USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 934 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 90 THR OG1 : rot -78:sc= 0.412 USER MOD Set 1.2: A 91 ASN : amide:sc= -3.7! C(o=-3.3!,f=-1.4!) USER MOD Set 2.1: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 74 GLN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0473 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0.0127 X(o=0.013,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 39:sc= -0.071 USER MOD Single : A 40 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00124) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 HIS : no HD1:sc= -0.253 X(o=-0.25,f=0.017) USER MOD Single : A 47 SER OG : rot 43:sc= 0.92 USER MOD Single : A 48 HIS : no HE2:sc= -9.52! C(o=-9.5!,f=-11!) USER MOD Single : A 54 HIS : no HD1:sc= -0.251 X(o=-0.25,f=-0.72) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -1.33 K(o=-1.3,f=-3.1!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -47:sc= 0.375 USER MOD Single : A 64 LYS NZ :NH3+ -140:sc= -0.026 (180deg=-1.2) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.0631 K(o=-0.063,f=-5!) USER MOD Single : A 69 ASN : amide:sc=0.000432 K(o=0.00043,f=-1.1) USER MOD Single : A 75 HIS : no HE2:sc= -0.274 X(o=-0.27,f=-0.33) USER MOD Single : A 78 LYS NZ :NH3+ -164:sc= -0.0333 (180deg=-0.253) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.0058) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 89 SER OG : rot -166:sc= 0.387 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot -2:sc= 0.948 USER MOD Single : A 108 GLN : amide:sc= -0.264 X(o=-0.26,f=-0.18) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -130:sc= -0.128 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.426 23.634 8.205 1.00 0.00 N ATOM 2 CA GLY A 1 10.072 23.511 7.695 1.00 0.00 C ATOM 3 C GLY A 1 9.876 22.257 6.867 1.00 0.00 C ATOM 4 O GLY A 1 10.831 21.721 6.304 1.00 0.00 O ATOM 0 H1 GLY A 1 11.415 23.557 9.242 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.017 22.876 7.808 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.818 24.558 7.931 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.372 23.504 8.530 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.835 24.384 7.088 1.00 0.00 H new ATOM 8 N SER A 2 8.635 21.786 6.793 1.00 0.00 N ATOM 9 CA SER A 2 8.318 20.583 6.032 1.00 0.00 C ATOM 10 C SER A 2 8.362 20.862 4.533 1.00 0.00 C ATOM 11 O SER A 2 7.411 21.397 3.962 1.00 0.00 O ATOM 12 CB SER A 2 6.936 20.056 6.424 1.00 0.00 C ATOM 13 OG SER A 2 6.850 18.656 6.226 1.00 0.00 O ATOM 0 H SER A 2 7.833 22.219 7.251 1.00 0.00 H new ATOM 0 HA SER A 2 9.067 19.826 6.265 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.736 20.292 7.469 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.170 20.558 5.832 1.00 0.00 H new ATOM 0 HG SER A 2 5.958 18.343 6.485 1.00 0.00 H new ATOM 19 N SER A 3 9.472 20.495 3.901 1.00 0.00 N ATOM 20 CA SER A 3 9.643 20.708 2.469 1.00 0.00 C ATOM 21 C SER A 3 10.911 20.025 1.966 1.00 0.00 C ATOM 22 O SER A 3 11.950 20.057 2.624 1.00 0.00 O ATOM 23 CB SER A 3 9.698 22.205 2.158 1.00 0.00 C ATOM 24 OG SER A 3 9.697 22.436 0.760 1.00 0.00 O ATOM 0 H SER A 3 10.267 20.048 4.359 1.00 0.00 H new ATOM 0 HA SER A 3 8.787 20.269 1.956 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.843 22.706 2.613 