USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 878 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 79 THR OG1 : rot -79:sc= 0.458 USER MOD Set 1.2: A 82 GLN :FLIP amide:sc= -2.47 F(o=-2.9,f=-2) USER MOD Set 2.1: A 32 ASN : amide:sc= -0.26 K(o=0.1,f=-5.3) USER MOD Set 2.2: A 46 SER OG : rot -163:sc= 0.36 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 25:sc= 0.241 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 23:sc= 0.464 USER MOD Single : A 8 ASN : amide:sc= -0.0114 X(o=-0.011,f=-0.19) USER MOD Single : A 13 HIS : no HD1:sc= -0.171 K(o=-0.17,f=-0.82) USER MOD Single : A 15 ASN : amide:sc= -0.438 K(o=-0.44,f=-5.6!) USER MOD Single : A 21 MET CE :methyl 166:sc= -0.948 (180deg=-1.4) USER MOD Single : A 22 LYS NZ :NH3+ -159:sc= -0.0636 (180deg=-0.34) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 34 LYS NZ :NH3+ 158:sc= -1.73! (180deg=-2.21!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot -130:sc= 1.09 USER MOD Single : A 57 CYS SG : rot 59:sc= -0.506 USER MOD Single : A 62 ASN : amide:sc= -3.7! C(o=-3.7!,f=-4.3!) USER MOD Single : A 66 GLN : amide:sc= -3.48 K(o=-3.5,f=-7.5!) USER MOD Single : A 71 ASN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 78 HIS : no HD1:sc= -0.476 X(o=-0.48,f=-0.034) USER MOD Single : A 80 HIS : no HD1:sc= -0.239 X(o=-0.24,f=-0.1) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot -160:sc= 0 USER MOD Single : A 91 CYS SG : rot -160:sc= -0.0941 USER MOD Single : A 94 HIS : no HD1:sc= -0.519 X(o=-0.52,f=-0.4) USER MOD Single : A 95 SER OG : rot 38:sc= 0.357 USER MOD Single : A 99 MET CE :methyl -164:sc= -1.47 (180deg=-2.72) USER MOD Single : A 105 ASN : amide:sc= -0.285 K(o=-0.28,f=-1.9) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 44:sc= 0.471 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.372 17.329 -42.050 1.00 0.00 N ATOM 2 CA GLY A 1 -8.502 16.518 -41.635 1.00 0.00 C ATOM 3 C GLY A 1 -8.334 15.965 -40.233 1.00 0.00 C ATOM 4 O GLY A 1 -8.462 16.695 -39.251 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.535 17.683 -43.014 1.00 0.00 H new ATOM 0 H2 GLY A 1 -7.264 18.133 -41.399 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.507 16.752 -42.035 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.411 17.117 -41.680 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.630 15.692 -42.335 1.00 0.00 H new ATOM 8 N SER A 2 -8.049 14.670 -40.140 1.00 0.00 N ATOM 9 CA SER A 2 -7.869 14.018 -38.848 1.00 0.00 C ATOM 10 C SER A 2 -6.898 12.846 -38.961 1.00 0.00 C ATOM 11 O SER A 2 -6.802 12.204 -40.007 1.00 0.00 O ATOM 12 CB SER A 2 -9.215 13.529 -38.308 1.00 0.00 C ATOM 13 OG SER A 2 -9.901 14.568 -37.633 1.00 0.00 O ATOM 0 H SER A 2 -7.938 14.052 -40.944 1.00 0.00 H new ATOM 0 HA SER A 2 -7.451 14.748 -38.155 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.827 13.159 -39.130 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.055 12.692 -37.628 1.00 0.00 H new ATOM 0 HG SER A 2 -9.595 15.435 -37.971 1.00 0.00 H new ATOM 19 N SER A 3 -6.179 12.575 -37.876 1.00 0.00 N ATOM 20 CA SER A 3 -5.212 11.484 -37.854 1.00 0.00 C ATOM 21 C SER A 3 -5.914 10.133 -37.946 1.00 0.00 C ATOM 22 O SER A 3 -7.019 9.959 -37.435 1.00 0.00 O ATOM 23 CB SER A 3 -4.370 11.548 -36.578 1.00 0.00 C ATOM 24 OG SER A 3 -3.247 10.688 -36.664 1.00 0.00 O ATOM 0 H SER A 3 -6.248 13.096 -37.002 1.00 0.00 H new ATOM 0 HA SER A 3 -4.558 11.593 -38.719 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.036 12.572 -36.410 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.982 11.268 -35.720 1.00 0.00 H new ATOM 0 HG SER A 3 -2.724 10.749 -35.837 1.00 0.00 H new ATOM 30 N GLY A 4 -5.263 9.179 -38.604 1.00 0.00 N ATOM 31 CA GLY A 4 -5.840 7.855 -38.753 1.00 0.00 C ATOM 32 C GLY A 4 -4.962 6.929 -39.571 1.00 0.00 C ATOM 33 O GLY A 4 -5.187 6.744 -40.767 1.00 0.00 O ATOM 0 H GLY A 4 -4.347 9.299 -39.036 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.002 7.420 -37.767 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.817 7.939 -39.229 1.00 0.00 H new ATOM 37 N SER A 5 -3.956 6.346 -38.926 1.00 0.00 N ATOM 38 CA SER A 5 -3.037 5.439 -39.603 1.00 0.00 C ATOM 39 C SER A 5 -2.646 4.281 -38.689 1.00 0.00 C ATOM 40 O SER A 5 -2.450 4.463 -37.488 1.00 0.00 O ATOM 41 CB SER A 5 -1.785 6.191 -40.056 1.00 0.00 C ATOM 42 OG SER A 5 -2.127 7.358 -40.784 1.00 0.00 O ATOM 0 H SER A 5 -3.757 6.486 -37.935 1.00 0.00 H new ATOM 0 HA SER A 5 -3.544 5.034 -40.478 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.186 6.463 -39.187 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.170 5.539 -40.676 1.00 0.00 H new ATOM 0 HG SER A 5 -1.309 7.822 -41.061 1.00 0.00 H new ATOM 48 N SER A 6 -2.534 3.090 -39.269 1.00 0.00 N ATOM 49 CA SER A 6 -2.170 1.901 -38.507 1.00 0.00 C ATOM 50 C SER A 6 -0.730 1.489 -38.798 1.00 0.00 C ATOM 51 O SER A 6 -0.380 1.173 -39.934 1.00 0.00 O ATOM 52 CB SER A 6 -3.119 0.747 -38.838 1.00 0.00 C ATOM 53 OG SER A 6 -3.024 0.385 -40.205 1.00 0.00 O ATOM 0 H SER A 6 -2.690 2.923 -40.263 1.00 0.00 H new ATOM 0 HA SER A 6 -2.254 2.139 -37.447 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.882 -0.114 -38.213 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.144 1.037 -38.606 1.00 0.00 H new ATOM 0 HG SER A 6 -2.158 0.674 -40.561 1.00 0.00 H new ATOM 59 N GLY A 7 0.102 1.497 -37.761 1.00 0.00 N ATOM 60 CA GLY A 7 1.495 1.123 -37.924 1.00 0.00 C ATOM 61 C GLY A 7 2.149 0.738 -36.613 1.00 0.00 C ATOM 62 O GLY A 7 2.935 1.503 -36.056 1.00 0.00 O ATOM 0 H GLY A 7 -0.164 1.756 -36.811 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.564 0.287 -38.620 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.042 1.955 -38.369 1.00 0.00 H new ATOM 66 N ASN A 8 1.824 -0.452 -36.118 1.00 0.00 N ATOM 67 CA ASN A 8 2.384 -0.936 -34.861 1.00 0.00 C ATOM 68 C ASN A 8 2.710 -2.424 -34.949 1.00 0.00 C ATOM 69 O ASN A 8 1.920 -3.214 -35.465 1.00 0.00 O ATOM 70 CB ASN A 8 1.407 -0.683 -33.712 1.00 0.00 C ATOM 71 CG ASN A 8 2.115 -0.465 -32.388 1.00 0.00 C ATOM 72 OD1 ASN A 8 3.008 0.376 -32.281 1.00 0.00 O ATOM 73 ND2 ASN A 8 1.720 -1.225 -31.374 1.00 0.00 N ATOM 0 H ASN A 8 1.176 -1.099 -36.568 1.00 0.00 H new ATOM 0 HA ASN A 8 3.308 -0.390 -34.669 1.00 0.00 H new ATOM 0 HB2 ASN A 8 0.797 0.190 -33.943 1.00 0.00 H new ATOM 0 HB3 ASN A 8 0.728 -1.531 -33.623 1.00 0.00 H new ATOM 0 HD21 ASN A 8 2.161 -1.125 -30.460 1.00 0.00 H new ATOM 0 HD22 ASN A 8 0.976 -1.909 -31.509 1.00 0.00 H new ATOM 80 N GLY A 9 3.880 -2.800 -34.440 1.00 0.00 N ATOM 81 CA GLY A 9 4.289 -4.192 -34.470 1.00 0.00 C ATOM 82 C GLY A 9 5.007 -4.612 -33.203 1.00 0.00 C ATOM 83 O GLY A 9 6.189 -4.323 -33.026 1.00 0.00 O ATOM 0 H GLY A 9 4.551 -2.165 -34.008 1.00 0.00 H new ATOM 0 HA2 GLY A 9 3.411 -4.822 -34.613 1.00 0.00 H new ATOM 0 HA3 GLY A 9 4.943 -4.357 -35.326 1.00 0.00 H new ATOM 87 N GLY A 10 4.289 -5.297 -32.318 1.00 0.00 N ATOM 88 CA GLY A 10 4.881 -5.745 -31.071 1.00 0.00 C ATOM 89 C GLY A 10 3.934 -5.604 -29.896 1.00 0.00 C ATOM 90 O GLY A 10 3.289 -4.568 -29.731 1.00 0.00 O ATOM 0 H GLY A 10 3.309 -5.549 -32.442 1.00 0.00 H new ATOM 0 HA2 GLY A 10 5.181 -6.788 -31.169 1.00 0.00 H new ATOM 0 HA3 GLY A 10 5.786 -5.170 -30.875 1.00 0.00 H new ATOM 94 N ILE A 11 3.849 -6.647 -29.078 1.00 0.00 N ATOM 95 CA ILE A 11 2.973 -6.634 -27.912 1.00 0.00 C ATOM 96 C ILE A 11 3.767 -6.834 -26.626 1.00 0.00 C ATOM 97 O ILE A 11 4.630 -7.706 -26.529 1.00 0.00 O ATOM 98 CB ILE A 11 1.891 -7.726 -28.009 1.00 0.00 C ATOM 99 CG1 ILE A 11 1.231 -7.699 -29.390 1.00 0.00 C ATOM 100 CG2 ILE A 11 0.850 -7.538 -26.915 1.00 0.00 C ATOM 101 CD1 ILE A 11 0.130 -6.670 -29.513 1.00 0.00 C ATOM 0 H ILE A 11 4.376 -7.512 -29.200 1.00 0.00 H new ATOM 0 HA ILE A 11 2.491 -5.657 -27.890 1.00 0.00 H new ATOM 0 HB ILE A 11 2.363 -8.699 -27.871 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.992 -7.497 -30.144 1.00 0.00 H new ATOM 0 HG13 ILE A 11 0.821 -8.685 -29.607 1.00 0.00 H new ATOM 0 HG21 ILE A 11 0.092 -8.317 -26.996 1.00 0.00 H new ATOM 0 HG22 ILE A 11 1.332 -7.601 -25.939 1.00 0.00 H new ATOM 0 HG23 ILE A 11 0.379 -6.561 -27.025 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.292 -6.707 -30.517 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -0.651 -6.883 -28.783 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.538 -5.676 -29.328 1.00 0.00 H new ATOM 113 N PRO A 12 3.468 -6.009 -25.612 1.00 0.00 N ATOM 114 CA PRO A 12 4.141 -6.077 -24.311 1.00 0.00 C ATOM 115 C PRO A 12 3.766 -7.331 -23.530 1.00 0.00 C ATOM 116 O PRO A 12 2.593 -7.698 -23.449 1.00 0.00 O ATOM 117 CB PRO A 12 3.639 -4.826 -23.586 1.00 0.00 C ATOM 118 CG PRO A 12 2.324 -4.523 -24.219 1.00 0.00 C ATOM 119 CD PRO A 12 2.450 -4.946 -25.657 1.00 0.00 C ATOM 0 HA PRO A 12 5.225 -6.120 -24.415 1.00 0.00 H new ATOM 0 HB2 PRO A 12 3.531 -5.005 -22.516 1.00 0.00 H new ATOM 0 HB3 PRO A 12 4.335 -3.995 -23.702 1.00 0.00 H new ATOM 0 HG2 PRO A 12 1.518 -5.063 -23.722 1.00 0.00 H new ATOM 0 HG3 PRO A 12 2.090 -3.461 -24.144 1.00 0.00 H new ATOM 0 HD2 PRO A 12 1.503 -5.313 -26.052 1.00 0.00 H new ATOM 0 HD3 PRO A 12 2.762 -4.118 -26.294 1.00 0.00 H new ATOM 127 N HIS A 13 4.769 -7.986 -22.954 1.00 0.00 N ATOM 128 CA HIS A 13 4.544 -9.200 -22.177 1.00 0.00 C ATOM 129 C HIS A 13 3.819 -8.884 -20.873 1.00 0.00 C ATOM 130 O HIS A 13 4.413 -8.358 -19.932 1.00 0.00 O ATOM 131 CB HIS A 13 5.874 -9.894 -21.879 1.00 0.00 C ATOM 132 CG HIS A 13 6.515 -10.503 -23.088 1.00 0.00 C ATOM 133 ND1 HIS A 13 6.680 -9.823 -24.276 1.00 0.00 N ATOM 134 CD2 HIS A 13 7.036 -11.737 -23.287 1.00 0.00 C ATOM 135 CE1 HIS A 13 7.273 -10.613 -25.154 1.00 0.00 C ATOM 136 NE2 HIS A 13 7.500 -11.780 -24.579 1.00 0.00 N ATOM 0 H HIS A 13 5.745 -7.697 -23.011 1.00 0.00 H new ATOM 0 HA HIS A 13 3.918 -9.869 -22.768 1.00 0.00 H new ATOM 0 HB2 HIS A 13 6.561 -9.171 -21.439 1.00 0.00 H new ATOM 0 HB3 HIS A 13 5.709 -10.672 -21.134 1.00 0.00 H new ATOM 0 HD2 HIS A 13 7.079 -12.538 -22.564 1.00 0.00 H new ATOM 0 HE1 HIS A 13 7.529 -10.349 -26.170 1.00 0.00 H new ATOM 0 HE2 HIS A 13 7.947 -12.583 -25.022 1.00 0.00 H new ATOM 145 N ASP A 14 2.531 -9.208 -20.824 1.00 0.00 N ATOM 146 CA ASP A 14 1.724 -8.958 -19.636 1.00 0.00 C ATOM 147 C ASP A 14 1.945 -10.048 -18.591 1.00 0.00 C ATOM 148 O ASP A 14 0.992 -10.568 -18.012 1.00 0.00 O ATOM 149 CB ASP A 14 0.242 -8.881 -20.006 1.00 0.00 C ATOM 150 CG ASP A 14 -0.026 -7.882 -21.114 1.00 0.00 C ATOM 151 OD1 ASP A 14 0.155 -8.243 -22.295 1.00 0.00 O ATOM 152 OD2 ASP A 14 -0.417 -6.738 -20.799 1.00 0.00 O ATOM 0 H ASP A 14 2.024 -9.644 -21.594 1.00 0.00 H new ATOM 0 HA ASP A 14 2.033 -8.003 -19.211 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -0.103 -9.867 -20.318 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -0.336 -8.605 -19.124 1.00 0.00 H new ATOM 157 N ASN A 15 3.208 -10.389 -18.356 1.00 0.00 N ATOM 158 CA ASN A 15 3.553 -11.419 -17.383 1.00 0.00 C ATOM 159 C ASN A 15 3.221 -10.961 -15.966 1.00 0.00 C ATOM 160 O ASN A 15 2.669 -11.721 -15.169 1.00 0.00 O ATOM 161 CB ASN A 15 5.039 -11.767 -17.483 1.00 0.00 C ATOM 162 CG ASN A 15 5.929 -10.665 -16.942 1.00 0.00 C ATOM 163 OD1 ASN A 15 5.694 -9.483 -17.193 1.00 0.00 O ATOM 164 ND2 ASN A 15 6.959 -11.048 -16.196 1.00 0.00 N ATOM 0 H ASN A 15 4.009 -9.967 -18.826 1.00 0.00 H new ATOM 0 HA ASN A 15 2.963 -12.308 -17.607 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.231 -12.688 -16.933 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.295 -11.958 -18.525 1.00 0.00 H new ATOM 0 HD21 ASN A 15 7.593 -10.351 -15.806 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.116 -12.039 -16.013 1.00 0.00 H new ATOM 171 N LEU A 16 3.560 -9.714 -15.659 1.00 0.00 N ATOM 172 CA LEU A 16 3.298 -9.152 -14.338 1.00 0.00 C ATOM 173 C LEU A 16 1.803 -8.936 -14.125 1.00 0.00 C ATOM 174 O LEU A 16 1.056 -8.711 -15.077 1.00 0.00 O ATOM 175 CB LEU A 16 4.046 -7.829 -14.166 1.00 0.00 C ATOM 176 CG LEU A 16 5.525 -7.938 -13.795 1.00 0.00 C ATOM 177 CD1 LEU A 16 6.290 -6.719 -14.287 1.00 0.00 C ATOM 178 CD2 LEU A 16 5.687 -8.099 -12.290 1.00 0.00 C ATOM 0 H LEU A 16 4.017 -9.072 -16.307 1.00 0.00 H new ATOM 0 HA LEU A 16 3.654 -9.862 -13.592 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.966 -7.266 -15.096 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.541 -7.246 -13.396 1.00 0.00 H new ATOM 0 HG LEU A 16 5.938 -8.822 -14.282 1.00 0.00 H new ATOM 0 HD11 LEU A 16 7.341 -6.814 -14.014 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.202 -6.647 -15.371 1.00 0.00 H new ATOM 0 HD13 LEU A 16 5.876 -5.821 -13.829 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.746 -8.175 -12.044 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.258 -7.234 -11.783 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.173 -9.003 -11.963 1.00 0.00 H new ATOM 190 N VAL A 17 1.374 -9.004 -12.869 1.00 0.00 N ATOM 191 CA VAL A 17 -0.032 -8.812 -12.530 1.00 0.00 C ATOM 192 C VAL A 17 -0.303 -7.372 -12.107 1.00 0.00 C ATOM 193 O VAL A 17 0.386 -6.826 -11.245 1.00 0.00 O ATOM 194 CB VAL A 17 -0.470 -9.759 -11.398 1.00 0.00 C ATOM 195 CG1 VAL A 17 -1.931 -9.528 -11.044 1.00 0.00 C ATOM 196 CG2 VAL A 17 -0.233 -11.209 -11.795 1.00 0.00 C ATOM 0 H VAL A 17 1.979 -9.190 -12.069 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.608 -9.039 -13.427 1.00 0.00 H new ATOM 0 HB VAL A 17 0.132 -9.544 -10.515 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.223 -10.206 -10.242 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.067 -8.498 -10.715 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.552 -9.714 -11.920 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.548 -11.865 -10.983 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.808 -11.439 -12.692 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.827 -11.363 -11.995 1.00 0.00 H new ATOM 206 N LEU A 18 -1.312 -6.763 -12.719 1.00 0.00 N ATOM 207 CA LEU A 18 -1.677 -5.385 -12.406 1.00 0.00 C ATOM 208 C LEU A 18 -2.976 -5.334 -11.608 1.00 0.00 C ATOM 209 O LEU A 18 -3.923 -6.065 -11.898 1.00 0.00 O ATOM 210 CB LEU A 18 -1.823 -4.570 -13.692 1.00 0.00 C ATOM 211 CG LEU A 18 -2.497 -3.206 -13.549 1.00 0.00 C ATOM 212 CD1 LEU A 18 -1.556 -2.211 -12.888 1.00 0.00 C ATOM 213 CD2 LEU A 18 -2.953 -2.691 -14.907 1.00 0.00 C ATOM 0 H LEU A 18 -1.892 -7.201 -13.435 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.881 -4.954 -11.799 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.831 -4.420 -14.118 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.392 -5.161 -14.410 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.375 -3.321 -12.913 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.054 -1.246 -12.795 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -1.280 -2.574 -11.898 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.659 -2.099 -13.497 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.431 -1.719 -14.786 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -2.091 -2.592 -15.567 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.664 -3.393 -15.342 1.00 0.00 H new ATOM 225 N ILE A 19 -3.013 -4.464 -10.604 1.00 0.00 N ATOM 226 CA ILE A 19 -4.197 -4.315 -9.766 1.00 0.00 C ATOM 227 C ILE A 19 -4.892 -2.984 -10.029 1.00 0.00 C ATOM 228 O ILE A 19 -4.327 -1.918 -9.783 1.00 0.00 O ATOM 229 CB ILE A 19 -3.844 -4.411 -8.270 1.00 0.00 C ATOM 230 CG1 ILE A 19 -3.067 -5.698 -7.989 1.00 0.00 C ATOM 231 CG2 ILE A 19 -5.107 -4.353 -7.424 1.00 0.00 C ATOM 232 CD1 ILE A 19 -3.919 -6.946 -8.054 1.00 0.00 C ATOM 0 H ILE A 19 -2.237 -3.852 -10.351 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.871 -5.131 -10.024 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.213 -3.563 -8.005 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.253 -5.786 -8.709 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.612 -5.630 -7.001 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.842 -4.422 -6.369 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.625 -3.411 -7.607 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.761 -5.184 -7.689 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.302 -7.819 -7.844 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -4.718 -6.880 -7.315 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.353 -7.039 -9.050 1.00 0.00 H new ATOM 244 N ARG A 20 -6.122 -3.053 -10.529 1.00 0.00 N ATOM 245 CA ARG A 20 -6.895 -1.853 -10.824 1.00 0.00 C ATOM 246 C ARG A 20 -8.192 -1.830 -10.021 1.00 0.00 C ATOM 247 O ARG A 20 -9.062 -2.682 -10.205 1.00 0.00 O ATOM 248 CB ARG A 20 -7.207 -1.777 -12.320 1.00 0.00 C ATOM 249 CG ARG A 20 -5.976 -1.583 -13.190 1.00 0.00 C ATOM 250 CD ARG A 20 -6.309 -0.825 -14.466 1.00 0.00 C ATOM 251 NE ARG A 20 -5.147 -0.688 -15.340 1.00 0.00 N ATOM 252 CZ ARG A 20 -5.232 -0.503 -16.652 1.00 0.00 C ATOM 253 NH1 ARG A 20 -6.419 -0.434 -17.239 1.00 0.00 N ATOM 254 NH2 ARG A 20 -4.129 -0.387 -17.381 1.00 0.00 N ATOM 0 H ARG A 20 -6.604 -3.927 -10.738 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.297 -0.987 -10.540 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.715 -2.692 -12.623 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -7.900 -0.954 -12.497 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -5.216 -1.039 -12.630 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.551 -2.554 -13.443 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -7.105 -1.345 -14.999 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -6.690 0.164 -14.211 1.00 0.00 H new ATOM 0 HE ARG A 20 -4.219 -0.737 -14.919 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -7.269 -0.523 -16.682 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -6.482 -0.292 -18.247 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -3.214 -0.440 -16.933 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -4.196 -0.245 -18.389 1.00 0.00 H new ATOM 268 N MET A 21 -8.314 -0.851 -9.131 1.00 0.00 N ATOM 269 CA MET A 21 -9.506 -0.718 -8.301 1.00 0.00 C ATOM 270 C MET A 21 -9.835 0.751 -8.054 1.00 0.00 C ATOM 271 O MET A 21 -9.053 1.639 -8.395 1.00 0.00 O ATOM 272 CB MET A 21 -9.307 -1.439 -6.966 1.00 0.00 C ATOM 273 CG MET A 21 -8.364 -0.714 -6.019 1.00 0.00 C ATOM 274 SD MET A 21 -6.636 -1.154 -6.287 1.00 0.00 S ATOM 275 CE MET A 21 -6.351 -2.263 -4.911 1.00 0.00 C ATOM 0 H MET A 21 -7.603 -0.139 -8.966 1.00 0.00 H new ATOM 0 HA MET A 21 -10.341 -1.175 -8.832 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.275 -1.560 -6.480 1.00 0.00 H new ATOM 0 HB3 MET A 21 -8.919 -2.440 -7.157 1.00 0.00 H new ATOM 0 HG2 MET A 21 -8.485 0.362 -6.146 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.639 -0.947 -4.990 1.00 0.00 H new ATOM 0 HE1 MET A 21 -5.421 -2.809 -5.071 1.00 0.00 H new ATOM 0 HE2 MET A 21 -6.280 -1.687 -3.988 1.00 0.00 H new ATOM 0 HE3 MET A 21 -7.178 -2.969 -4.835 1.00 0.00 H new ATOM 285 N LYS A 22 -10.998 1.000 -7.461 1.00 0.00 N ATOM 286 CA LYS A 22 -11.431 2.361 -7.168 1.00 0.00 C ATOM 287 C LYS A 22 -11.711 2.534 -5.679 1.00 0.00 C ATOM 288 O LYS A 22 -12.053 1.586 -4.973 1.00 0.00 O ATOM 289 CB LYS A 22 -12.685 2.705 -7.977 1.00 0.00 C ATOM 290 CG LYS A 22 -12.554 2.403 -9.460 1.00 0.00 C ATOM 291 CD LYS A 22 -13.912 2.211 -10.112 1.00 0.00 C ATOM 292 CE LYS A 22 -14.360 0.759 -10.051 1.00 0.00 C ATOM 293 NZ LYS A 22 -13.527 -0.115 -10.923 1.00 0.00 N ATOM 0 H LYS A 22 -11.657 0.277 -7.174 1.00 0.00 H new ATOM 0 HA LYS A 22 -10.626 3.040 -7.450 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -13.531 2.148 -7.575 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.911 3.764 -7.849 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -12.025 3.219 -9.953 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.953 1.504 -9.597 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -14.648 2.841 -9.613 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -13.867 2.535 -11.152 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -14.304 0.405 -9.022 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -15.404 0.688 -10.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -14.049 -0.988 -11.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.307 0.386 -11.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.642 -0.354 -10.431 1.00 0.00 H new ATOM 307 N PRO A 23 -11.564 3.774 -5.188 1.00 0.00 N ATOM 308 CA PRO A 23 -11.798 4.101 -3.779 1.00 0.00 C ATOM 309 C PRO A 23 -13.274 4.021 -3.402 1.00 0.00 C ATOM 310 O PRO A 23 -14.113 4.699 -3.996 1.00 0.00 O ATOM 311 CB PRO A 23 -11.293 5.540 -3.659 1.00 0.00 C ATOM 312 CG PRO A 23 -11.415 6.100 -5.035 1.00 0.00 C ATOM 313 CD PRO A 23 -11.159 4.953 -5.973 1.00 0.00 C ATOM 0 HA PRO A 23 -11.296 3.402 -3.110 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -11.888 6.110 -2.945 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.261 5.570 -3.309 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -12.406 6.523 -5.198 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -10.695 6.903 -5.195 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -11.742 5.045 -6.889 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -10.111 4.900 -6.266 1.00 0.00 H new ATOM 321 N ASP A 24 -13.583 3.191 -2.413 1.00 0.00 N ATOM 322 CA ASP A 24 -14.958 3.024 -1.956 1.00 0.00 C ATOM 323 C ASP A 24 -15.562 4.365 -1.552 1.00 0.00 C ATOM 324 O ASP A 24 -14.919 5.407 -1.670 1.00 0.00 O ATOM 325 CB ASP A 24 -15.012 2.050 -0.779 1.00 0.00 C ATOM 326 CG ASP A 24 -16.335 1.313 -0.697 1.00 0.00 C ATOM 327 OD1 ASP A 24 -16.831 0.866 -1.752 1.00 0.00 O ATOM 328 OD2 ASP A 24 -16.875 1.186 0.422 1.00 0.00 O ATOM 0 H ASP A 24 -12.900 2.623 -1.912 1.00 0.00 H new ATOM 0 HA ASP A 24 -15.543 2.616 -2.781 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.202 1.327 -0.872 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.846 2.597 0.149 1.00 0.00 H new ATOM 333 N GLU A 25 -16.803 4.329 -1.075 1.00 0.00 N ATOM 334 CA GLU A 25 -17.494 5.543 -0.655 1.00 0.00 C ATOM 335 C GLU A 25 -16.685 6.292 0.400 1.00 0.00 C ATOM 336 O GLU A 25 -16.650 7.522 0.413 1.00 0.00 O ATOM 337 CB GLU A 25 -18.880 5.202 -0.103 1.00 0.00 C ATOM 338 CG GLU A 25 -19.913 4.923 -1.182 1.00 0.00 C ATOM 339 CD GLU A 25 -21.218 4.396 -0.618 1.00 0.00 C ATOM 340 OE1 GLU A 25 -21.214 3.278 -0.060 1.00 0.00 O ATOM 341 OE2 GLU A 25 -22.243 5.099 -0.735 1.00 0.00 O ATOM 0 H GLU A 25 -17.349 3.474 -0.970 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.606 6.187 -1.527 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -18.799 4.329 0.545 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -19.228 6.028 0.517 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -20.106 5.839 -1.740 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -19.508 4.199 -1.889 1.00 0.00 H new ATOM 348 N ASN A 26 -16.036 5.541 1.284 1.00 0.00 N ATOM 349 CA ASN A 26 -15.228 6.133 2.344 1.00 0.00 C ATOM 350 C ASN A 26 -13.817 6.434 1.848 1.00 0.00 C ATOM 351 O ASN A 26 -12.864 6.444 2.626 1.00 0.00 O ATOM 352 CB ASN A 26 -15.168 5.196 3.552 1.00 0.00 C ATOM 353 CG ASN A 26 -16.370 5.350 4.464 1.00 0.00 C ATOM 354 OD1 ASN A 26 -17.487 5.585 4.003 1.00 0.00 O ATOM 355 ND2 ASN A 26 -16.145 5.219 5.766 1.00 0.00 N ATOM 0 H ASN A 26 -16.054 4.521 1.287 1.00 0.00 H new ATOM 0 HA ASN A 26 -15.696 7.071 2.644 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.108 4.164 3.205 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.258 5.395 4.118 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -16.915 5.313 6.429 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -15.202 5.024 6.104 1.00 0.00 H new ATOM 362 N GLY A 27 -13.692 6.679 0.547 1.00 0.00 N ATOM 363 CA GLY A 27 -12.395 6.978 -0.030 1.00 0.00 C ATOM 364 C GLY A 27 -11.271 6.213 0.642 1.00 0.00 C ATOM 365 O GLY A 27 -10.270 6.801 1.051 1.00 0.00 O ATOM 0 H GLY A 27 -14.466 6.676 -0.117 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.409 6.737 -1.093 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.202 8.048 0.052 1.00 0.00 H new ATOM 369 N ARG A 28 -11.438 4.900 0.759 1.00 0.00 N ATOM 370 CA ARG A 28 -10.432 4.055 1.389 1.00 0.00 C ATOM 371 C ARG A 28 -10.450 2.651 0.793 1.00 0.00 C ATOM 372 O ARG A 28 -11.506 2.131 0.433 1.00 0.00 O ATOM 373 CB ARG A 28 -10.668 3.982 2.899 1.00 0.00 C ATOM 374 CG ARG A 28 -11.895 3.172 3.285 1.00 0.00 C ATOM 375 CD ARG A 28 -11.551 1.706 3.495 1.00 0.00 C ATOM 376 NE ARG A 28 -12.726 0.846 3.378 1.00 0.00 N ATOM 377 CZ ARG A 28 -12.785 -0.388 3.866 1.00 0.00 C ATOM 378 NH1 ARG A 28 -11.741 -0.904 4.501 1.00 0.00 N ATOM 379 NH2 ARG A 28 -13.889 -1.109 3.720 1.00 0.00 N ATOM 0 H ARG A 28 -12.261 4.398 0.425 1.00 0.00 H new ATOM 0 HA ARG A 28 -9.454 4.498 1.202 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -9.790 3.545 3.375 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -10.773 4.994 3.291 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -12.329 3.579 4.198 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -12.651 3.261 2.505 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -10.804 1.400 2.763 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -11.103 1.576 4.480 1.00 0.00 H new ATOM 0 HE ARG A 28 -13.546 1.213 2.895 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -10.890 -0.353 4.616 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -11.789 -1.852 4.875 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -14.694 -0.716 3.232 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.933 -2.056 4.095 1.00 0.00 H new ATOM 393 N PHE A 29 -9.273 2.042 0.690 1.00 0.00 N ATOM 394 CA PHE A 29 -9.153 0.699 0.135 1.00 0.00 C ATOM 395 C PHE A 29 -9.117 -0.347 1.246 1.00 0.00 C ATOM 396 O PHE A 29 -8.903 -0.022 2.413 1.00 0.00 O ATOM 397 CB PHE A 29 -7.892 0.589 -0.724 1.00 0.00 C ATOM 398 CG PHE A 29 -7.787 1.660 -1.773 1.00 0.00 C ATOM 399 CD1 PHE A 29 -8.365 1.487 -3.020 1.00 0.00 C ATOM 400 CD2 PHE A 29 -7.109 2.840 -1.511 1.00 0.00 C ATOM 401 CE1 PHE A 29 -8.270 2.470 -3.986 1.00 0.00 C ATOM 402 CE2 PHE A 29 -7.011 3.827 -2.473 1.00 0.00 C ATOM 403 CZ PHE A 29 -7.591 3.641 -3.713 1.00 0.00 C ATOM 0 H PHE A 29 -8.389 2.457 0.984 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.027 0.512 -0.489 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -7.016 0.638 -0.077 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.876 -0.387 -1.209 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -8.896 0.573 -3.240 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.652 2.990 -0.544 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -8.726 2.323 -4.954 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -6.482 4.743 -2.256 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.514 4.410 -4.467 1.00 0.00 H new ATOM 413 N GLY A 30 -9.329 -1.606 0.873 1.00 0.00 N ATOM 414 CA GLY A 30 -9.318 -2.680 1.849 1.00 0.00 C ATOM 415 C GLY A 30 -8.120 -3.596 1.689 1.00 0.00 C ATOM 416 O GLY A 30 -8.262 -4.754 1.298 1.00 0.00 O ATOM 0 H GLY A 30 -9.508 -1.901 -0.087 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.315 -2.255 2.853 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.233 -3.264 1.753 1.00 0.00 H new ATOM 420 N PHE A 31 -6.935 -3.075 1.990 1.00 0.00 N ATOM 421 CA PHE A 31 -5.707 -3.852 1.876 1.00 0.00 C ATOM 422 C PHE A 31 -4.553 -3.156 2.592 1.00 0.00 C ATOM 423 O PHE A 31 -4.213 -2.016 2.280 1.00 0.00 O ATOM 424 CB PHE A 31 -5.351 -4.069 0.403 1.00 0.00 C ATOM 425 CG PHE A 31 -4.698 -2.878 -0.237 1.00 0.00 C ATOM 426 CD1 PHE A 31 -3.343 -2.639 -0.067 1.00 0.00 C ATOM 427 CD2 PHE A 31 -5.438 -1.996 -1.008 1.00 0.00 C ATOM 428 CE1 PHE A 31 -2.739 -1.544 -0.655 1.00 0.00 C ATOM 429 CE2 PHE A 31 -4.839 -0.900 -1.599 1.00 0.00 C ATOM 430 CZ PHE A 31 -3.488 -0.672 -1.422 1.00 0.00 C ATOM 0 H PHE A 31 -6.800 -2.118 2.315 1.00 0.00 H new ATOM 0 HA PHE A 31 -5.874 -4.819 2.350 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.684 -4.927 0.321 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.258 -4.317 -0.149 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -2.753 -3.317 0.532 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -6.495 -2.167 -1.149 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.682 -1.370 -0.515 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -5.427 -0.222 -2.199 1.00 0.00 H new ATOM 0 HZ PHE A 31 -3.019 0.185 -1.882 1.00 0.00 H new ATOM 440 N ASN A 32 -3.957 -3.851 3.555 1.00 0.00 N ATOM 441 CA ASN A 32 -2.842 -3.300 4.318 1.00 0.00 C ATOM 442 C ASN A 32 -1.513 -3.853 3.814 1.00 0.00 C ATOM 443 O ASN A 32 -1.466 -4.907 3.179 1.00 0.00 O ATOM 444 CB ASN A 32 -3.009 -3.618 5.805 1.00 0.00 C ATOM 445 CG ASN A 32 -1.988 -2.901 6.667 1.00 0.00 C ATOM 446 OD1 ASN A 32 -0.857 -3.362 6.823 1.00 0.00 O ATOM 447 ND2 ASN A 32 -2.383 -1.766 7.232 1.00 0.00 N ATOM 0 H ASN A 32 -4.227 -4.797 3.826 1.00 0.00 H new ATOM 0 HA ASN A 32 -2.840 -2.218 4.183 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -4.012 -3.336 6.124 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -2.917 -4.694 5.956 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -1.739 -1.239 7.823 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -3.330 -1.421 7.075 1.00 0.00 H new ATOM 454 N VAL A 33 -0.432 -3.134 4.102 1.00 0.00 N ATOM 455 CA VAL A 33 0.899 -3.552 3.680 1.00 0.00 C ATOM 456 C VAL A 33 1.864 -3.587 4.859 1.00 0.00 C ATOM 457 O VAL A 33 1.558 -3.085 5.941 1.00 0.00 O ATOM 458 CB VAL A 33 1.465 -2.616 2.596 1.00 0.00 C ATOM 459 CG1 VAL A 33 0.557 -2.602 1.375 1.00 0.00 C ATOM 460 CG2 VAL A 33 1.649 -1.211 3.149 1.00 0.00 C ATOM 0 H VAL A 33 -0.453 -2.259 4.626 1.00 0.00 H new ATOM 0 HA VAL A 33 0.798 -4.555 3.266 1.00 0.00 H new ATOM 0 HB VAL A 33 2.441 -2.992 2.289 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.973 -1.935 0.620 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.481 -3.610 0.967 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.434 -2.251 1.663 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.050 -0.563 2.370 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.687 -0.823 3.484 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.342 -1.239 3.990 1.00 0.00 H new ATOM 470 N LYS A 34 3.032 -4.184 4.644 1.00 0.00 N ATOM 471 CA LYS A 34 4.044 -4.284 5.689 1.00 0.00 C ATOM 472 C LYS A 34 5.447 -4.185 5.098 1.00 0.00 C ATOM 473 O LYS A 34 5.684 -4.601 3.964 1.00 0.00 O ATOM 474 CB LYS A 34 3.892 -5.602 6.451 1.00 0.00 C ATOM 475 CG LYS A 34 4.036 -6.833 5.572 1.00 0.00 C ATOM 476 CD LYS A 34 3.913 -8.113 6.381 1.00 0.00 C ATOM 477 CE LYS A 34 3.891 -9.340 5.482 1.00 0.00 C ATOM 478 NZ LYS A 34 2.582 -9.495 4.788 1.00 0.00 N ATOM 0 H LYS A 34 3.301 -4.606 3.755 1.00 0.00 H new ATOM 0 HA LYS A 34 3.900 -3.454 6.380 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.639 -5.642 7.243 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.915 -5.623 6.933 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.272 -6.818 4.795 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.003 -6.811 5.069 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.748 -8.186 7.078 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.001 -8.081 6.978 1.00 0.00 H new ATOM 0 HE2 LYS A 34 4.688 -9.263 4.742 1.00 0.00 H new ATOM 0 HE3 LYS A 34 4.094 -10.230 6.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 2.707 -10.080 3.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 1.902 -9.954 5.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 2.221 -8.559 4.514 1.00 0.00 H new ATOM 492 N GLY A 35 6.374 -3.633 5.874 1.00 0.00 N ATOM 493 CA GLY A 35 7.742 -3.491 5.411 1.00 0.00 C ATOM 494 C GLY A 35 8.052 -2.083 4.942 1.00 0.00 C ATOM 495 O GLY A 35 7.445 -1.119 5.405 1.00 0.00 O ATOM 0 H GLY A 35 6.202 -3.281 6.816 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.425 -3.761 6.217 1.00 0.00 H new ATOM 0 HA3 GLY A 35 7.920 -4.190 4.594 1.00 0.00 H new ATOM 499 N GLY A 36 9.003 -1.964 4.020 1.00 0.00 N ATOM 500 CA GLY A 36 9.378 -0.660 3.505 1.00 0.00 C ATOM 501 C GLY A 36 10.867 -0.397 3.619 1.00 0.00 C ATOM 502 O GLY A 36 11.565 -1.065 4.382 1.00 0.00 O ATOM 0 H GLY A 36 9.520 -2.747 3.621 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.078 -0.586 2.460 1.00 0.00 H new ATOM 0 HA3 GLY A 36 8.833 0.112 4.048 1.00 0.00 H new ATOM 506 N TYR A 37 11.354 0.576 2.857 1.00 0.00 N ATOM 507 CA TYR A 37 12.770 0.922 2.873 1.00 0.00 C ATOM 508 C TYR A 37 13.293 1.011 4.304 1.00 0.00 C ATOM 509 O TYR A 37 14.482 0.814 4.555 1.00 0.00 O ATOM 510 CB TYR A 37 13.000 2.250 2.150 1.00 0.00 C ATOM 511 CG TYR A 37 14.457 2.640 2.048 1.00 0.00 C ATOM 512 CD1 TYR A 37 15.101 3.279 3.101 1.00 0.00 C ATOM 513 CD2 TYR A 37 15.190 2.370 0.899 1.00 0.00 C ATOM 514 CE1 TYR A 37 16.433 3.637 3.012 1.00 0.00 C ATOM 515 CE2 TYR A 37 16.522 2.723 0.802 1.00 0.00 C ATOM 516 CZ TYR A 37 17.139 3.357 1.861 1.00 0.00 C ATOM 517 OH TYR A 37 18.465 3.712 1.767 1.00 0.00 O ATOM 0 H TYR A 37 10.789 1.139 2.221 1.00 0.00 H new ATOM 0 HA TYR A 37 13.317 0.134 2.354 1.00 0.00 H new ATOM 0 HB2 TYR A 37 12.579 2.185 1.147 1.00 0.00 H new ATOM 0 HB3 TYR A 37 12.458 3.038 2.673 1.00 0.00 H new ATOM 0 HD1 TYR A 37 14.551 3.500 4.004 1.00 0.00 H new ATOM 0 HD2 TYR A 37 14.710 1.876 0.067 1.00 0.00 H new ATOM 0 HE1 TYR A 37 16.918 4.133 3.839 1.00 0.00 H new ATOM 0 HE2 TYR A 37 17.078 2.504 -0.098 1.00 0.00 H new ATOM 0 HH TYR A 37 18.815 3.442 0.892 1.00 0.00 H new ATOM 527 N ASP A 38 12.396 1.309 5.237 1.00 0.00 N ATOM 528 CA ASP A 38 12.765 1.423 6.643 1.00 0.00 C ATOM 529 C ASP A 38 13.294 0.095 7.176 1.00 0.00 C ATOM 530 O ASP A 38 14.258 0.062 7.940 1.00 0.00 O ATOM 531 CB ASP A 38 11.562 1.876 7.473 1.00 0.00 C ATOM 532 CG ASP A 38 10.598 0.743 7.761 1.00 0.00 C ATOM 533 OD1 ASP A 38 10.171 0.069 6.801 1.00 0.00 O ATOM 534 OD2 ASP A 38 10.269 0.530 8.947 1.00 0.00 O ATOM 0 H ASP A 38 11.408 1.476 5.045 1.00 0.00 H new ATOM 0 HA ASP A 38 13.556 2.168 6.726 1.00 0.00 H new ATOM 0 HB2 ASP A 38 11.912 2.299 8.414 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.037 2.670 6.943 1.00 0.00 H new ATOM 539 N GLN A 39 12.656 -0.997 6.767 1.00 0.00 N ATOM 540 CA GLN A 39 13.062 -2.328 7.205 1.00 0.00 C ATOM 541 C GLN A 39 13.762 -3.081 6.079 1.00 0.00 C ATOM 542 O GLN A 39 13.730 -4.311 6.026 1.00 0.00 O ATOM 543 CB GLN A 39 11.847 -3.122 7.687 1.00 0.00 C ATOM 544 CG GLN A 39 11.532 -2.917 9.161 1.00 0.00 C ATOM 545 CD GLN A 39 10.720 -4.055 9.747 1.00 0.00 C ATOM 546 OE1 GLN A 39 11.132 -4.691 10.718 1.00 0.00 O ATOM 547 NE2 GLN A 39 9.558 -4.318 9.161 1.00 0.00 N ATOM 0 H GLN A 39 11.857 -0.987 6.134 1.00 0.00 H new ATOM 0 HA GLN A 39 13.763 -2.213 8.032 1.00 0.00 H new ATOM 0 HB2 GLN A 39 10.978 -2.835 7.095 1.00 0.00 H new ATOM 0 HB3 GLN A 39 12.021 -4.183 7.505 1.00 0.00 H new ATOM 0 HG2 GLN A 39 12.464 -2.816 9.717 1.00 0.00 H new ATOM 0 HG3 GLN A 39 10.984 -1.983 9.285 1.00 0.00 H new ATOM 0 HE21 GLN A 39 9.255 -3.766 8.359 1.00 0.00 H new ATOM 0 HE22 GLN A 39 8.968 -5.072 9.513 1.00 0.00 H new ATOM 556 N LYS A 40 14.395 -2.336 5.179 1.00 0.00 N ATOM 557 CA LYS A 40 15.105 -2.932 4.054 1.00 0.00 C ATOM 558 C LYS A 40 14.367 -4.162 3.535 1.00 0.00 C ATOM 559 O LYS A 40 14.981 -5.186 3.236 1.00 0.00 O ATOM 560 CB LYS A 40 16.528 -3.315 4.467 1.00 0.00 C ATOM 561 CG LYS A 40 17.477 -2.132 4.547 1.00 0.00 C ATOM 562 CD LYS A 40 17.260 -1.329 5.819 1.00 0.00 C ATOM 563 CE LYS A 40 17.694 0.118 5.645 1.00 0.00 C ATOM 564 NZ LYS A 40 18.055 0.749 6.945 1.00 0.00 N ATOM 0 H LYS A 40 14.431 -1.317 5.207 1.00 0.00 H new ATOM 0 HA LYS A 40 15.152 -2.193 3.254 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.495 -3.810 5.438 1.00 0.00 H new ATOM 0 HB3 LYS A 40 16.922 -4.039 3.754 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.507 -2.487 4.511 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.331 -1.488 3.680 1.00 0.00 H new ATOM 0 HD2 LYS A 40 16.207 -1.363 6.097 1.00 0.00 H new ATOM 0 HD3 LYS A 40 17.820 -1.782 6.637 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.549 0.162 4.970 1.00 0.00 H new ATOM 0 HE3 LYS A 40 16.889 0.685 5.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 18.345 1.735 6.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 17.232 0.730 7.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 18.840 0.224 7.380 1.00 0.00 H new ATOM 578 N MET A 41 13.046 -4.054 3.430 1.00 0.00 N ATOM 579 CA MET A 41 12.226 -5.157 2.945 1.00 0.00 C ATOM 580 C MET A 41 11.147 -4.654 1.991 1.00 0.00 C ATOM 581 O MET A 41 10.701 -3.508 2.069 1.00 0.00 O ATOM 582 CB MET A 41 11.580 -5.896 4.119 1.00 0.00 C ATOM 583 CG MET A 41 10.349 -5.198 4.673 1.00 0.00 C ATOM 584 SD MET A 41 9.470 -6.200 5.887 1.00 0.00 S ATOM 585 CE MET A 41 8.439 -7.201 4.817 1.00 0.00 C ATOM 0 H MET A 41 12.522 -3.214 3.674 1.00 0.00 H new ATOM 0 HA MET A 41 12.873 -5.846 2.403 1.00 0.00 H new ATOM 0 HB2 MET A 41 11.304 -6.901 3.798 1.00 0.00 H new ATOM 0 HB3 MET A 41 12.315 -6.007 4.917 1.00 0.00 H new ATOM 0 HG2 MET A 41 10.646 -4.255 5.133 1.00 0.00 H new ATOM 0 HG3 MET A 41 9.674 -4.954 3.852 1.00 0.00 H new ATOM 0 HE1 MET A 41 7.833 -7.875 5.422 1.00 0.00 H new ATOM 0 HE2 MET A 41 7.786 -6.554 4.231 1.00 0.00 H new ATOM 0 HE3 MET A 41 9.069 -7.784 4.145 1.00 0.00 H new ATOM 595 N PRO A 42 10.715 -5.527 1.069 1.00 0.00 N ATOM 596 CA PRO A 42 9.684 -5.193 0.083 1.00 0.00 C ATOM 597 C PRO A 42 8.306 -5.033 0.717 1.00 0.00 C ATOM 598 O PRO A 42 8.026 -5.605 1.771 1.00 0.00 O ATOM 599 CB PRO A 42 9.698 -6.393 -0.867 1.00 0.00 C ATOM 600 CG PRO A 42 10.223 -7.520 -0.045 1.00 0.00 C ATOM 601 CD PRO A 42 11.202 -6.909 0.919 1.00 0.00 C ATOM 0 HA PRO A 42 9.884 -4.241 -0.408 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.699 -6.610 -1.245 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.333 -6.205 -1.733 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.416 -8.025 0.486 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.708 -8.268 -0.672 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.211 -7.438 1.872 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.220 -6.937 0.530 1.00 0.00 H new ATOM 609 N VAL A 43 7.449 -4.250 0.070 1.00 0.00 N ATOM 610 CA VAL A 43 6.100 -4.016 0.570 1.00 0.00 C ATOM 611 C VAL A 43 5.148 -5.120 0.123 1.00 0.00 C ATOM 612 O VAL A 43 4.859 -5.261 -1.066 1.00 0.00 O ATOM 613 CB VAL A 43 5.552 -2.657 0.092 1.00 0.00 C ATOM 614 CG1 VAL A 43 4.238 -2.337 0.787 1.00 0.00 C ATOM 615 CG2 VAL A 43 6.574 -1.557 0.333 1.00 0.00 C ATOM 0 H VAL A 43 7.665 -3.767 -0.802 1.00 0.00 H new ATOM 0 HA VAL A 43 6.163 -4.013 1.658 1.00 0.00 H new ATOM 0 HB VAL A 43 5.363 -2.717 -0.980 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.866 -1.374 0.437 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.507 -3.113 0.559 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.397 -2.295 1.864 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.171 -0.604 -0.010 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.797 -1.494 1.398 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.488 -1.783 -0.216 1.00 0.00 H new ATOM 625 N ILE A 44 4.664 -5.901 1.083 1.00 0.00 N ATOM 626 CA ILE A 44 3.744 -6.992 0.788 1.00 0.00 C ATOM 627 C ILE A 44 2.472 -6.879 1.622 1.00 0.00 C ATOM 628 O ILE A 44 2.511 -6.464 2.781 1.00 0.00 O ATOM 629 CB ILE A 44 4.395 -8.363 1.048 1.00 0.00 C ATOM 630 CG1 ILE A 44 5.665 -8.516 0.209 1.00 0.00 C ATOM 631 CG2 ILE A 44 3.412 -9.483 0.741 1.00 0.00 C ATOM 632 CD1 ILE A 44 6.903 -7.964 0.881 1.00 0.00 C ATOM 0 H ILE A 44 4.894 -5.798 2.071 1.00 0.00 H new ATOM 0 HA ILE A 44 3.491 -6.914 -0.269 1.00 0.00 H new ATOM 0 HB ILE A 44 4.669 -8.425 2.101 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.821 -9.572 -0.010 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.523 -8.010 -0.746 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.887 -10.446 0.930 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.533 -9.381 1.378 1.00 0.00 H new ATOM 0 HG23 ILE A 44 3.110 -9.426 -0.305 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.765 -8.107 0.229 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.767 -6.900 1.076 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.070 -8.487 1.823 1.00 0.00 H new ATOM 644 N VAL A 45 1.344 -7.252 1.026 1.00 0.00 N ATOM 645 CA VAL A 45 0.060 -7.196 1.714 1.00 0.00 C ATOM 646 C VAL A 45 0.108 -7.966 3.029 1.00 0.00 C ATOM 647 O VAL A 45 0.732 -9.023 3.119 1.00 0.00 O ATOM 648 CB VAL A 45 -1.071 -7.766 0.838 1.00 0.00 C ATOM 649 CG1 VAL A 45 -2.386 -7.775 1.604 1.00 0.00 C ATOM 650 CG2 VAL