1.00 0.00 O ATOM 0 H GLY A 122 37.948 27.937 -2.361 1.00 0.00 H new ATOM 0 HA2 GLY A 122 39.802 30.144 -2.280 1.00 0.00 H new ATOM 0 HA3 GLY A 122 40.440 28.754 -3.135 1.00 0.00 H new ATOM 1847 N PRO A 123 38.111 30.831 -4.014 1.00 0.00 N ATOM 1848 CA PRO A 123 37.306 31.347 -5.125 1.00 0.00 C ATOM 1849 C PRO A 123 38.156 31.715 -6.336 1.00 0.00 C ATOM 1850 O PRO A 123 37.690 31.659 -7.474 1.00 0.00 O ATOM 1851 CB PRO A 123 36.647 32.596 -4.535 1.00 0.00 C ATOM 1852 CG PRO A 123 37.564 33.029 -3.444 1.00 0.00 C ATOM 1853 CD PRO A 123 38.160 31.769 -2.880 1.00 0.00 C ATOM 0 HA PRO A 123 36.596 30.606 -5.492 1.00 0.00 H new ATOM 0 HB2 PRO A 123 36.532 33.376 -5.288 1.00 0.00 H new ATOM 0 HB3 PRO A 123 35.651 32.374 -4.151 1.00 0.00 H new ATOM 0 HG2 PRO A 123 38.341 33.691 -3.827 1.00 0.00 H new ATOM 0 HG3 PRO A 123 37.023 33.583 -2.676 1.00 0.00 H new ATOM 0 HD2 PRO A 123 39.181 31.928 -2.534 1.00 0.00 H new ATOM 0 HD3 PRO A 123 37.588 31.400 -2.028 1.00 0.00 H new ATOM 1861 N SER A 124 39.406 32.090 -6.084 1.00 0.00 N ATOM 1862 CA SER A 124 40.321 32.470 -7.154 1.00 0.00 C ATOM 1863 C SER A 124 40.301 31.439 -8.278 1.00 0.00 C ATOM 1864 O SER A 124 40.047 31.771 -9.435 1.00 0.00 O ATOM 1865 CB SER A 124 41.743 32.619 -6.609 1.00 0.00 C ATOM 1866 OG SER A 124 42.499 33.522 -7.397 1.00 0.00 O ATOM 0 H SER A 124 39.808 32.139 -5.148 1.00 0.00 H new ATOM 0 HA SER A 124 39.991 33.428 -7.557 1.00 0.00 H new ATOM 0 HB2 SER A 124 41.706 32.973 -5.579 1.00 0.00 H new ATOM 0 HB3 SER A 124 42.234 31.646 -6.594 1.00 0.00 H new ATOM 0 HG SER A 124 43.403 33.601 -7.027 1.00 0.00 H new ATOM 1872 N SER A 125 40.570 30.185 -7.927 1.00 0.00 N ATOM 1873 CA SER A 125 40.587 29.105 -8.907 1.00 0.00 C ATOM 1874 C SER A 125 39.240 28.391 -8.951 1.00 0.00 C ATOM 1875 O SER A 125 38.528 28.322 -7.950 1.00 0.00 O ATOM 1876 CB SER A 125 41.696 28.105 -8.575 1.00 0.00 C ATOM 1877 OG SER A 125 42.975 28.653 -8.843 1.00 0.00 O ATOM 0 H SER A 125 40.779 29.892 -6.972 1.00 0.00 H new ATOM 0 HA SER A 125 40.781 29.540 -9.888 1.00 0.00 H new ATOM 0 HB2 SER A 125 41.631 27.821 -7.525 1.00 0.00 H new ATOM 0 HB3 SER A 125 41.557 27.196 -9.160 1.00 0.00 H new ATOM 0 HG SER A 125 43.666 27.995 -8.621 1.00 0.00 H new ATOM 1883 N GLY A 126 38.896 27.861 -10.121 1.00 0.00 N ATOM 1884 CA GLY A 126 37.635 27.159 -10.276 1.00 0.00 C ATOM 1885 C GLY A 126 36.514 28.074 -10.728 1.00 0.00 C ATOM 1886 O GLY A 126 36.426 29.221 -10.291 1.00 0.00 O ATOM 0 H GLY A 126 39.468 27.905 -10.964 1.00 0.00 H new ATOM 0 HA2 GLY A 126 37.757 26.354 -11.001 1.00 0.00 H new ATOM 0 HA3 GLY A 126 37.362 26.696 -9.328 1.00 0.00 H new TER 1890 GLY A 126