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.595 22.639 2.601 1.00 0.00 H new ATOM 0 HG SER A 3 9.731 23.400 0.588 1.00 0.00 H new ATOM 30 N GLY A 4 10.817 19.408 0.792 1.00 0.00 N ATOM 31 CA GLY A 4 11.963 18.725 0.219 1.00 0.00 C ATOM 32 C GLY A 4 11.794 18.454 -1.263 1.00 0.00 C ATOM 33 O GLY A 4 10.681 18.228 -1.737 1.00 0.00 O ATOM 0 H GLY A 4 9.968 19.369 0.228 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.857 19.328 0.375 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.119 17.782 0.742 1.00 0.00 H new ATOM 37 N SER A 5 12.902 18.477 -1.997 1.00 0.00 N ATOM 38 CA SER A 5 12.871 18.237 -3.435 1.00 0.00 C ATOM 39 C SER A 5 12.273 16.868 -3.744 1.00 0.00 C ATOM 40 O SER A 5 12.522 15.895 -3.034 1.00 0.00 O ATOM 41 CB SER A 5 14.282 18.333 -4.020 1.00 0.00 C ATOM 42 OG SER A 5 15.118 17.311 -3.505 1.00 0.00 O ATOM 0 H SER A 5 13.832 18.659 -1.620 1.00 0.00 H new ATOM 0 HA SER A 5 12.243 19.001 -3.893 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.235 18.256 -5.106 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.710 19.308 -3.788 1.00 0.00 H new ATOM 0 HG SER A 5 16.013 17.393 -3.895 1.00 0.00 H new ATOM 48 N SER A 6 11.481 16.803 -4.810 1.00 0.00 N ATOM 49 CA SER A 6 10.843 15.555 -5.213 1.00 0.00 C ATOM 50 C SER A 6 11.882 14.461 -5.437 1.00 0.00 C ATOM 51 O SER A 6 11.738 13.342 -4.946 1.00 0.00 O ATOM 52 CB SER A 6 10.024 15.765 -6.488 1.00 0.00 C ATOM 53 OG SER A 6 9.389 14.564 -6.890 1.00 0.00 O ATOM 0 H SER A 6 11.266 17.600 -5.410 1.00 0.00 H new ATOM 0 HA SER A 6 10.177 15.240 -4.409 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.274 16.538 -6.319 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.674 16.121 -7.287 1.00 0.00 H new ATOM 0 HG SER A 6 8.871 14.725 -7.706 1.00 0.00 H new ATOM 59 N GLY A 7 12.931 14.793 -6.183 1.00 0.00 N ATOM 60 CA GLY A 7 13.980 13.829 -6.460 1.00 0.00 C ATOM 61 C GLY A 7 13.486 12.656 -7.283 1.00 0.00 C ATOM 62 O GLY A 7 13.431 11.527 -6.795 1.00 0.00 O ATOM 0 H GLY A 7 13.073 15.713 -6.601 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.794 14.324 -6.990 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.390 13.462 -5.519 1.00 0.00 H new ATOM 66 N GLN A 8 13.125 12.922 -8.534 1.00 0.00 N ATOM 67 CA GLN A 8 12.631 11.879 -9.425 1.00 0.00 C ATOM 68 C GLN A 8 13.757 10.936 -9.836 1.00 0.00 C ATOM 69 O GLN A 8 14.665 11.323 -10.572 1.00 0.00 O ATOM 70 CB GLN A 8 11.991 12.501 -10.667 1.00 0.00 C ATOM 71 CG GLN A 8 10.569 12.988 -10.440 1.00 0.00 C ATOM 72 CD GLN A 8 9.556 11.862 -10.463 1.00 0.00 C ATOM 73 OE1 GLN A 8 9.356 11.211 -11.489 1.00 0.00 O ATOM 74 NE2 GLN A 8 8.909 11.624 -9.328 1.00 0.00 N ATOM 0 H GLN A 8 13.165 13.851 -8.953 1.00 0.00 H new ATOM 0 HA GLN A 8 11.878 11.303 -8.887 1.00 0.00 H new ATOM 0 HB2 GLN A 8 12.604 13.338 -11.001 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.990 11.766 -11.472 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.514 13.502 -9.480 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.312 13.718 -11.207 1.00 0.00 H new ATOM 0 HE21 GLN A 8 9.106 12.188 -8.501 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.215 10.877 -9.283 1.00 0.00 H new ATOM 83 N GLU A 9 13.691 9.699 -9.355 1.00 0.00 N ATOM 84 CA GLU A 9 14.707 8.702 -9.673 1.00 0.00 C ATOM 85 C GLU A 9 14.442 8.070 -11.036 1.00 0.00 C ATOM 86 O GLU A 9 15.325 