A 45 -1.201 -6.967 -0.450 1.00 0.00 C ATOM 0 H VAL A 45 1.294 -7.597 0.067 1.00 0.00 H new ATOM 0 HA VAL A 45 -0.145 -6.145 1.919 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.822 -8.795 0.577 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.174 -8.181 0.970 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.283 -8.393 2.496 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.644 -6.757 1.896 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -2.005 -7.384 -1.057 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.427 -5.928 -0.212 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.264 -7.017 -1.005 1.00 0.00 H new ATOM 660 N SER A 46 -0.557 -7.429 4.047 1.00 0.00 N ATOM 661 CA SER A 46 -0.588 -8.064 5.359 1.00 0.00 C ATOM 662 C SER A 46 -1.929 -8.752 5.598 1.00 0.00 C ATOM 663 O SER A 46 -1.981 -9.940 5.919 1.00 0.00 O ATOM 664 CB SER A 46 -0.331 -7.029 6.457 1.00 0.00 C ATOM 665 OG SER A 46 -0.949 -5.792 6.145 1.00 0.00 O ATOM 0 H SER A 46 -1.081 -6.556 3.988 1.00 0.00 H new ATOM 0 HA SER A 46 0.199 -8.818 5.389 1.00 0.00 H new ATOM 0 HB2 SER A 46 -0.713 -7.400 7.408 1.00 0.00 H new ATOM 0 HB3 SER A 46 0.742 -6.883 6.579 1.00 0.00 H new ATOM 0 HG SER A 46 -0.562 -5.084 6.701 1.00 0.00 H new ATOM 671 N ARG A 47 -3.011 -7.998 5.438 1.00 0.00 N ATOM 672 CA ARG A 47 -4.352 -8.533 5.637 1.00 0.00 C ATOM 673 C ARG A 47 -5.323 -7.965 4.606 1.00 0.00 C ATOM 674 O ARG A 47 -5.118 -6.870 4.082 1.00 0.00 O ATOM 675 CB ARG A 47 -4.848 -8.215 7.049 1.00 0.00 C ATOM 676 CG ARG A 47 -5.995 -9.101 7.506 1.00 0.00 C ATOM 677 CD ARG A 47 -5.552 -10.546 7.669 1.00 0.00 C ATOM 678 NE ARG A 47 -6.524 -11.335 8.421 1.00 0.00 N ATOM 679 CZ ARG A 47 -6.702 -11.226 9.733 1.00 0.00 C ATOM 680 NH1 ARG A 47 -5.977 -10.365 10.434 1.00 0.00 N ATOM 681 NH2 ARG A 47 -7.606 -11.978 10.347 1.00 0.00 N ATOM 0 H ARG A 47 -2.985 -7.014 5.171 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.306 -9.615 5.511 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -4.019 -8.320 7.748 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -5.167 -7.174 7.087 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.387 -8.731 8.453 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -6.808 -9.048 6.782 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -5.405 -10.993 6.686 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.589 -10.575 8.179 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.098 -12.007 7.911 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.281 -9.785 9.966 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.115 -10.283 11.441 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.166 -12.642 9.812 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.741 -11.893 11.354 1.00 0.00 H new ATOM 695 N VAL A 48 -6.380 -8.718 4.318 1.00 0.00 N ATOM 696 CA VAL A 48 -7.383 -8.290 3.351 1.00 0.00 C ATOM 697 C VAL A 48 -8.789 -8.638 3.825 1.00 0.00 C ATOM 698 O VAL A 48 -9.189 -9.802 3.813 1.00 0.00 O ATOM 699 CB VAL A 48 -7.144 -8.934 1.972 1.00 0.00 C ATOM 700 CG1 VAL A 48 -8.179 -8.449 0.969 1.00 0.00 C ATOM 701 CG2 VAL A 48 -5.734 -8.638 1.483 1.00 0.00 C ATOM 0 H VAL A 48 -6.564 -9.628 4.741 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.292 -7.208 3.260 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.250 -10.014 2.072 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.994 -8.915 0.001 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.176 -8.718 1.316 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.110 -7.366 0.870 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.583 -9.100 0.508 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.597 -7.560 1.399 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.011 -9.041 2.192 1.00 0.00 H new ATOM 711 N ALA A 49 -9.536 -7.621 4.243 1.00 0.00 N ATOM 712 CA ALA A 49 -10.899 -7.820 4.720 1.00 0.00 C ATOM 713 C ALA A 49 -11.864 -8.019 3.556 1.00 0.00 C ATOM 714 O ALA A 49 -11.686 -7.469 2.469 1.00 0.00 O ATOM 715 CB ALA A 49 -11.336 -6.639 5.574 1.00 0.00 C ATOM 0 H ALA A 49 -9.220 -6.651 4.261 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.916 -8.723 5.331 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.356 -6.800 5.924 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.669 -6.543 6.431 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -11.297 -5.726 4.980 1.00 0.00 H new ATOM 721 N PRO A 50 -12.911 -8.825 3.786 1.00 0.00 N ATOM 722 CA PRO A 50 -13.925 -9.116 2.768 1.00 0.00 C ATOM 723 C PRO A 50 -14.800 -7.906 2.459 1.00 0.00 C ATOM 724 O PRO A 50 -14.726 -6.884 3.141 1.00 0.00 O ATOM 725 CB PRO A 50 -14.759 -10.230 3.406 1.00 0.00 C ATOM 726 CG PRO A 50 -14.582 -10.043 4.873 1.00 0.00 C ATOM 727 CD PRO A 50 -13.186 -9.515 5.058 1.00 0.00 C ATOM 0 HA PRO A 50 -13.477 -9.394 1.814 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.808 -10.152 3.121 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.415 -11.214 3.088 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.319 -9.344 5.269 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.717 -10.984 5.405 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -13.123 -8.834 5.907 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -12.473 -10.319 5.241 1.00 0.00 H new ATOM 735 N GLY A 51 -15.629 -8.028 1.427 1.00 0.00 N ATOM 736 CA GLY A 51 -16.506 -6.937 1.046 1.00 0.00 C ATOM 737 C GLY A 51 -15.751 -5.647 0.795 1.00 0.00 C ATOM 738 O GLY A 51 -16.258 -4.558 1.067 1.00 0.00 O ATOM 0 H GLY A 51 -15.709 -8.864 0.848 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -17.055 -7.214 0.146 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.243 -6.776 1.833 1.00 0.00 H new ATOM 742 N THR A 52 -14.533 -5.767 0.275 1.00 0.00 N ATOM 743 CA THR A 52 -13.705 -4.602 -0.010 1.00 0.00 C ATOM 744 C THR A 52 -13.375 -4.512 -1.496 1.00 0.00 C ATOM 745 O THR A 52 -13.348 -5.513 -2.212 1.00 0.00 O ATOM 746 CB THR A 52 -12.392 -4.635 0.794 1.00 0.00 C ATOM 747 OG1 THR A 52 -11.729 -5.889 0.598 1.00 0.00 O ATOM 748 CG2 THR A 52 -12.660 -4.425 2.277 1.00 0.00 C ATOM 0 H THR A 52 -14.098 -6.660 0.043 1.00 0.00 H new ATOM 0 HA THR A 52 -14.281 -3.725 0.286 1.00 0.00 H new ATOM 0 HB THR A 52 -11.754 -3.827 0.438 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.488 -6.271 1.468 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.718 -4.452 2.824 1.00 0.00 H new ATOM 0 HG22 THR A 52 -13.139 -3.457 2.427 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.316 -5.215 2.644 1.00 0.00 H new ATOM 756 N PRO A 53 -13.118 -3.285 -1.973 1.00 0.00 N ATOM 757 CA PRO A 53 -12.784 -3.036 -3.378 1.00 0.00 C ATOM 758 C PRO A 53 -11.408 -3.577 -3.752 1.00 0.00 C ATOM 759 O PRO A 53 -10.949 -3.406 -4.881 1.00 0.00 O ATOM 760 CB PRO A 53 -12.804 -1.509 -3.482 1.00 0.00 C ATOM 761 CG PRO A 53 -12.519 -1.031 -2.100 1.00 0.00 C ATOM 762 CD PRO A 53 -13.132 -2.047 -1.176 1.00 0.00 C ATOM 0 HA PRO A 53 -13.478 -3.533 -4.056 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.054 -1.150 -4.187 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.771 -1.149 -3.834 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.446 -0.946 -1.930 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.947 -0.043 -1.933 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.555 -2.154 -0.257 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.145 -1.767 -0.886 1.00 0.00 H new ATOM 770 N ALA A 54 -10.754 -4.230 -2.796 1.00 0.00 N ATOM 771 CA ALA A 54 -9.432 -4.798 -3.026 1.00 0.00 C ATOM 772 C ALA A 54 -9.516 -6.298 -3.288 1.00 0.00 C ATOM 773 O ALA A 54 -8.590 -6.895 -3.836 1.00 0.00 O ATOM 774 CB ALA A 54 -8.523 -4.517 -1.838 1.00 0.00 C ATOM 0 H ALA A 54 -11.119 -4.378 -1.855 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.010 -4.325 -3.913 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.539 -4.947 -2.023 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.428 -3.440 -1.699 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -8.950 -4.963 -0.940 1.00 0.00 H new ATOM 780 N ASP A 55 -10.632 -6.900 -2.892 1.00 0.00 N ATOM 781 CA ASP A 55 -10.837 -8.331 -3.084 1.00 0.00 C ATOM 782 C ASP A 55 -11.759 -8.593 -4.271 1.00 0.00 C ATOM 783 O ASP A 55 -11.355 -9.204 -5.262 1.00 0.00 O ATOM 784 CB ASP A 55 -11.424 -8.958 -1.818 1.00 0.00 C ATOM 785 CG ASP A 55 -11.013 -10.407 -1.646 1.00 0.00 C ATOM 786 OD1 ASP A 55 -9.798 -10.668 -1.524 1.00 0.00 O ATOM 787 OD2 ASP A 55 -11.906 -11.280 -1.632 1.00 0.00 O ATOM 0 H ASP A 55 -11.408 -6.420 -2.436 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.869 -8.788 -3.291 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -11.100 -8.386 -0.949 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -12.511 -8.894 -1.855 1.00 0.00 H new ATOM 792 N LEU A 56 -12.999 -8.130 -4.164 1.00 0.00 N ATOM 793 CA LEU A 56 -13.980 -8.315 -5.228 1.00 0.00 C ATOM 794 C LEU A 56 -13.379 -7.973 -6.588 1.00 0.00 C ATOM 795 O LEU A 56 -13.751 -8.556 -7.607 1.00 0.00 O ATOM 796 CB LEU A 56 -15.212 -7.447 -4.970 1.00 0.00 C ATOM 797 CG LEU A 56 -15.880 -7.618 -3.605 1.00 0.00 C ATOM 798 CD1 LEU A 56 -16.932 -6.542 -3.386 1.00 0.00 C ATOM 799 CD2 LEU A 56 -16.497 -9.003 -3.483 1.00 0.00 C ATOM 0 H LEU A 56 -13.350 -7.623 -3.351 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.277 -9.364 -5.236 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.925 -6.402 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.950 -7.661 -5.743 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.117 -7.513 -2.833 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.396 -6.680 -2.410 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -16.462 -5.560 -3.428 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.693 -6.614 -4.163 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -16.968 -9.107 -2.505 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.247 -9.137 -4.263 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.719 -9.759 -3.593 1.00 0.00 H new ATOM 811 N CYS A 57 -12.447 -7.026 -6.595 1.00 0.00 N ATOM 812 CA CYS A 57 -11.792 -6.607 -7.830 1.00 0.00 C ATOM 813 C CYS A 57 -11.088 -7.783 -8.498 1.00 0.00 C ATOM 814 O CYS A 57 -10.833 -8.809 -7.866 1.00 0.00 O ATOM 815 CB CYS A 57 -10.787 -5.490 -7.545 1.00 0.00 C ATOM 816 SG CYS A 57 -9.396 -5.996 -6.507 1.00 0.00 S ATOM 0 H CYS A 57 -12.128 -6.534 -5.760 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.558 -6.232 -8.509 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -10.401 -5.113 -8.492 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -11.306 -4.663 -7.060 1.00 0.00 H new ATOM 0 HG CYS A 57 -8.759 -6.973 -7.081 1.00 0.00 H new ATOM 822 N VAL A 58 -10.776 -7.629 -9.781 1.00 0.00 N ATOM 823 CA VAL A 58 -10.102 -8.678 -10.536 1.00 0.00 C ATOM 824 C VAL A 58 -8.804 -8.166 -11.149 1.00 0.00 C ATOM 825 O VAL A 58 -8.789 -7.210 -11.926 1.00 0.00 O ATOM 826 CB VAL A 58 -11.003 -9.231 -11.656 1.00 0.00 C ATOM 827 CG1 VAL A 58 -10.178 -10.011 -12.669 1.00 0.00 C ATOM 828 CG2 VAL A 58 -12.105 -10.102 -11.071 1.00 0.00 C ATOM 0 H VAL A 58 -10.980 -6.787 -10.319 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.877 -9.479 -9.832 1.00 0.00 H new ATOM 0 HB VAL A 58 -11.469 -8.391 -12.172 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.832 -10.394 -13.453 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -9.428 -9.354 -13.110 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.682 -10.844 -12.170 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -12.732 -10.485 -11.876 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.660 -10.937 -10.530 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.713 -9.509 -10.388 1.00 0.00 H new ATOM 838 N PRO A 59 -7.685 -8.815 -10.795 1.00 0.00 N ATOM 839 CA PRO A 59 -7.689 -9.954 -9.871 1.00 0.00 C ATOM 840 C PRO A 59 -8.019 -9.539 -8.441 1.00 0.00 C ATOM 841 O PRO A 59 -8.147 -8.351 -8.144 1.00 0.00 O ATOM 842 CB PRO A 59 -6.257 -10.486 -9.957 1.00 0.00 C ATOM 843 CG PRO A 59 -5.441 -9.312 -10.377 1.00 0.00 C ATOM 844 CD PRO A 59 -6.329 -8.488 -11.268 1.00 0.00 C ATOM 0 HA PRO A 59 -8.448 -10.691 -10.135 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -5.922 -10.878 -8.997 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -6.180 -11.300 -10.678 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -5.113 -8.735 -9.512 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -4.543 -9.630 -10.907 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -6.116 -7.423 -11.173 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -6.196 -8.747 -12.318 1.00 0.00 H new ATOM 852 N ARG A 60 -8.154 -10.524 -7.560 1.00 0.00 N ATOM 853 CA ARG A 60 -8.469 -10.261 -6.161 1.00 0.00 C ATOM 854 C ARG A 60 -7.194 -10.096 -5.339 1.00 0.00 C ATOM 855 O ARG A 60 -6.363 -11.002 -5.274 1.00 0.00 O ATOM 856 CB ARG A 60 -9.317 -11.396 -5.585 1.00 0.00 C ATOM 857 CG ARG A 60 -9.559 -11.276 -4.089 1.00 0.00 C ATOM 858 CD ARG A 60 -9.716 -12.642 -3.439 1.00 0.00 C ATOM 859 NE ARG A 60 -8.431 -13.211 -3.045 1.00 0.00 N ATOM 860 CZ ARG A 60 -8.268 -14.480 -2.685 1.00 0.00 C ATOM 861 NH1 ARG A 60 -9.304 -15.306 -2.672 1.00 0.00 N ATOM 862 NH2 ARG A 60 -7.066 -14.923 -2.339 1.00 0.00 N ATOM 0 H ARG A 60 -8.050 -11.512 -7.790 1.00 0.00 H new ATOM 0 HA ARG A 60 -9.036 -9.332 -6.110 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -10.278 -11.418 -6.099 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.824 -12.346 -5.790 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.727 -10.745 -3.626 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -10.455 -10.682 -3.911 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.358 -12.555 -2.562 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.215 -13.319 -4.133 1.00 0.00 H new ATOM 0 HE ARG A 60 -7.613 -12.601 -3.046 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -10.229 -14.968 -2.939 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.177 -16.279 -2.395 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -6.267 -14.290 -2.349 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -6.941 -15.897 -2.063 1.00 0.00 H new ATOM 876 N LEU A 61 -7.047 -8.934 -4.712 1.00 0.00 N ATOM 877 CA LEU A 61 -5.873 -8.649 -3.893 1.00 0.00 C ATOM 878 C LEU A 61 -5.874 -9.499 -2.626 1.00 0.00 C ATOM 879 O LEU A 61 -6.851 -9.515 -1.879 1.00 0.00 O ATOM 880 CB LEU A 61 -5.831 -7.165 -3.526 1.00 0.00 C ATOM 881 CG LEU A 61 -4.484 -6.633 -3.036 1.00 0.00 C ATOM 882 CD1 LEU A 61 -3.462 -6.649 -4.162 1.00 0.00 C ATOM 883 CD2 LEU A 61 -4.638 -5.227 -2.474 1.00 0.00 C ATOM 0 H LEU A 61 -7.726 -8.174 -4.755 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.985 -8.898 -4.474 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.131 -6.587 -4.400 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.575 -6.982 -2.751 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.126 -7.285 -2.239 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.510 -6.267 -3.794 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.330 -7.670 -4.519 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.813 -6.021 -4.981 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.669 -4.865 -2.130 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.018 -4.564 -3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.337 -5.244 -1.638 1.00 0.00 H new ATOM 895 N ASN A 62 -4.771 -10.202 -2.391 1.00 0.00 N ATOM 896 CA ASN A 62 -4.644 -11.053 -1.213 1.00 0.00 C ATOM 897 C ASN A 62 -3.233 -10.978 -0.638 1.00 0.00 C ATOM 898 O ASN A 62 -2.328 -10.422 -1.259 1.00 0.00 O ATOM 899 CB ASN A 62 -4.987 -12.502 -1.566 1.00 0.00 C ATOM 900 CG ASN A 62 -4.250 -13.499 -0.692 1.00 0.00 C ATOM 901 OD1 ASN A 62 -4.651 -13.763 0.442 1.00 0.00 O ATOM 902 ND2 ASN A 62 -3.166 -14.058 -1.218 1.00 0.00 N ATOM 0 H ASN A 62 -3.953 -10.199 -3.000 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.344 -10.694 -0.459 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.061 -12.655 -1.460 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -4.740 -12.687 -2.611 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -2.629 -14.736 -0.678 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.871 -13.809 -2.162 1.00 0.00 H new ATOM 909 N GLU A 63 -3.055 -11.542 0.553 1.00 0.00 N ATOM 910 CA GLU A 63 -1.754 -11.538 1.212 1.00 0.00 C ATOM 911 C GLU A 63 -0.702 -12.219 0.342 1.00 0.00 C ATOM 912 O GLU A 63 -1.019 -13.087 -0.471 1.00 0.00 O ATOM 913 CB GLU A 63 -1.843 -12.241 2.568 1.00 0.00 C ATOM 914 CG GLU A 63 -2.895 -11.651 3.492 1.00 0.00 C ATOM 915 CD GLU A 63 -3.304 -12.606 4.596 1.00 0.00 C ATOM 916 OE1 GLU A 63 -3.566 -13.788 4.291 1.00 0.00 O ATOM 917 OE2 GLU A 63 -3.362 -12.171 5.765 1.00 0.00 O ATOM 0 H GLU A 63 -3.794 -12.007 1.080 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.456 -10.501 1.367 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.064 -13.296 2.407 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -0.871 -12.190 3.059 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.510 -10.733 3.935 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.774 -11.379 2.908 1.00 0.00 H new ATOM 924 N GLY A 64 0.554 -11.818 0.518 1.00 0.00 N ATOM 925 CA GLY A 64 1.634 -12.398 -0.257 1.00 0.00 C ATOM 926 C GLY A 64 2.028 -11.535 -1.440 1.00 0.00 C ATOM 927 O GLY A 64 3.213 -11.374 -1.732 1.00 0.00 O ATOM 0 H GLY A 64 0.842 -11.101 1.184 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.501 -12.544 0.387 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.333 -13.383 -0.614 1.00 0.00 H new ATOM 931 N ASP A 65 1.032 -10.981 -2.122 1.00 0.00 N ATOM 932 CA ASP A 65 1.280 -10.130 -3.280 1.00 0.00 C ATOM 933 C ASP A 65 2.262 -9.015 -2.935 1.00 0.00 C ATOM 934 O ASP A 65 1.962 -8.142 -2.121 1.00 0.00 O ATOM 935 CB ASP A 65 -0.032 -9.532 -3.791 1.00 0.00 C ATOM 936 CG ASP A 65 -0.991 -10.589 -4.301 1.00 0.00 C ATOM 937 OD1 ASP A 65 -0.515 -11.616 -4.828 1.00 0.00 O ATOM 938 OD2 ASP A 65 -2.217 -10.389 -4.173 1.00 0.00 O ATOM 0 H ASP A 65 0.046 -11.106 -1.893 1.00 0.00 H new ATOM 0 HA ASP A 65 1.719 -10.746 -4.065 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.509 -8.970 -2.988 1.00 0.00 H new ATOM 0 HB3 ASP A 65 0.182 -8.824 -4.591 1.00 0.00 H new ATOM 943 N GLN A 66 3.435 -9.052 -3.559 1.00 0.00 N ATOM 944 CA GLN A 66 4.462 -8.045 -3.315 1.00 0.00 C ATOM 945 C GLN A 66 4.311 -6.871 -4.276 1.00 0.00 C ATOM 946 O GLN A 66 4.257 -7.053 -5.493 1.00 0.00 O ATOM 947 CB GLN A 66 5.854 -8.661 -3.459 1.00 0.00 C ATOM 948 CG GLN A 66 6.973 -7.633 -3.495 1.00 0.00 C ATOM 949 CD GLN A 66 7.302 -7.178 -4.904 1.00 0.00 C ATOM 950 OE1 GLN A 66 6.618 -7.541 -5.861 1.00 0.00 O ATOM 951 NE2 GLN A 66 8.355 -6.380 -5.038 1.00 0.00 N ATOM 0 H GLN A 66 3.698 -9.768 -4.237 1.00 0.00 H new ATOM 0 HA GLN A 66 4.339 -7.676 -2.297 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.027 -9.345 -2.628 1.00 0.00 H new ATOM 0 HB3 GLN A 66 5.887 -9.254 -4.373 1.00 0.00 H new ATOM 0 HG2 GLN A 66 6.687 -6.769 -2.896 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.866 -8.057 -3.036 1.00 0.00 H new ATOM 0 HE21 GLN A 66 8.894 -6.104 -4.217 1.00 0.00 H new ATOM 0 HE22 GLN A 66 8.625 -6.043 -5.962 1.00 0.00 H new ATOM 960 N VAL A 67 4.242 -5.664 -3.723 1.00 0.00 N ATOM 961 CA VAL A 67 4.098 -4.459 -4.531 1.00 0.00 C ATOM 962 C VAL A 67 5.452 -3.963 -5.024 1.00 0.00 C ATOM 963 O VAL A 67 6.351 -3.685 -4.229 1.00 0.00 O ATOM 964 CB VAL A 67 3.407 -3.332 -3.740 1.00 0.00 C ATOM 965 CG1 VAL A 67 3.239 -2.096 -4.609 1.00 0.00 C ATOM 966 CG2 VAL A 67 2.065 -3.804 -3.203 1.00 0.00 C ATOM 0 H VAL A 67 4.284 -5.495 -2.718 1.00 0.00 H new ATOM 0 HA VAL A 67 3.478 -4.724 -5.387 1.00 0.00 H new ATOM 0 HB VAL A 67 4.038 -3.067 -2.892 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.749 -1.310 -4.034 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.218 -1.748 -4.939 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.630 -2.343 -5.478 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.591 -2.995 -2.647 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.424 -4.098 -4.034 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.217 -4.658 -2.543 1.00 0.00 H new ATOM 976 N VAL A 68 5.593 -3.853 -6.341 1.00 0.00 N ATOM 977 CA VAL A 68 6.837 -3.388 -6.941 1.00 0.00 C ATOM 978 C VAL A 68 6.831 -1.874 -7.118 1.00 0.00 C ATOM 979 O VAL A 68 7.756 -1.184 -6.688 1.00 0.00 O ATOM 980 CB VAL A 68 7.083 -4.053 -8.309 1.00 0.00 C ATOM 981 CG1 VAL A 68 8.439 -3.645 -8.865 1.00 0.00 C ATOM 982 CG2 VAL A 68 6.979 -5.566 -8.193 1.00 0.00 C ATOM 0 H VAL A 68 4.860 -4.080 -7.013 1.00 0.00 H new ATOM 0 HA VAL A 68 7.640 -3.667 -6.259 1.00 0.00 H new ATOM 0 HB VAL A 68 6.315 -3.711 -9.002 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.595 -4.124 -9.831 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.471 -2.562 -8.987 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.224 -3.956 -8.175 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.156 -6.019 -9.169 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.724 -5.929 -7.485 1.00 0.00 H new ATOM 0 HG23 VAL A 68 5.983 -5.836 -7.842 1.00 0.00 H new ATOM 992 N LEU A 69 5.781 -1.363 -7.752 1.00 0.00 N ATOM 993 CA LEU A 69 5.653 0.071 -7.985 1.00 0.00 C ATOM 994 C LEU A 69 4.204 0.521 -7.829 1.00 0.00 C ATOM 995 O LEU A 69 3.278 -0.281 -7.957 1.00 0.00 O ATOM 996 CB LEU A 69 6.162 0.428 -9.383 1.00 0.00 C ATOM 997 CG LEU A 69 7.482 -0.219 -9.802 1.00 0.00 C ATOM 998 CD1 LEU A 69 7.652 -0.156 -11.312 1.00 0.00 C ATOM 999 CD2 LEU A 69 8.653 0.457 -9.103 1.00 0.00 C ATOM 0 H LEU A 69 5.007 -1.920 -8.113 1.00 0.00 H new ATOM 0 HA LEU A 69 6.257 0.590 -7.241 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.398 0.149 -10.108 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.277 1.510 -9.441 1.00 0.00 H new ATOM 0 HG LEU A 69 7.462 -1.267 -9.503 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.597 -0.621 -11.591 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.830 -0.686 -11.793 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.651 0.885 -11.635 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.584 -0.017 -9.413 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.676 1.513 -9.371 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.538 0.359 -8.024 1.00 0.00 H new ATOM 1011 N ILE A 70 4.015 1.807 -7.554 1.00 0.00 N ATOM 1012 CA ILE A 70 2.678 2.363 -7.384 1.00 0.00 C ATOM 1013 C ILE A 70 2.475 3.587 -8.272 1.00 0.00 C ATOM 1014 O ILE A 70 3.232 4.554 -8.196 1.00 0.00 O ATOM 1015 CB ILE A 70 2.414 2.756 -5.919 1.00 0.00 C ATOM 1016 CG1 ILE A 70 2.567 1.538 -5.006 1.00 0.00 C ATOM 1017 CG2 ILE A 70 1.026 3.363 -5.775 1.00 0.00 C ATOM 1018 CD1 ILE A 70 2.430 1.864 -3.535 1.00 0.00 C ATOM 0 H ILE A 70 4.770 2.483 -7.444 1.00 0.00 H new ATOM 0 HA ILE A 70 1.973 1.585 -7.675 1.00 0.00 H new ATOM 0 HB ILE A 70 3.148 3.504 -5.621 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.817 0.795 -5.276 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.543 1.084 -5.180 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.854 3.636 -4.734 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.951 4.253 -6.400 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.277 2.636 -6.088 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.550 0.953 -2.948 1.00 0.00 H new ATOM 0 HD12 ILE A 70 3.197 2.584 -3.249 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.444 2.290 -3.347 1.00 0.00 H new ATOM 1030 N ASN A 71 1.446 3.537 -9.112 1.00 0.00 N ATOM 1031 CA ASN A 71 1.142 4.642 -10.013 1.00 0.00 C ATOM 1032 C ASN A 71 2.313 4.917 -10.952 1.00 0.00 C ATOM 1033 O ASN A 71 2.495 6.039 -11.424 1.00 0.00 O ATOM 1034 CB ASN A 71 0.809 5.904 -9.214 1.00 0.00 C ATOM 1035 CG ASN A 71 -0.663 5.993 -8.861 1.00 0.00 C ATOM 1036 OD1 ASN A 71 -1.237 4.876 -8.429 1.00 0.00 O flip ATOM 1037 ND2 ASN A 71 -1.277 7.054 -8.976 1.00 0.00 N flip ATOM 0 H ASN A 71 0.809 2.744 -9.187 1.00 0.00 H new ATOM 0 HA ASN A 71 0.276 4.360 -10.612 1.00 0.00 H new ATOM 0 HB2 ASN A 71 1.401 5.918 -8.299 1.00 0.00 H new ATOM 0 HB3 ASN A 71 1.095 6.783 -9.792 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -0.795 7.888 -9.312 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -2.267 7.099 -8.735 1.00 0.00 H new ATOM 1044 N GLY A 72 3.105 3.883 -11.220 1.00 0.00 N ATOM 1045 CA GLY A 72 4.248 4.032 -12.102 1.00 0.00 C ATOM 1046 C GLY A 72 5.470 4.565 -11.381 1.00 0.00 C ATOM 1047 O GLY A 72 6.586 4.486 -11.895 1.00 0.00 O ATOM 0 H GLY A 72 2.975 2.945 -10.842 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.486 3.067 -12.550 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.988 4.706 -12.918 1.00 0.00 H new ATOM 1051 N ARG A 73 5.260 5.111 -10.188 1.00 0.00 N ATOM 1052 CA ARG A 73 6.354 5.662 -9.397 1.00 0.00 C ATOM 1053 C ARG A 73 6.924 4.609 -8.451 1.00 0.00 C ATOM 1054 O ARG A 73 6.191 3.776 -7.918 1.00 0.00 O ATOM 1055 CB ARG A 73 5.873 6.874 -8.597 1.00 0.00 C ATOM 1056 CG ARG A 73 5.984 8.187 -9.356 1.00 0.00 C ATOM 1057 CD ARG A 73 5.166 9.284 -8.693 1.00 0.00 C ATOM 1058 NE ARG A 73 5.410 10.591 -9.299 1.00 0.00 N ATOM 1059 CZ ARG A 73 4.902 10.966 -10.467 1.00 0.00 C ATOM 1060 NH1 ARG A 73 4.125 10.138 -11.152 1.00 0.00 N ATOM 1061 NH2 ARG A 73 5.171 12.171 -10.952 1.00 0.00 N ATOM 0 H ARG A 73 4.343 5.184 -9.748 1.00 0.00 H new ATOM 0 HA ARG A 73 7.142 5.976 -10.081 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.834 6.718 -8.307 1.00 0.00 H new ATOM 0 HB3 ARG A 73 6.453 6.945 -7.677 1.00 0.00 H new ATOM 0 HG2 ARG A 73 7.029 8.492 -9.407 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.642 8.046 -10.381 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.106 9.042 -8.768 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.409 9.326 -7.631 1.00 0.00 H new ATOM 0 HE ARG A 73 6.003 11.252 -8.797 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.916 9.211 -10.782 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.736 10.428 -12.049 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.768 12.810 -10.428 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.780 12.458 -11.849 1.00 0.00 H new ATOM 1075 N ASP A 74 8.236 4.654 -8.247 1.00 0.00 N ATOM 1076 CA ASP A 74 8.906 3.704 -7.365 1.00 0.00 C ATOM 1077 C ASP A 74 8.613 4.022 -5.902 1.00 0.00 C ATOM 1078 O ASP A 74 8.890 5.125 -5.429 1.00 0.00 O ATOM 1079 CB ASP A 74 10.415 3.723 -7.612 1.00 0.00 C ATOM 1080 CG ASP A 74 10.962 5.131 -7.749 1.00 0.00 C ATOM 1081 OD1 ASP A 74 10.396 6.051 -7.122 1.00 0.00 O ATOM 1082 OD2 ASP A 74 11.957 5.312 -8.481 1.00 0.00 O ATOM 0 H ASP A 74 8.857 5.338 -8.680 1.00 0.00 H new ATOM 0 HA ASP A 74 8.523 2.708 -7.586 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.921 3.218 -6.789 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.639 3.160 -8.518 1.00 0.00 H new ATOM 1087 N ILE A 75 8.051 3.050 -5.192 1.00 0.00 N ATOM 1088 CA ILE A 75 7.721 3.227 -3.783 1.00 0.00 C ATOM 1089 C ILE A 75 8.717 2.495 -2.889 1.00 0.00 C