8.020 -11.892 1.00 0.00 O ATOM 87 CB GLU A 9 14.743 7.617 -8.594 1.00 0.00 C ATOM 88 CG GLU A 9 15.181 8.128 -7.232 1.00 0.00 C ATOM 89 CD GLU A 9 15.114 7.058 -6.159 1.00 0.00 C ATOM 90 OE1 GLU A 9 14.027 6.473 -5.971 1.00 0.00 O ATOM 91 OE2 GLU A 9 16.149 6.807 -5.507 1.00 0.00 O ATOM 0 H GLU A 9 12.946 9.363 -8.745 1.00 0.00 H new ATOM 0 HA GLU A 9 15.674 9.204 -9.707 1.00 0.00 H new ATOM 0 HB2 GLU A 9 13.752 7.172 -8.504 1.00 0.00 H new ATOM 0 HB3 GLU A 9 15.421 6.824 -8.910 1.00 0.00 H new ATOM 0 HG2 GLU A 9 16.201 8.505 -7.300 1.00 0.00 H new ATOM 0 HG3 GLU A 9 14.549 8.968 -6.943 1.00 0.00 H new ATOM 98 N SER A 10 13.218 7.589 -11.231 1.00 0.00 N ATOM 99 CA SER A 10 12.836 6.956 -12.488 1.00 0.00 C ATOM 100 C SER A 10 13.773 5.799 -12.820 1.00 0.00 C ATOM 101 O SER A 10 14.362 5.751 -13.901 1.00 0.00 O ATOM 102 CB SER A 10 12.850 7.981 -13.624 1.00 0.00 C ATOM 103 OG SER A 10 11.614 8.667 -13.707 1.00 0.00 O ATOM 0 H SER A 10 12.474 7.626 -10.534 1.00 0.00 H new ATOM 0 HA SER A 10 11.826 6.562 -12.376 1.00 0.00 H new ATOM 0 HB2 SER A 10 13.656 8.696 -13.463 1.00 0.00 H new ATOM 0 HB3 SER A 10 13.055 7.478 -14.569 1.00 0.00 H new ATOM 0 HG SER A 10 11.649 9.317 -14.439 1.00 0.00 H new ATOM 109 N VAL A 11 13.907 4.866 -11.882 1.00 0.00 N ATOM 110 CA VAL A 11 14.771 3.707 -12.074 1.00 0.00 C ATOM 111 C VAL A 11 13.953 2.450 -12.347 1.00 0.00 C ATOM 112 O VAL A 11 13.190 1.998 -11.493 1.00 0.00 O ATOM 113 CB VAL A 11 15.668 3.466 -10.845 1.00 0.00 C ATOM 114 CG1 VAL A 11 16.341 2.105 -10.934 1.00 0.00 C ATOM 115 CG2 VAL A 11 16.702 4.574 -10.716 1.00 0.00 C ATOM 0 H VAL A 11 13.428 4.890 -10.982 1.00 0.00 H new ATOM 0 HA VAL A 11 15.400 3.921 -12.938 1.00 0.00 H new ATOM 0 HB VAL A 11 15.043 3.478 -9.952 1.00 0.00 H new ATOM 0 HG11 VAL A 11 16.971 1.952 -10.057 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.581 1.325 -10.975 1.00 0.00 H new ATOM 0 HG13 VAL A 11 16.955 2.061 -11.834 1.00 0.00 H new ATOM 0 HG21 VAL A 11 17.327 4.388 -9.843 1.00 0.00 H new ATOM 0 HG22 VAL A 11 17.325 4.596 -11.610 1.00 0.00 H new ATOM 0 HG23 VAL A 11 16.196 5.533 -10.602 1.00 0.00 H new ATOM 125 N GLU A 12 14.117 1.891 -13.541 1.00 0.00 N ATOM 126 CA GLU A 12 13.392 0.686 -13.926 1.00 0.00 C ATOM 127 C GLU A 12 14.261 -0.555 -13.738 1.00 0.00 C ATOM 128 O GLU A 12 14.962 -0.980 -14.657 1.00 0.00 O ATOM 129 CB GLU A 12 12.931 0.783 -15.382 1.00 0.00 C ATOM 130 CG GLU A 12 14.073 0.933 -16.373 1.00 0.00 C ATOM 131 CD GLU A 12 13.647 1.624 -17.654 1.00 0.00 C ATOM 132 OE1 GLU A 12 13.499 2.863 -17.638 1.00 0.00 O ATOM 133 OE2 GLU A 12 13.463 0.924 -18.672 1.00 0.00 O ATOM 0 H GLU A 12 14.745 2.253 -14.258 1.00 0.00 H new ATOM 0 HA GLU A 12 12.518 0.598 -13.281 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.358 -0.110 -15.633 1.00 0.00 H new ATOM 0 HB3 GLU A 12 12.257 1.634 -15.485 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.879 1.501 -15.909 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.474 -0.052 -16.612 1.00 0.00 H new ATOM 140 N ASP A 13 14.210 -1.130 -12.542 1.00 0.00 N ATOM 141 CA ASP A 13 14.992 -2.321 -12.232 1.00 0.00 C ATOM 142 C ASP A 13 14.319 -3.144 -11.138 1.00 0.00 C ATOM 143 O ASP A 13 14.167 -2.683 -10.006 1.00 0.00 O ATOM 144 CB ASP A 13 16.406 -1.932 -11.798 1.00 0.00 C ATOM 145 CG ASP A 13 17.418 -3.027 -12.072 1.00 0.00 C ATOM 146 OD1 ASP A 13 17.447 -3.536 -13.212 1.00 0.00 O ATOM 147 OD2 ASP A 13 18.180 -3.375 -11.146 1.00 0.00 O ATOM 0 H ASP A 13 13.635 -0.791 -11.771 1.00 0.00 H new ATOM 0 HA ASP A 13 15.053 -2.930 -13.134 1.00 0.00 H new ATOM 0 HB2 ASP A 13 16.707 -1.024 -12.321 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.405 -1.700 -10.733 1.00 0.00 H new ATOM 152 N SER A 14 13.916 -4.362 -11.483 1.00 0.00 N ATOM 153 CA SER A 14 13.254 -5.247 -10.532 1.00 0.00 C ATOM 154 C SER A 14 11.920 -4.660 -10.081 1.00 0.00 C ATOM 155 O SER A 14 11.585 -4.689 -8.896 1.00 0.00 O ATOM 156 CB SER A 14 14.154 -5.490 -9.318 1.00 0.00 C ATOM 157 OG SER A 14 15.396 -6.051 -9.707 1.00 0.00 O ATOM 0 H SER A 14 14.036 -4.759 -12.415 1.00 0.00 H new ATOM 0 HA SER A 14 13.063 -6.197 -11.030 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.325 -4.550 -8.794 1.00 0.00 H new ATOM 0 HB3 SER A 14 13.653 -6.159 -8.618 1.00 0.00 H new ATOM 0 HG SER A 14 15.953 -6.195 -8.914 1.00 0.00 H new ATOM 163 N LEU A 15 11.163 -4.128 -11.034 1.00 0.00 N ATOM 164 CA LEU A 15 9.865 -3.533 -10.737 1.00 0.00 C ATOM 165 C LEU A 15 8.760 -4.583 -10.791 1.00 0.00 C ATOM 166 O LEU A 15 8.798 -5.496 -11.615 1.00 0.00 O ATOM 167 CB LEU A 15 9.561 -2.405 -11.724 1.00 0.00 C ATOM 168 CG LEU A 15 10.044 -1.011 -11.319 1.00 0.00 C ATOM 169 CD1 LEU A 15 9.931 -0.047 -12.490 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.252 -0.498 -10.125 1.00 0.00 C ATOM 0 H LEU A 15 11.426 -4.096 -12.019 1.00 0.00 H new ATOM 0 HA LEU A 15 9.903 -3.123 -9.728 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.010 -2.659 -12.684 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.483 -2.364 -11.877 1.00 0.00 H new ATOM 0 HG LEU A 15 11.093 -1.080 -11.031 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.279 0.940 -12.184 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.542 -0.407 -13.318 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.891 0.018 -12.809 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.609 0.495 -9.851 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.195 -0.444 -10.386 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.384 -1.177 -9.282 1.00 0.00 H new ATOM 182 N ALA A 16 7.776 -4.445 -9.909 1.00 0.00 N ATOM 183 CA ALA A 16 6.658 -5.379 -9.859 1.00 0.00 C ATOM 184 C ALA A 16 5.326 -4.638 -9.789 1.00 0.00 C ATOM 185 O ALA A 16 5.243 -3.540 -9.239 1.00 0.00 O ATOM 186 CB ALA A 16 6.805 -6.316 -8.670 1.00 0.00 C ATOM 0 H ALA A 16 7.730 -3.695 -9.219 1.00 0.00 H new ATOM 0 HA ALA A 16 6.669 -5.969 -10.776 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.963 -7.008 -8.646 1.00 0.00 H new ATOM 0 HB2 ALA A 16 7.734 -6.878 -8.763 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.823 -5.734 -7.748 1.00 0.00 H new ATOM 192 N THR A 17 4.286 -5.246 -10.351 1.00 0.00 N ATOM 193 CA THR A 17 2.959 -4.643 -10.354 1.00 0.00 C ATOM 194 C THR A 17 2.266 -4.832 -9.010 1.00 0.00 C ATOM 195 O THR A 17 1.693 -5.888 -8.738 1.00 0.00 O ATOM 196 CB THR A 17 2.073 -5.240 -11.464 1.00 0.00 C ATOM 197 OG1 THR A 17 2.740 -5.144 -12.728 1.00 0.00 O ATOM 198 CG2 THR A 17 0.735 -4.520 -11.535 1.00 0.00 C ATOM 0 H THR A 17 4.337 -6.156 -10.810 1.00 0.00 H new ATOM 0 HA THR A 17 3.096 -3.578 -10.542 1.00 0.00 H new ATOM 0 HB THR A 17 1.891 -6.289 -11.228 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.171 -5.527 -13.428 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.127 -4.959 -12.326 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.217 -4.620 -10.581 1.00 0.00 H new ATOM 0 HG23 THR A 17 0.901 -3.464 -11.749 1.00 0.00 H new ATOM 206 N VAL A 18 2.322 -3.803 -8.171 1.00 0.00 N ATOM 207 CA VAL A 18 1.697 -3.856 -6.854 1.00 0.00 C ATOM 208 C VAL A 18 0.328 -3.185 -6.868 1.00 0.00 C ATOM 209 O VAL A 18 0.219 -1.976 -7.072 1.00 0.00 O ATOM 210 CB VAL A 18 2.578 -3.178 -5.788 1.00 0.00 C ATOM 211 CG1 VAL A 18 1.786 -2.943 -4.511 1.00 0.00 C ATOM 212 CG2 VAL A 18 3.817 -4.015 -5.510 1.00 0.00 C ATOM 0 H VAL A 18 2.793 -2.923 -8.379 1.00 0.00 H new ATOM 0 HA VAL A 18 1.579 -4.910 -6.601 1.00 0.00 H new ATOM 0 HB VAL A 18 2.900 -2.210 -6.171 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.425 -2.463 -3.770 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.933 -2.300 -4.725 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.432 -3.898 -4.122 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.428 -3.521 -4.755 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.518 -4.999 -5.148 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.394 -4.126 -6.428 1.00 0.00 H new ATOM 222 N LYS A 19 -0.715 -3.978 -6.648 1.00 0.00 N ATOM 223 CA LYS A 19 -2.079 -3.462 -6.633 1.00 0.00 C ATOM 224 C LYS A 19 -2.464 -2.983 -5.237 1.00 0.00 C ATOM 225 O LYS A 19 -2.153 -3.633 -4.239 1.00 0.00 O ATOM 226 CB LYS A 19 -3.059 -4.540 -7.102 1.00 0.00 C ATOM 227 CG LYS A 19 -2.855 -4.960 -8.547 1.00 0.00 C ATOM 228 CD LYS A 19 -3.943 -5.915 -9.009 1.00 0.00 C ATOM 229 CE LYS A 19 -3.790 -7.285 -8.368 1.00 0.00 C ATOM 230 NZ LYS A 19 -5.064 -8.056 -8.396 1.00 0.00 N ATOM 0 H LYS A 19 -0.642 -4.981 -6.478 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.128 -2.613 -7.315 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.958 -5.415 -6.460 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.077 -4.171 -6.980 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.849 -4.077 -9.186 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.881 -5.437 -8.654 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -4.921 -5.503 -8.760 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -3.906 -6.013 -10.094 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -3.015 -7.846 -8.890 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -3.459 -7.168 -7.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -4.918 -8.984 -7.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -5.798 -7.533 -7.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.367 -8.190 -9.382 1.00 0.00 H new ATOM 244 N VAL A 20 -3.143 -1.842 -5.174 1.00 0.00 N ATOM 245 CA VAL A 20 -3.573 -1.278 -3.900 1.00 0.00 C ATOM 246 C VAL A 20 -5.087 -1.105 -3.859 1.00 0.00 C ATOM 247 O VAL A 20 -5.685 -0.550 -4.781 1.00 0.00 O ATOM 248 CB VAL A 20 -2.905 0.085 -3.636 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.354 0.650 -2.297 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.390 -0.047 -3.688 1.00 0.00 C ATOM 0 H VAL A 20 -3.407 -1.290 -5.990 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.269 -1.980 -3.124 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.214 0.780 -4.417 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.872 1.613 -2.128 