ATOM 1090 O ILE A 75 9.006 2.934 -1.776 1.00 0.00 O ATOM 1091 CB ILE A 75 6.300 2.722 -3.470 1.00 0.00 C ATOM 1092 CG1 ILE A 75 6.210 1.212 -3.697 1.00 0.00 C ATOM 1093 CG2 ILE A 75 5.278 3.454 -4.327 1.00 0.00 C ATOM 1094 CD1 ILE A 75 6.592 0.395 -2.483 1.00 0.00 C ATOM 0 H ILE A 75 7.815 2.132 -5.569 1.00 0.00 H new ATOM 0 HA ILE A 75 7.771 4.297 -3.579 1.00 0.00 H new ATOM 0 HB ILE A 75 6.080 2.926 -2.422 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.192 0.957 -3.991 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.860 0.938 -4.528 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.278 3.087 -4.095 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.329 4.523 -4.120 1.00 0.00 H new ATOM 0 HG23 ILE A 75 5.494 3.278 -5.381 1.00 0.00 H new ATOM 0 HD11 ILE A 75 6.505 -0.666 -2.716 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.620 0.621 -2.201 1.00 0.00 H new ATOM 0 HD13 ILE A 75 5.926 0.640 -1.655 1.00 0.00 H new ATOM 1106 N ALA A 76 9.240 1.379 -3.385 1.00 0.00 N ATOM 1107 CA ALA A 76 10.206 0.588 -2.633 1.00 0.00 C ATOM 1108 C ALA A 76 11.308 1.470 -2.058 1.00 0.00 C ATOM 1109 O ALA A 76 11.900 1.147 -1.028 1.00 0.00 O ATOM 1110 CB ALA A 76 10.803 -0.497 -3.518 1.00 0.00 C ATOM 0 H ALA A 76 9.011 1.002 -4.305 1.00 0.00 H new ATOM 0 HA ALA A 76 9.683 0.116 -1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 76 11.523 -1.080 -2.943 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.009 -1.152 -3.876 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.305 -0.037 -4.369 1.00 0.00 H new ATOM 1116 N GLU A 77 11.580 2.585 -2.730 1.00 0.00 N ATOM 1117 CA GLU A 77 12.613 3.512 -2.285 1.00 0.00 C ATOM 1118 C GLU A 77 12.124 4.345 -1.104 1.00 0.00 C ATOM 1119 O GLU A 77 12.908 4.736 -0.239 1.00 0.00 O ATOM 1120 CB GLU A 77 13.032 4.433 -3.433 1.00 0.00 C ATOM 1121 CG GLU A 77 14.436 4.995 -3.281 1.00 0.00 C ATOM 1122 CD GLU A 77 14.510 6.109 -2.255 1.00 0.00 C ATOM 1123 OE1 GLU A 77 13.628 6.992 -2.274 1.00 0.00 O ATOM 1124 OE2 GLU A 77 15.450 6.097 -1.433 1.00 0.00 O ATOM 0 H GLU A 77 11.099 2.867 -3.584 1.00 0.00 H new ATOM 0 HA GLU A 77 13.475 2.928 -1.964 1.00 0.00 H new ATOM 0 HB2 GLU A 77 12.970 3.882 -4.371 1.00 0.00 H new ATOM 0 HB3 GLU A 77 12.324 5.259 -3.502 1.00 0.00 H new ATOM 0 HG2 GLU A 77 15.115 4.193 -2.991 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.779 5.370 -4.245 1.00 0.00 H new ATOM 1131 N HIS A 78 10.822 4.614 -1.075 1.00 0.00 N ATOM 1132 CA HIS A 78 10.228 5.400 0.000 1.00 0.00 C ATOM 1133 C HIS A 78 9.996 4.540 1.239 1.00 0.00 C ATOM 1134 O HIS A 78 9.725 3.343 1.135 1.00 0.00 O ATOM 1135 CB HIS A 78 8.907 6.017 -0.461 1.00 0.00 C ATOM 1136 CG HIS A 78 9.074 7.315 -1.189 1.00 0.00 C ATOM 1137 ND1 HIS A 78 8.585 7.535 -2.459 1.00 0.00 N ATOM 1138 CD2 HIS A 78 9.679 8.467 -0.816 1.00 0.00 C ATOM 1139 CE1 HIS A 78 8.884 8.765 -2.837 1.00 0.00 C ATOM 1140 NE2 HIS A 78 9.547 9.352 -1.858 1.00 0.00 N ATOM 0 H HIS A 78 10.159 4.299 -1.783 1.00 0.00 H new ATOM 0 HA HIS A 78 10.923 6.199 0.259 1.00 0.00 H new ATOM 0 HB2 HIS A 78 8.392 5.309 -1.111 1.00 0.00 H new ATOM 0 HB3 HIS A 78 8.267 6.176 0.407 1.00 0.00 H new ATOM 0 HD2 HIS A 78 10.173 8.655 0.126 1.00 0.00 H new ATOM 0 HE1 HIS A 78 8.629 9.214 -3.786 1.00 0.00 H new ATOM 0 HE2 HIS A 78 9.903 10.308 -1.873 1.00 0.00 H new ATOM 1149 N THR A 79 10.104 5.157 2.411 1.00 0.00 N ATOM 1150 CA THR A 79 9.908 4.448 3.669 1.00 0.00 C ATOM 1151 C THR A 79 8.428 4.193 3.932 1.00 0.00 C ATOM 1152 O THR A 79 7.562 4.836 3.339 1.00 0.00 O ATOM 1153 CB THR A 79 10.500 5.234 4.855 1.00 0.00 C ATOM 1154 OG1 THR A 79 9.983 6.569 4.865 1.00 0.00 O ATOM 1155 CG2 THR A 79 12.019 5.273 4.774 1.00 0.00 C ATOM 0 H THR A 79 10.326 6.147 2.515 1.00 0.00 H new ATOM 0 HA THR A 79 10.428 3.494 3.578 1.00 0.00 H new ATOM 0 HB THR A 79 10.214 4.728 5.777 1.00 0.00 H new ATOM 0 HG1 THR A 79 10.458 7.109 4.199 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.414 5.833 5.621 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.411 4.256 4.797 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.322 5.758 3.846 1.00 0.00 H new ATOM 1163 N HIS A 80 8.145 3.250 4.825 1.00 0.00 N ATOM 1164 CA HIS A 80 6.768 2.910 5.167 1.00 0.00 C ATOM 1165 C HIS A 80 5.906 4.166 5.262 1.00 0.00 C ATOM 1166 O HIS A 80 4.899 4.293 4.566 1.00 0.00 O ATOM 1167 CB HIS A 80 6.723 2.146 6.490 1.00 0.00 C ATOM 1168 CG HIS A 80 5.409 1.476 6.751 1.00 0.00 C ATOM 1169 ND1 HIS A 80 4.751 0.717 5.806 1.00 0.00 N ATOM 1170 CD2 HIS A 80 4.631 1.453 7.858 1.00 0.00 C ATOM 1171 CE1 HIS A 80 3.624 0.258 6.320 1.00 0.00 C ATOM 1172 NE2 HIS A 80 3.528 0.689 7.565 1.00 0.00 N ATOM 0 H HIS A 80 8.850 2.708 5.325 1.00 0.00 H new ATOM 0 HA HIS A 80 6.369 2.275 4.376 1.00 0.00 H new ATOM 0 HB2 HIS A 80 7.512 1.394 6.493 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.938 2.836 7.306 1.00 0.00 H new ATOM 0 HD2 HIS A 80 4.839 1.944 8.797 1.00 0.00 H new ATOM 0 HE1 HIS A 80 2.904 -0.364 5.809 1.00 0.00 H new ATOM 0 HE2 HIS A 80 2.760 0.487 8.205 1.00 0.00 H new ATOM 1181 N ASP A 81 6.309 5.090 6.127 1.00 0.00 N ATOM 1182 CA ASP A 81 5.574 6.335 6.313 1.00 0.00 C ATOM 1183 C ASP A 81 5.203 6.953 4.968 1.00 0.00 C ATOM 1184 O ASP A 81 4.056 7.340 4.748 1.00 0.00 O ATOM 1185 CB ASP A 81 6.404 7.325 7.131 1.00 0.00 C ATOM 1186 CG ASP A 81 7.044 6.680 8.345 1.00 0.00 C ATOM 1187 OD1 ASP A 81 6.326 6.447 9.340 1.00 0.00 O ATOM 1188 OD2 ASP A 81 8.262 6.409 8.300 1.00 0.00 O ATOM 0 H ASP A 81 7.141 5.000 6.710 1.00 0.00 H new ATOM 0 HA ASP A 81 4.656 6.108 6.855 1.00 0.00 H new ATOM 0 HB2 ASP A 81 7.182 7.753 6.498 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.767 8.149 7.454 1.00 0.00 H new ATOM 1193 N GLN A 82 6.182 7.043 4.074 1.00 0.00 N ATOM 1194 CA GLN A 82 5.958 7.615 2.752 1.00 0.00 C ATOM 1195 C GLN A 82 4.995 6.754 1.941 1.00 0.00 C ATOM 1196 O GLN A 82 3.974 7.238 1.452 1.00 0.00 O ATOM 1197 CB GLN A 82 7.285 7.759 2.004 1.00 0.00 C ATOM 1198 CG GLN A 82 8.024 9.049 2.319 1.00 0.00 C ATOM 1199 CD GLN A 82 8.593 9.067 3.724 1.00 0.00 C ATOM 1200 OE1 GLN A 82 9.914 8.990 3.829 1.00 0.00 O flip ATOM 1201 NE2 GLN A 82 7.853 9.149 4.705 1.00 0.00 N flip ATOM 0 H GLN A 82 7.137 6.727 4.241 1.00 0.00 H new ATOM 0 HA GLN A 82 5.513 8.601 2.882 1.00 0.00 H new ATOM 0 HB2 GLN A 82 7.926 6.913 2.252 1.00 0.00 H new ATOM 0 HB3 GLN A 82 7.095 7.711 0.932 1.00 0.00 H new ATOM 0 HG2 GLN A 82 8.833 9.184 1.602 1.00 0.00 H new ATOM 0 HG3 GLN A 82 7.344 9.892 2.195 1.00 0.00 H new ATOM 0 HE21 GLN A 82 6.843 9.206 4.578 1.00 0.00 H new ATOM 0 HE22 GLN A 82 8.251 9.160 5.644 1.00 0.00 H new ATOM 1210 N VAL A 83 5.326 5.474 1.804 1.00 0.00 N ATOM 1211 CA VAL A 83 4.490 4.544 1.053 1.00 0.00 C ATOM 1212 C VAL A 83 3.035 4.628 1.502 1.00 0.00 C ATOM 1213 O VAL A 83 2.150 4.967 0.717 1.00 0.00 O ATOM 1214 CB VAL A 83 4.982 3.093 1.212 1.00 0.00 C ATOM 1215 CG1 VAL A 83 4.060 2.133 0.476 1.00 0.00 C ATOM 1216 CG2 VAL A 83 6.413 2.959 0.712 1.00 0.00 C ATOM 0 H VAL A 83 6.167 5.057 2.203 1.00 0.00 H new ATOM 0 HA VAL A 83 4.561 4.831 0.004 1.00 0.00 H new ATOM 0 HB VAL A 83 4.965 2.835 2.271 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.423 1.113 0.600 1.00 0.00 H new ATOM 0 HG12 VAL A 83 3.052 2.211 0.884 1.00 0.00 H new ATOM 0 HG13 VAL A 83 4.043 2.386 -0.584 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.745 1.928 0.832 1.00 0.00 H new ATOM 0 HG22 VAL A 83 6.458 3.235 -0.342 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.063 3.618 1.287 1.00 0.00 H new ATOM 1226 N VAL A 84 2.795 4.318 2.772 1.00 0.00 N ATOM 1227 CA VAL A 84 1.448 4.359 3.328 1.00 0.00 C ATOM 1228 C VAL A 84 0.714 5.624 2.896 1.00 0.00 C ATOM 1229 O VAL A 84 -0.338 5.557 2.258 1.00 0.00 O ATOM 1230 CB VAL A 84 1.473 4.294 4.866 1.00 0.00 C ATOM 1231 CG1 VAL A 84 0.065 4.423 5.429 1.00 0.00 C ATOM 1232 CG2 VAL A 84 2.126 3.002 5.334 1.00 0.00 C ATOM 0 H VAL A 84 3.516 4.036 3.435 1.00 0.00 H new ATOM 0 HA VAL A 84 0.920 3.486 2.944 1.00 0.00 H new ATOM 0 HB VAL A 84 2.066 5.130 5.238 1.00 0.00 H new ATOM 0 HG11 VAL A 84 0.102 4.375 6.517 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.363 5.377 5.123 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.554 3.609 5.051 1.00 0.00 H new ATOM 0 HG21 VAL A 84 2.135 2.973 6.424 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.562 2.151 4.953 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.149 2.956 4.961 1.00 0.00 H new ATOM 1242 N LEU A 85 1.275 6.776 3.246 1.00 0.00 N ATOM 1243 CA LEU A 85 0.674 8.058 2.894 1.00 0.00 C ATOM 1244 C LEU A 85 0.498 8.180 1.384 1.00 0.00 C ATOM 1245 O LEU A 85 -0.475 8.764 0.907 1.00 0.00 O ATOM 1246 CB LEU A 85 1.539 9.208 3.413 1.00 0.00 C ATOM 1247 CG LEU A 85 1.285 9.640 4.858 1.00 0.00 C ATOM 1248 CD1 LEU A 85 2.480 10.406 5.404 1.00 0.00 C ATOM 1249 CD2 LEU A 85 0.022 10.484 4.948 1.00 0.00 C ATOM 0 H LEU A 85 2.145 6.849 3.773 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.309 8.112 3.361 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.586 8.919 3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.388 10.071 2.765 1.00 0.00 H new ATOM 0 HG LEU A 85 1.145 8.746 5.465 1.00 0.00 H new ATOM 0 HD11 LEU A 85 2.281 10.705 6.433 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.364 9.769 5.376 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.652 11.293 4.795 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.143 10.782 5.983 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.134 11.373 4.327 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.830 9.902 4.598 1.00 0.00 H new ATOM 1261 N PHE A 86 1.445 7.623 0.636 1.00 0.00 N ATOM 1262 CA PHE A 86 1.394 7.669 -0.821 1.00 0.00 C ATOM 1263 C PHE A 86 0.098 7.052 -1.339 1.00 0.00 C ATOM 1264 O PHE A 86 -0.567 7.618 -2.207 1.00 0.00 O ATOM 1265 CB PHE A 86 2.596 6.934 -1.417 1.00 0.00 C ATOM 1266 CG PHE A 86 2.815 7.227 -2.874 1.00 0.00 C ATOM 1267 CD1 PHE A 86 2.952 8.531 -3.319 1.00 0.00 C ATOM 1268 CD2 PHE A 86 2.882 6.197 -3.799 1.00 0.00 C ATOM 1269 CE1 PHE A 86 3.154 8.804 -4.659 1.00 0.00 C ATOM 1270 CE2 PHE A 86 3.084 6.464 -5.140 1.00 0.00 C ATOM 1271 CZ PHE A 86 3.219 7.769 -5.571 1.00 0.00 C ATOM 0 H PHE A 86 2.257 7.135 1.014 1.00 0.00 H new ATOM 0 HA PHE A 86 1.427 8.714 -1.129 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.492 7.209 -0.861 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.457 5.861 -1.287 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.900 9.345 -2.611 1.00 0.00 H new ATOM 0 HD2 PHE A 86 2.775 5.174 -3.468 1.00 0.00 H new ATOM 0 HE1 PHE A 86 3.261 9.826 -4.992 1.00 0.00 H new ATOM 0 HE2 PHE A 86 3.136 5.652 -5.851 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.375 7.980 -6.619 1.00 0.00 H new ATOM 1281 N ILE A 87 -0.253 5.889 -0.802 1.00 0.00 N ATOM 1282 CA ILE A 87 -1.468 5.195 -1.209 1.00 0.00 C ATOM 1283 C ILE A 87 -2.701 6.063 -0.976 1.00 0.00 C ATOM 1284 O ILE A 87 -3.442 6.372 -1.909 1.00 0.00 O ATOM 1285 CB ILE A 87 -1.640 3.866 -0.450 1.00 0.00 C ATOM 1286 CG1 ILE A 87 -0.426 2.963 -0.679 1.00 0.00 C ATOM 1287 CG2 ILE A 87 -2.917 3.166 -0.889 1.00 0.00 C ATOM 1288 CD1 ILE A 87 -0.148 2.022 0.472 1.00 0.00 C ATOM 0 H ILE A 87 0.287 5.407 -0.083 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.369 4.985 -2.274 1.00 0.00 H new ATOM 0 HB ILE A 87 -1.715 4.081 0.616 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.584 2.379 -1.586 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.453 3.585 -0.850 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.024 2.228 -0.343 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.774 3.807 -0.680 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.870 2.960 -1.958 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.726 1.413 0.241 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.042 2.600 1.377 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.011 1.375 0.629 1.00 0.00 H new ATOM 1300 N LYS A 88 -2.913 6.455 0.276 1.00 0.00 N ATOM 1301 CA LYS A 88 -4.054 7.290 0.633 1.00 0.00 C ATOM 1302 C LYS A 88 -4.128 8.522 -0.264 1.00 0.00 C ATOM 1303 O LYS A 88 -5.163 8.800 -0.868 1.00 0.00 O ATOM 1304 CB LYS A 88 -3.959 7.719 2.099 1.00 0.00 C ATOM 1305 CG LYS A 88 -4.456 6.665 3.074 1.00 0.00 C ATOM 1306 CD LYS A 88 -4.197 7.072 4.515 1.00 0.00 C ATOM 1307 CE LYS A 88 -4.442 5.916 5.473 1.00 0.00 C ATOM 1308 NZ LYS A 88 -5.881 5.538 5.528 1.00 0.00 N ATOM 0 H LYS A 88 -2.310 6.208 1.060 1.00 0.00 H new ATOM 0 HA LYS A 88 -4.961 6.703 0.490 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -2.921 7.958 2.333 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.536 8.633 2.240 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.524 6.506 2.926 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.961 5.716 2.869 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -3.169 7.419 4.617 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.843 7.909 4.780 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -3.852 5.054 5.161 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -4.100 6.192 6.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -6.007 4.747 6.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -6.442 6.353 5.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -6.201 5.250 4.581 1.00 0.00 H new ATOM 1322 N ALA A 89 -3.023 9.256 -0.346 1.00 0.00 N ATOM 1323 CA ALA A 89 -2.962 10.456 -1.171 1.00 0.00 C ATOM 1324 C ALA A 89 -3.804 10.297 -2.433 1.00 0.00 C ATOM 1325 O ALA A 89 -4.661 11.130 -2.728 1.00 0.00 O ATOM 1326 CB ALA A 89 -1.519 10.775 -1.534 1.00 0.00 C ATOM 0 H ALA A 89 -2.158 9.040 0.149 1.00 0.00 H new ATOM 0 HA ALA A 89 -3.371 11.285 -0.594 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -1.489 11.674 -2.150 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.943 10.940 -0.624 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -1.090 9.940 -2.089 1.00 0.00 H new ATOM 1332 N SER A 90 -3.553 9.223 -3.175 1.00 0.00 N ATOM 1333 CA SER A 90 -4.285 8.958 -4.408 1.00 0.00 C ATOM 1334 C SER A 90 -5.745 9.380 -4.275 1.00 0.00 C ATOM 1335 O SER A 90 -6.270 10.112 -5.114 1.00 0.00 O ATOM 1336 CB SER A 90 -4.202 7.473 -4.766 1.00 0.00 C ATOM 1337 OG SER A 90 -4.504 7.260 -6.134 1.00 0.00 O ATOM 0 H SER A 90 -2.849 8.523 -2.944 1.00 0.00 H new ATOM 0 HA SER A 90 -3.827 9.543 -5.206 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.202 7.099 -4.549 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.896 6.907 -4.145 1.00 0.00 H new ATOM 0 HG SER A 90 -4.756 6.323 -6.271 1.00 0.00 H new ATOM 1343 N CYS A 91 -6.394 8.913 -3.214 1.00 0.00 N ATOM 1344 CA CYS A 91 -7.795 9.240 -2.970 1.00 0.00 C ATOM 1345 C CYS A 91 -8.028 10.744 -3.075 1.00 0.00 C ATOM 1346 O CYS A 91 -8.893 11.196 -3.823 1.00 0.00 O ATOM 1347 CB CYS A 91 -8.223 8.741 -1.589 1.00 0.00 C ATOM 1348 SG CYS A 91 -9.869 9.293 -1.083 1.00 0.00 S ATOM 0 H CYS A 91 -5.973 8.307 -2.509 1.00 0.00 H new ATOM 0 HA CYS A 91 -8.397 8.743 -3.731 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -8.200 7.651 -1.585 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -7.495 9.078 -0.851 1.00 0.00 H new ATOM 0 HG CYS A 91 -9.981 9.196 0.209 1.00 0.00 H new ATOM 1354 N GLU A 92 -7.250 11.512 -2.318 1.00 0.00 N ATOM 1355 CA GLU A 92 -7.375 12.965 -2.325 1.00 0.00 C ATOM 1356 C GLU A 92 -6.466 13.584 -3.384 1.00 0.00 C ATOM 1357 O GLU A 92 -5.757 14.554 -3.118 1.00 0.00 O ATOM 1358 CB GLU A 92 -7.032 13.535 -0.947 1.00 0.00 C ATOM 1359 CG GLU A 92 -7.724 14.854 -0.645 1.00 0.00 C ATOM 1360 CD GLU A 92 -7.205 15.508 0.620 1.00 0.00 C ATOM 1361 OE1 GLU A 92 -5.978 15.469 0.849 1.00 0.00 O ATOM 1362 OE2 GLU A 92 -8.026 16.061 1.382 1.00 0.00 O ATOM 0 H GLU A 92 -6.528 11.153 -1.693 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.408 13.214 -2.567 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -7.306 12.807 -0.183 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.953 13.676 -0.880 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -7.584 15.534 -1.485 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -8.796 14.684 -0.548 1.00 0.00 H new ATOM 1369 N ARG A 93 -6.493 13.015 -4.584 1.00 0.00 N ATOM 1370 CA ARG A 93 -5.672 13.509 -5.683 1.00 0.00 C ATOM 1371 C ARG A 93 -6.467 13.544 -6.984 1.00 0.00 C ATOM 1372 O ARG A 93 -7.417 12.780 -7.165 1.00 0.00 O ATOM 1373 CB ARG A 93 -4.431 12.630 -5.855 1.00 0.00 C ATOM 1374 CG ARG A 93 -3.431 13.179 -6.859 1.00 0.00 C ATOM 1375 CD ARG A 93 -2.458 12.104 -7.320 1.00 0.00 C ATOM 1376 NE ARG A 93 -1.525 12.606 -8.326 1.00 0.00 N ATOM 1377 CZ ARG A 93 -1.877 12.901 -9.572 1.00 0.00 C ATOM 1378 NH1 ARG A 93 -3.134 12.745 -9.965 1.00 0.00 N ATOM 1379 NH2 ARG A 93 -0.970 13.352 -10.429 1.00 0.00 N ATOM 0 H ARG A 93 -7.075 12.211 -4.820 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.360 14.525 -5.441 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -3.939 12.518 -4.889 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.742 11.635 -6.172 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -3.963 13.584 -7.720 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -2.878 14.004 -6.410 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -1.899 11.729 -6.463 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.016 11.262 -7.731 1.00 0.00 H new ATOM 0 HE ARG A 93 -0.550 12.737 -8.057 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.834 12.397 -9.309 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -3.401 12.973 -10.923 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -0.002 13.472 -10.131 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -1.241 13.578 -11.386 1.00 0.00 H new ATOM 1393 N HIS A 94 -6.075 14.435 -7.889 1.00 0.00 N ATOM 1394 CA HIS A 94 -6.751 14.569 -9.174 1.00 0.00 C ATOM 1395 C HIS A 94 -6.977 13.203 -9.814 1.00 0.00 C ATOM 1396 O HIS A 94 -6.445 12.194 -9.351 1.00 0.00 O ATOM 1397 CB HIS A 94 -5.935 15.458 -10.113 1.00 0.00 C ATOM 1398 CG HIS A 94 -6.748 16.080 -11.206 1.00 0.00 C ATOM 1399 ND1 HIS A 94 -6.312 16.168 -12.512 1.00 0.00 N ATOM 1400 CD2 HIS A 94 -7.977 16.645 -11.183 1.00 0.00 C ATOM 1401 CE1 HIS A 94 -7.237 16.762 -13.243 1.00 0.00 C ATOM 1402 NE2 HIS A 94 -8.259 17.061 -12.461 1.00 0.00 N ATOM 0 H HIS A 94 -5.292 15.075 -7.756 1.00 0.00 H new ATOM 0 HA HIS A 94 -7.722 15.033 -9.000 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -5.460 16.247 -9.531 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -5.136 14.865 -10.558 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -8.618 16.749 -10.320 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -7.170 16.969 -14.301 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -9.117 17.525 -12.758 1.00 0.00 H new ATOM 1411 N SER A 95 -7.770 13.179 -10.881 1.00 0.00 N ATOM 1412 CA SER A 95 -8.070 11.936 -11.582 1.00 0.00 C ATOM 1413 C SER A 95 -6.859 11.008 -11.584 1.00 0.00 C ATOM 1414 O SER A 95 -5.798 11.354 -12.101 1.00 0.00 O ATOM 1415 CB SER A 95 -8.505 12.229 -13.020 1.00 0.00 C ATOM 1416 OG SER A 95 -7.501 12.943 -13.721 1.00 0.00 O ATOM 0 H SER A 95 -8.216 14.006 -11.278 1.00 0.00 H new ATOM 0 HA SER A 95 -8.886 11.439 -11.057 1.00 0.00 H new ATOM 0 HB2 SER A 95 -8.718 11.293 -13.537 1.00 0.00 H new ATOM 0 HB3 SER A 95 -9.429 12.807 -13.013 1.00 0.00 H new ATOM 0 HG SER A 95 -6.618 12.607 -13.460 1.00 0.00 H new ATOM 1422 N GLY A 96 -7.028 9.825 -11.001 1.00 0.00 N ATOM 1423 CA GLY A 96 -5.942 8.863 -10.946 1.00 0.00 C ATOM 1424 C GLY A 96 -6.303 7.626 -10.148 1.00 0.00 C ATOM 1425 O GLY A 96 -6.066 7.567 -8.942 1.00 0.00 O ATOM 0 H GLY A 96 -7.897 9.516 -10.566 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -5.668 8.571 -11.960 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.065 9.335 -10.502 1.00 0.00 H new ATOM 1429 N GLU A 97 -6.880 6.636 -10.823 1.00 0.00 N ATOM 1430 CA GLU A 97 -7.276 5.396 -10.168 1.00 0.00 C ATOM 1431 C GLU A 97 -6.113 4.800 -9.381 1.00 0.00 C ATOM 1432 O GLU A 97 -4.967 5.230 -9.523 1.00 0.00 O ATOM 1433 CB GLU A 97 -7.778 4.385 -11.201 1.00 0.00 C ATOM 1434 CG GLU A 97 -6.696 3.895 -12.149 1.00 0.00 C ATOM 1435 CD GLU A 97 -6.114 5.010 -12.996 1.00 0.00 C ATOM 1436 OE1 GLU A 97 -6.737 5.368 -14.017 1.00 0.00 O ATOM 1437 OE2 GLU A 97 -5.035 5.526 -12.636 1.00 0.00 O ATOM 0 H GLU A 97 -7.083 6.669 -11.822 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.083 5.625 -9.472 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.208 3.529 -10.680 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.580 4.840 -11.782 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.898 3.427 -11.573 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.111 3.127 -12.802 1.00 0.00 H new ATOM 1444 N LEU A 98 -6.414 3.808 -8.550 1.00 0.00 N ATOM 1445 CA LEU A 98 -5.394 3.152 -7.740 1.00 0.00 C ATOM 1446 C LEU A 98 -4.733 2.014 -8.511 1.00 0.00 C ATOM 1447 O LEU A 98 -5.363 0.994 -8.792 1.00 0.00 O ATOM 1448 CB LEU A 98 -6.009 2.616 -6.446 1.00 0.00 C ATOM 1449 CG LEU A 98 -5.073 2.536 -5.240 1.00 0.00 C ATOM 1450 CD1 LEU A 98 -3.915 1.591 -5.525 1.00 0.00 C ATOM 1451 CD2 LEU A 98 -4.556 3.919 -4.872 1.00 0.00 C ATOM 0 H LEU A 98 -7.356 3.440 -8.420 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.631 3.891 -7.494 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.857 3.248 -6.181 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.404 1.619 -6.641 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.636 2.144 -4.393 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.259 1.547 -4.656 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.302 0.595 -5.739 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.353 1.954 -6.385 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.891 3.842 -4.011 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.009 4.340 -5.716 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.396 4.568 -4.624 1.00 0.00 H new ATOM 1463 N MET A 99 -3.461 2.195 -8.849 1.00 0.00 N ATOM 1464 CA MET A 99 -2.714 1.182 -9.585 1.00 0.00 C ATOM 1465 C MET A 99 -1.626 0.566 -8.711 1.00 0.00 C ATOM 1466 O MET A 99 -0.970 1.263 -7.936 1.00 0.00 O ATOM 1467 CB MET A 99 -2.091 1.790 -10.843 1.00 0.00 C ATOM 1468 CG MET A 99 -1.940 0.800 -11.986 1.00 0.00 C ATOM 1469 SD MET A 99 -3.387 0.756 -13.062 1.00 0.00 S ATOM 1470 CE MET A 99 -2.621 0.956 -14.668 1.00 0.00 C ATOM 0 H MET A 99 -2.926 3.034 -8.625 1.00 0.00 H new ATOM 0 HA MET A 99 -3.409 0.395 -9.877 1.00 0.00 H new ATOM 0 HB2 MET A 99 -2.707 2.626 -11.176 1.00 0.00 H new ATOM 0 HB3 MET A 99 -1.111 2.196 -10.593 1.00 0.00 H new ATOM 0 HG2 MET A 99 -1.062 1.063 -12.575 1.00 0.00 H new ATOM 0 HG3 MET A 99 -1.765 -0.196 -11.579 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.379 1.232 -15.401 1.00 0.00 H new ATOM 0 HE2 MET A 99 -1.865 1.739 -14.615 1.00 0.00 H new ATOM 0 HE3 MET A 99 -2.152 0.018 -14.967 1.00 0.00 H new ATOM 1480 N LEU A 100 -1.440 -0.743 -8.840 1.00 0.00 N ATOM 1481 CA LEU A 100 -0.431 -1.453 -8.061 1.00 0.00 C ATOM 1482 C LEU A 100 0.146 -2.621 -8.854 1.00 0.00 C ATOM 1483 O LEU A 100 -0.562 -3.574 -9.180 1.00 0.00 O ATOM 1484 CB LEU A 100 -1.035 -1.960 -6.750 1.00 0.00 C ATOM 1485 CG LEU A 100 -1.841 -0.942 -5.943 1.00 0.00 C ATOM 1486 CD1 LEU A 100 -2.922 -1.639 -5.132 1.00 0.00 C ATOM 1487 CD2 LEU A 100 -0.925 -0.135 -5.034 1.00 0.00 C ATOM 0 H LEU A 100 -1.974 -1.334 -9.476 1.00 0.00 H new ATOM 0 HA LEU A 100 0.377 -0.756 -7.836 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.681 -2.808 -6.975 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.227 -2.333 -6.122 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.324 -0.256 -6.639 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.485 -0.898 -4.564 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.596 -2.170 -5.804 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.461 -2.349 -4.445 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.516 0.584 -4.468 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.413 -0.806 -4.345 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.189 0.396 -5.638 1.00 0.00 H new ATOM 1499 N LEU A 101 1.437 -2.541 -9.159 1.00 0.00 N ATOM 1500 CA LEU A 101 2.111 -3.593 -9.911 1.00 0.00 C ATOM 1501 C LEU A 101 2.702 -4.640 -8.973 1.00 0.00 C ATOM 1502 O LEU A 101 3.726 -4.407 -8.331 1.00 0.00 O ATOM 1503 CB LEU A 101 3.215 -2.994 -10.785 1.00 0.00 C ATOM 1504 CG LEU A 101 3.857 -3.942 -11.799 1.00 0.00 C ATOM 1505 CD1 LEU A 101 2.901 -4.224 -12.947 1.00 0.00 C ATOM 1506 CD2 LEU A 101 5.163 -3.359 -12.321 1.00 0.00 C ATOM 0 H LEU A 101 2.037 -1.759 -8.897 1.00 0.00 H new ATOM 0 HA LEU A 101 1.373 -4.079 -10.549 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.801 -2.142 -11.325 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.998 -2.608 -10.132 1.00 0.00 H new ATOM 0 HG LEU A 101 4.077 -4.884 -11.297 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.376 -4.900 -13.658 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.992 -4.685 -12.559 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.649 -3.290 -13.448 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.606 -4.047 -13.041 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.967 -2.403 -12.806 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.853 -3.210 -11.490 1.00 0.00 H new ATOM 1518 N VAL A 102 2.051 -5.797 -8.902 1.00 0.00 N ATOM 1519 CA VAL A 102 2.513 -6.883 -8.045 1.00 0.00 C ATOM 1520 C VAL A 102 3.108 -8.018 -8.870 1.00 0.00 C ATOM 1521 O VAL A 102 2.702 -8.251 -10.008 1.00 0.00 O ATOM 1522 CB VAL A 102 1.369 -7.439 -7.177 1.00 0.00 C ATOM 1523 CG1 VAL A 102 0.723 -6.324 -6.367 1.00 0.00 C ATOM 1524 CG2 VAL A 102 0.338 -8.146 -8.043 1.00 0.00 C ATOM 0 H VAL A 102 1.202 -6.006 -9.428 1.00 0.00 H new ATOM 0 HA VAL A 102 3.283 -6.468 -7.395 1.00 0.00 H new ATOM 0 HB VAL A 102 1.785 -8.167 -6.481 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.083 -6.736 -5.760 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.469 -5.867 -5.717 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.320 -5.570 -7.043 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.463 -8.533 -7.413 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.076 -7.441 -8.764 1.00 0.00 H new ATOM 0 HG23 VAL A 102 0.813 -8.971 -8.573 1.00 0.00 H new ATOM 1534 N ARG A 103 4.073 -8.723 -8.288 1.00 0.00 N ATOM 1535 CA ARG A 103 4.725 -9.835 -8.969 1.00 0.00 C ATOM 1536 C ARG A 103 4.014 -11.150 -8.666 1.00 0.00 C ATOM 1537 O ARG A 103 3.669 -11.448 -7.522 1.00 0.00 O ATOM 1538 CB ARG A 103 6.193 -9.927 -8.550 1.00 0.00 C ATOM 1539 CG ARG A 103 7.126 -9.088 -9.408 1.00 0.00 C ATOM 1540 CD ARG A 103 8.565 -9.189 -8.929 1.00 0.00 C ATOM 1541 NE ARG A 103 9.078 -10.553 -9.020 1.00 0.00 N ATOM 1542 CZ ARG A 103 10.282 -10.916 -8.592 1.00 0.00 C ATOM 1543 NH1 ARG A 103 11.092 -10.021 -8.044 1.00 0.00 N ATOM 1544 NH2 ARG A 103 10.677 -12.177 -8.710 1.00 0.00 N ATOM 0 H ARG A 103 4.421 -8.544 -7.346 1.00 0.00 H new ATOM 0 HA ARG A 103 4.672 -9.653 -10.042 1.00 0.00 H new ATOM 0 HB2 ARG A 103 6.286 -9.610 -7.511 1.00 0.00 H new ATOM 0 HB3 ARG A 103 6.510 -10.969 -8.595 1.00 0.00 H new ATOM 0 HG2 ARG A 103 7.063 -9.417 -10.445 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.806 -8.046 -9.384 1.00 0.00 H new ATOM 0 HD2 ARG A 103 9.192 -8.525 -9.524 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.628 -8.846 -7.896 1.00 0.00 H new ATOM 0 HE ARG A 103 8.479 -11.266 -9.435 1.00 0.00 H new ATOM 0 HH11 ARG A 103 10.791 -9.051 -7.950 1.00 0.00 H new ATOM 0 HH12 ARG A 103 12.016 -10.303 -7.716 1.00 0.00 H new ATOM 0 HH21 ARG A 103 10.056 -12.869 -9.130 1.00 0.00 H new ATOM 0 HH22 ARG A 103 11.602 -12.455 -8.381 1.00 0.00 H new ATOM 1558 N PRO A 104 3.790 -11.957 -9.714 1.00 0.00 N ATOM 1559 CA PRO A 104 3.119 -13.254 -9.585 1.00 0.00 C ATOM 1560 C PRO A 104 3.976 -14.281 -8.853 1.00 0.00 C ATOM 1561 O PRO A 104 5.192 -14.328 -9.032 1.00 0.00 O ATOM 1562 CB PRO A 104 2.893 -13.683 -11.037 1.00 0.00 C ATOM 1563 CG PRO A 104 3.953 -12.976 -11.809 1.00 0.00 C ATOM 1564 CD PRO A 104 4.175 -11.666 -11.105 1.00 0.00 C ATOM 0 HA PRO A 104 2.202 -13.181 -9.000 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.976 -14.764 -11.148 1.00 0.00 H new ATOM 0 HB3 PRO A 104 1.898 -13.403 -11.382 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.871 -13.563 -11.839 1.00 0.00 H new ATOM 0 HG3 PRO A 104 3.643 -12.816 -12.842 1.00 0.00 H new ATOM 0 HD2 PRO A 104 5.214 -11.343 -11.175 1.00 0.00 H new ATOM 0 HD3 PRO A 104 3.564 -10.871 -11.533 1.00 0.00 H new ATOM 1572 N ASN A 105 3.334 -15.101 -8.028 1.00 0.00 N ATOM 1573 CA ASN A 105 4.039 -16.128 -7.269 1.00 0.00 C ATOM 1574 C ASN A 105 3.596 -17.523 -7.698 1.00 0.00 C ATOM 1575 O ASN A 105 2.713 -18.121 -7.084 1.00 0.00 O ATOM 1576 CB ASN A 105 3.794 -15.941 -5.770 1.00 0.00 C ATOM 1577 CG ASN A 105 4.530 -16.969 -4.931 1.00 0.00 C ATOM 1578 OD1 ASN A 105 5.342 -17.739 -5.445 1.00 0.00 O ATOM 1579 ND2 ASN A 105 4.248 -16.985 -3.634 1.00 0.00 N ATOM 0 H ASN A 105 2.327 -15.075 -7.868 1.00 0.00 H new ATOM 0 HA ASN A 105 5.105 -16.027 -7.472 1.00 0.00 H new ATOM 0 HB2 ASN A 105 4.111 -14.941 -5.475 1.00 0.00 H new ATOM 0 HB3 ASN A 105 2.725 -16.009 -5.568 1.00 0.00 H new ATOM 0 HD21 ASN A 105 4.711 -17.654 -3.020 1.00 0.00 H new ATOM 0 HD22 ASN A 105 3.568 -16.328 -3.252 1.00 0.00 H new ATOM 1586 N ALA A 106 4.215 -18.035 -8.756 1.00 0.00 N ATOM 1587 CA ALA A 106 3.887 -19.361 -9.266 1.00 0.00 C ATOM 1588 C ALA A 106 4.845 -20.413 -8.718 1.00 0.00 C ATOM 1589 O ALA A 106 5.938 -20.608 -9.250 1.00 0.00 O ATOM 1590 CB ALA A 106 3.912 -19.362 -10.787 1.00 0.00 C ATOM 0 H ALA A 106 4.947 -17.552 -9.277 1.00 0.00 H new ATOM 0 HA ALA A 106 2.881 -19.614 -8.930 1.00 0.00 H new ATOM 0 HB1 ALA A 106 3.665 -20.358 -11.154 1.00 0.00 H new ATOM 0 HB2 ALA A 106 3.182 -18.645 -11.163 1.00 0.00 H new ATOM 0 HB3 ALA A 106 4.907 -19.083 -11.135 1.00 0.00 H new ATOM 1596 N VAL A 107 4.429 -21.088 -7.651 1.00 0.00 N ATOM 1597 CA VAL A 107 5.250 -22.120 -7.031 1.00 0.00 C ATOM 1598 C VAL A 107 5.449 -23.303 -7.973 1.00 0.00 C ATOM 1599 O VAL A 107 4.675 -23.501 -8.910 1.00 0.00 O ATOM 1600 CB VAL A 107 4.623 -22.624 -5.718 1.00 0.00 C ATOM 1601 CG1 VAL A 107 4.608 -21.517 -4.674 1.00 0.00 C ATOM 1602 CG2 VAL A 107 3.217 -23.151 -5.968 1.00 0.00 C ATOM 0 H VAL A 107 3.527 -20.938 -7.198 1.00 0.00 H new ATOM 0 HA VAL A 107 6.216 -21.666 -6.812 1.00 0.00 H new ATOM 0 HB VAL A 107 5.232 -23.443 -5.335 1.00 0.00 H new ATOM 0 HG11 VAL A 107 4.161 -21.892 -3.753 1.00 0.00 H new ATOM 0 HG12 VAL A 107 5.629 -21.190 -4.476 1.00 0.00 H new ATOM 0 HG13 VAL A 107 4.023 -20.675 -5.045 1.00 0.00 H new ATOM 0 HG21 VAL A 107 2.788 -23.503 -5.030 1.00 0.00 H new ATOM 0 HG22 VAL A 107 2.596 -22.352 -6.374 1.00 0.00 H new ATOM 0 HG23 VAL A 107 3.259 -23.975 -6.680 1.00 0.00 H new ATOM 1612 N TYR A 108 6.491 -24.086 -7.717 1.00 0.00 N ATOM 1613 CA TYR A 108 6.794 -25.249 -8.543 1.00 0.00 C ATOM 1614 C TYR A 108 6.102 -26.497 -8.002 1.00 0.00 C ATOM 1615 O TYR A 108 6.732 -27.537 -7.813 1.00 0.00 O ATOM 1616 CB TYR A 108 8.305 -25.477 -8.606 1.00 0.00 C ATOM 1617 CG TYR A 108 9.021 -24.537 -9.549 1.00 0.00 C ATOM 1618 CD1 TYR A 108 8.653 -24.450 -10.886 1.00 0.00 C ATOM 1619 CD2 TYR A 108 10.065 -23.735 -9.103 1.00 0.00 C ATOM 1620 CE1 TYR A 108 9.305 -23.593 -11.752 1.00 0.00 C ATOM 1621 CE2 TYR A 108 10.721 -22.874 -9.961 1.00 0.00 C ATOM 1622 CZ TYR A 108 10.337 -22.807 -11.285 1.00 0.00 C ATOM 1623 OH TYR A 108 10.989 -21.951 -12.143 1.00 0.00 O ATOM 0 H TYR A 108 7.140 -23.937 -6.944 1.00 0.00 H new ATOM 0 HA TYR A 108 6.421 -25.055 -9.549 1.00 0.00 H new ATOM 0 HB2 TYR A 108 8.723 -25.363 -7.606 1.00 0.00 H new ATOM 0 HB3 TYR A 108 8.496 -26.504 -8.916 1.00 0.00 H new ATOM 0 HD1 TYR A 108 7.844 -25.063 -11.255 1.00 0.00 H new ATOM 0 HD2 TYR A 108 10.368 -23.786 -8.068 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.008 -23.539 -12.789 1.00 0.00 H new ATOM 0 HE2 TYR A 108 11.530 -22.257 -9.598 1.00 0.00 H new ATOM 0 HH TYR A 108 11.689 -21.469 -11.655 1.00 0.00 H new ATOM 1633 N ASP A 109 4.801 -26.384 -7.756 1.00 0.00 N ATOM 1634 CA ASP A 109 4.022 -27.502 -7.238 1.00 0.00 C ATOM 1635 C ASP A 109 2.711 -27.652 -8.005 1.00 0.00 C ATOM 1636 O ASP A 109 2.199 -26.687 -8.574 1.00 0.00 O ATOM 1637 CB ASP A 109 3.736 -27.306 -5.749 1.00 0.00 C ATOM 1638 CG ASP A 109 5.000 -27.302 -4.912 1.00 0.00 C ATOM 1639 OD1 ASP A 109 5.877 -28.156 -5.159 1.00 0.00 O ATOM 1640 OD2 ASP A 109 5.113 -26.445 -4.010 1.00 0.00 O ATOM 0 H ASP A 109 4.264 -25.530 -7.907 1.00 0.00 H new ATOM 0 HA ASP A 109 4.607 -28.412 -7.371 1.00 0.00 H new ATOM 0 HB2 ASP A 109 3.205 -26.365 -5.605 1.00 0.00 H new ATOM 0 HB3 ASP A 109 3.076 -28.101 -5.401 1.00 0.00 H new ATOM 1645 N VAL A 110 2.174 -28.867 -8.017 1.00 0.00 N ATOM 1646 CA VAL A 110 0.923 -29.144 -8.714 1.00 0.00 C ATOM 1647 C VAL A 110 -0.278 -28.746 -7.864 1.00 0.00 C ATOM 1648 O VAL A 110 -0.266 -28.896 -6.643 1.00 0.00 O ATOM 1649 CB VAL A 110 0.805 -30.634 -9.084 1.00 0.00 C ATOM 1650 CG1 VAL A 110 -0.518 -30.907 -9.784 1.00 0.00 C ATOM 1651 CG2 VAL A 110 1.976 -31.061 -9.956 1.00 0.00 C ATOM 0 H VAL A 110 2.585 -29.676 -7.552 1.00 0.00 H new ATOM 0 HA VAL A 110 0.931 -28.550 -9.628 1.00 0.00 H new ATOM 0 HB VAL A 110 0.832 -31.221 -8.166 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -0.584 -31.965 -10.038 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.342 -30.641 -9.122 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.578 -30.311 -10.695 1.00 0.00 H new ATOM 0 HG21 VAL A 110 1.876 -32.117 -10.208 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.983 -30.469 -10.871 1.00 0.00 H new ATOM 0 HG23 VAL A 110 2.909 -30.904 -9.415 1.00 0.00 H new ATOM 1661 N VAL A 111 -1.317 -28.237 -8.520 1.00 0.00 N ATOM 1662 CA VAL A 111 -2.529 -27.818 -7.826 1.00 0.00 C ATOM 1663 C VAL A 111 -3.744 -28.589 -8.328 1.00 0.00 C ATOM 1664 O VAL A 111 -4.204 -28.379 -9.450 1.00 0.00 O ATOM 1665 CB VAL A 111 -2.783 -26.309 -8.002 1.00 0.00 C ATOM 1666 CG1 VAL A 111 -4.089 -25.906 -7.333 1.00 0.00 C ATOM 1667 CG2 VAL A 111 -1.619 -25.504 -7.444 1.00 0.00 C ATOM 0 H VAL A 111 -1.343 -28.105 -9.531 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.378 -28.032 -6.768 1.00 0.00 H new ATOM 0 HB VAL A 111 -2.866 -26.094 -9.067 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -4.252 -24.837 -7.468 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -4.914 -26.458 -7.783 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.038 -26.134 -6.268 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.816 -24.440 -7.577 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.502 -25.722 -6.382 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.704 -25.773 -7.972 1.00 0.00 H new ATOM 1677 N GLU A 112 -4.260 -29.481 -7.488 1.00 0.00 N ATOM 1678 CA GLU A 112 -5.423 -30.284 -7.848 1.00 0.00 C ATOM 1679 C GLU A 112 -6.635 -29.895 -7.005 1.00 0.00 C ATOM 1680 O GLU A 112 -6.623 -30.032 -5.783 1.00 0.00 O ATOM 1681 CB GLU A 112 -5.119 -31.772 -7.666 1.00 0.00 C ATOM 1682 CG GLU A 112 -6.177 -32.687 -8.261 1.00 0.00 C ATOM 1683 CD GLU A 112 -7.381 -32.852 -7.355 1.00 0.00 C ATOM 1684 OE1 GLU A 112 -7.296 -33.643 -6.393 1.00 0.00 O ATOM 1685 OE2 GLU A 112 -8.409 -32.189 -7.609 1.00 0.00 O ATOM 0 H GLU A 112 -3.892 -29.666 -6.555 1.00 0.00 H new ATOM 0 HA GLU A 112 -5.654 -30.093 -8.896 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -4.157 -31.996 -8.126 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -5.022 -31.987 -6.602 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -6.502 -32.285 -9.221 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -5.738 -33.665 -8.457 1.00 0.00 H new ATOM 1692 N GLU A 113 -7.678 -29.408 -7.669 1.00 0.00 N ATOM 1693 CA GLU A 113 -8.897 -28.997 -6.982 1.00 0.00 C ATOM 1694 C GLU A 113 -10.012 -28.701 -7.980 1.00 0.00 C ATOM 1695 O GLU A 113 -9.983 -27.687 -8.677 1.00 0.00 O ATOM 1696 CB GLU A 113 -8.630 -27.763 -6.118 1.00 0.00 C ATOM 1697 CG GLU A 113 -9.758 -27.440 -5.153 1.00 0.00 C ATOM 1698 CD GLU A 113 -10.838 -26.583 -5.784 1.00 0.00 C ATOM 1699 OE1 GLU A 113 -10.491 -25.670 -6.562 1.00 0.00 O ATOM 1700 OE2 GLU A 113 -12.030 -26.824 -5.500 1.00 0.00 O ATOM 0 H GLU A 113 -7.704 -29.288 -8.682 1.00 0.00 H new ATOM 0 HA GLU A 113 -9.216 -29.819 -6.341 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -7.712 -27.918 -5.551 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -8.462 -26.904 -6.768 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -10.200 -28.369 -4.793 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.351 -26.923 -4.284 1.00 0.00 H new ATOM 1707 N SER A 114 -10.994 -29.595 -8.044 1.00 0.00 N ATOM 1708 CA SER A 114 -12.117 -29.433 -8.960 1.00 0.00 C ATOM 1709 C SER A 114 -13.379 -29.028 -8.205 1.00 0.00 C ATOM 1710 O SER A 114 -13.537 -29.340 -7.026 1.00 0.00 O ATOM 1711 CB SER A 114 -12.364 -30.731 -9.732 1.00 0.00 C ATOM 1712 OG SER A 114 -12.731 -31.783 -8.856 1.00 0.00 O ATOM 0 H SER A 114 -11.034 -30.439 -7.472 1.00 0.00 H new ATOM 0 HA SER A 114 -11.867 -28.641 -9.666 1.00 0.00 H new ATOM 0 HB2 SER A 114 -13.152 -30.575 -10.469 1.00 0.00 H new ATOM 0 HB3 SER A 114 -11.464 -31.008 -10.281 1.00 0.00 H new ATOM 0 HG SER A 114 -12.885 -32.601 -9.373 1.00 0.00 H new ATOM 1718 N GLY A 115 -14.276 -28.331 -8.896 1.00 0.00 N ATOM 1719 CA GLY A 115 -15.514 -27.894 -8.276 1.00 0.00 C ATOM 1720 C GLY A 115 -16.546 -27.451 -9.293 1.00 0.00 C ATOM 1721 O GLY A 115 -16.748 -26.259 -9.526 1.00 0.00 O ATOM 0 H GLY A 115 -14.168 -28.061 -9.874 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -15.924 -28.707 -7.677 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -15.304 -27.071 -7.593 1.00 0.00 H new ATOM 1725 N PRO A 116 -17.221 -28.426 -9.921 1.00 0.00 N ATOM 1726 CA PRO A 116 -18.249 -28.154 -10.930 1.00 0.00 C ATOM 1727 C PRO A 116 -19.506 -27.539 -10.326 1.00 0.00 C ATOM 1728 O PRO A 116 -20.001 -28.000 -9.297 1.00 0.00 O ATOM 1729 CB PRO A 116 -18.554 -29.538 -11.507 1.00 0.00 C ATOM 1730 CG PRO A 116 -18.193 -30.490 -10.420 1.00 0.00 C ATOM 1731 CD PRO A 116 -17.032 -29.868 -9.694 1.00 0.00 C ATOM 0 HA PRO A 116 -17.910 -27.433 -11.673 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -19.605 -29.630 -11.781 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -17.972 -29.728 -12.409 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -19.034 -30.650 -9.746 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -17.922 -31.464 -10.828 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -17.045 -30.113 -8.632 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -16.078 -30.215 -10.090 1.00 0.00 H new ATOM 1739 N SER A 117 -20.019 -26.497 -10.971 1.00 0.00 N ATOM 1740 CA SER A 117 -21.218 -25.817 -10.495 1.00 0.00 C ATOM 1741 C SER A 117 -22.242 -26.822 -9.976 1.00 0.00 C ATOM 1742 O SER A 117 -22.880 -27.532 -10.753 1.00 0.00 O ATOM 1743 CB SER A 117 -21.834 -24.977 -11.616 1.00 0.00 C ATOM 1744 OG SER A 117 -22.073 -25.763 -12.770 1.00 0.00 O ATOM 0 H SER A 117 -19.623 -26.105 -11.825 1.00 0.00 H new ATOM 0 HA SER A 117 -20.931 -25.159 -9.674 1.00 0.00 H new ATOM 0 HB2 SER A 117 -22.770 -24.536 -11.272 1.00 0.00 H new ATOM 0 HB3 SER A 117 -21.166 -24.152 -11.866 1.00 0.00 H new ATOM 0 HG SER A 117 -22.472 -26.618 -12.506 1.00 0.00 H new ATOM 1750 N SER A 118 -22.394 -26.874 -8.656 1.00 0.00 N ATOM 1751 CA SER A 118 -23.338 -27.794 -8.032 1.00 0.00 C ATOM 1752 C SER A 118 -24.595 -27.944 -8.883 1.00 0.00 C ATOM 1753 O SER A 118 -25.087 -26.975 -9.460 1.00 0.00 O ATOM 1754 CB SER A 118 -23.712 -27.302 -6.632 1.00 0.00 C ATOM 1755 OG SER A 118 -22.626 -27.450 -5.733 1.00 0.00 O ATOM 0 H SER A 118 -21.876 -26.291 -7.999 1.00 0.00 H new ATOM 0 HA SER A 118 -22.857 -28.769 -7.951 1.00 0.00 H new ATOM 0 HB2 SER A 118 -24.010 -26.254 -6.679 1.00 0.00 H new ATOM 0 HB3 SER A 118 -24.572 -27.862 -6.264 1.00 0.00 H new ATOM 0 HG SER A 118 -22.889 -27.127 -4.846 1.00 0.00 H new ATOM 1761 N GLY A 119 -25.111 -29.167 -8.956 1.00 0.00 N ATOM 1762 CA GLY A 119 -26.306 -29.423 -9.738 1.00 0.00 C ATOM 1763 C GLY A 119 -27.465 -29.901 -8.887 1.00 0.00 C ATOM 1764 O GLY A 119 -27.272 -30.341 -7.753 1.00 0.00 O ATOM 0 H GLY A 119 -24.722 -29.985 -8.487 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -26.596 -28.512 -10.262 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -26.085 -30.172 -10.499 1.00 0.00 H new TER 1768 GLY A 119