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.436 0.782 -2.302 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.077 -0.040 -1.500 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.933 0.925 -3.499 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.060 -0.756 -2.929 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -1.089 -0.404 -4.673 1.00 0.00 H new ATOM 260 N VAL A 21 -5.703 -1.583 -2.782 1.00 0.00 N ATOM 261 CA VAL A 21 -7.148 -1.481 -2.619 1.00 0.00 C ATOM 262 C VAL A 21 -7.505 -0.771 -1.317 1.00 0.00 C ATOM 263 O VAL A 21 -7.019 -1.136 -0.246 1.00 0.00 O ATOM 264 CB VAL A 21 -7.814 -2.869 -2.633 1.00 0.00 C ATOM 265 CG1 VAL A 21 -9.318 -2.742 -2.441 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.494 -3.600 -3.929 1.00 0.00 C ATOM 0 H VAL A 21 -5.223 -2.045 -2.009 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.521 -0.899 -3.462 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.414 -3.453 -1.804 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.771 -3.733 -2.454 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.523 -2.261 -1.485 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.738 -2.140 -3.247 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.973 -4.579 -3.922 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.865 -3.021 -4.775 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.415 -3.724 -4.020 1.00 0.00 H new ATOM 276 N LEU A 22 -8.356 0.243 -1.417 1.00 0.00 N ATOM 277 CA LEU A 22 -8.780 1.004 -0.247 1.00 0.00 C ATOM 278 C LEU A 22 -9.843 0.246 0.541 1.00 0.00 C ATOM 279 O LEU A 22 -10.864 -0.165 -0.012 1.00 0.00 O ATOM 280 CB LEU A 22 -9.322 2.370 -0.672 1.00 0.00 C ATOM 281 CG LEU A 22 -8.278 3.404 -1.098 1.00 0.00 C ATOM 282 CD1 LEU A 22 -8.933 4.535 -1.875 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.539 3.946 0.116 1.00 0.00 C ATOM 0 H LEU A 22 -8.766 0.558 -2.296 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.912 1.148 0.396 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -10.016 2.222 -1.499 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.897 2.784 0.156 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.555 2.915 -1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -8.175 5.261 -2.170 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.416 4.133 -2.766 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.678 5.023 -1.248 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.800 4.680 -0.206 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.250 4.419 0.793 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.037 3.127 0.631 1.00 0.00 H new ATOM 295 N ILE A 23 -9.597 0.065 1.834 1.00 0.00 N ATOM 296 CA ILE A 23 -10.534 -0.641 2.698 1.00 0.00 C ATOM 297 C ILE A 23 -11.780 0.198 2.960 1.00 0.00 C ATOM 298 O ILE A 23 -12.905 -0.205 2.663 1.00 0.00 O ATOM 299 CB ILE A 23 -9.888 -1.014 4.045 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.253 -2.403 3.964 1.00 0.00 C ATOM 301 CG2 ILE A 23 -10.920 -0.962 5.161 1.00 0.00 C ATOM 302 CD1 ILE A 23 -10.220 -3.486 3.538 1.00 0.00 C ATOM 0 H ILE A 23 -8.756 0.398 2.306 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.817 -1.555 2.175 1.00 0.00 H new ATOM 0 HB ILE A 23 -9.105 -0.289 4.268 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.421 -2.373 3.260 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.837 -2.661 4.938 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.447 -1.228 6.106 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.330 0.046 5.231 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.724 -1.666 4.946 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.701 -4.444 3.502 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -11.040 -3.544 4.254 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.617 -3.251 2.550 1.00 0.00 H new ATOM 314 N PRO A 24 -11.577 1.397 3.527 1.00 0.00 N ATOM 315 CA PRO A 24 -12.672 2.320 3.839 1.00 0.00 C ATOM 316 C PRO A 24 -13.307 2.912 2.585 1.00 0.00 C ATOM 317 O PRO A 24 -14.445 3.379 2.615 1.00 0.00 O ATOM 318 CB PRO A 24 -11.988 3.416 4.661 1.00 0.00 C ATOM 319 CG PRO A 24 -10.563 3.381 4.228 1.00 0.00 C ATOM 320 CD PRO A 24 -10.263 1.943 3.907 1.00 0.00 C ATOM 0 HA PRO A 24 -13.488 1.822 4.362 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.436 4.391 4.470 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -12.082 3.226 5.730 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.404 4.017 3.357 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.907 3.750 5.016 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.541 1.855 3.095 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.843 1.419 4.765 1.00 0.00 H new ATOM 328 N VAL A 25 -12.563 2.889 1.484 1.00 0.00 N ATOM 329 CA VAL A 25 -13.054 3.422 0.219 1.00 0.00 C ATOM 330 C VAL A 25 -13.476 2.300 -0.723 1.00 0.00 C ATOM 331 O VAL A 25 -14.624 2.242 -1.161 1.00 0.00 O ATOM 332 CB VAL A 25 -11.987 4.288 -0.477 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.634 5.227 -1.483 1.00 0.00 C ATOM 334 CG2 VAL A 25 -11.180 5.067 0.550 1.00 0.00 C ATOM 0 H VAL A 25 -11.618 2.507 1.443 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.920 4.042 0.451 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.306 3.630 -1.017 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.865 5.831 -1.964 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -13.163 4.644 -2.237 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.339 5.880 -0.969 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.431 5.673 0.040 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.845 5.716 1.120 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.684 4.371 1.227 1.00 0.00 H new ATOM 344 N GLY A 26 -12.538 1.409 -1.032 1.00 0.00 N ATOM 345 CA GLY A 26 -12.832 0.300 -1.920 1.00 0.00 C ATOM 346 C GLY A 26 -12.279 0.512 -3.315 1.00 0.00 C ATOM 347 O GLY A 26 -12.364 -0.375 -4.164 1.00 0.00 O ATOM 0 H GLY A 26 -11.580 1.436 -0.683 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.415 -0.616 -1.502 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -13.912 0.161 -1.978 1.00 0.00 H new ATOM 351 N GLN A 27 -11.715 1.691 -3.553 1.00 0.00 N ATOM 352 CA GLN A 27 -11.148 2.018 -4.857 1.00 0.00 C ATOM 353 C GLN A 27 -9.879 1.213 -5.115 1.00 0.00 C ATOM 354 O GLN A 27 -9.216 0.765 -4.180 1.00 0.00 O ATOM 355 CB GLN A 27 -10.845 3.514 -4.944 1.00 0.00 C ATOM 356 CG GLN A 27 -10.653 4.014 -6.367 1.00 0.00 C ATOM 357 CD GLN A 27 -10.158 5.446 -6.421 1.00 0.00 C ATOM 358 OE1 GLN A 27 -10.951 6.388 -6.452 1.00 0.00 O ATOM 359 NE2 GLN A 27 -8.842 5.618 -6.431 1.00 0.00 N ATOM 0 H GLN A 27 -11.638 2.436 -2.861 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.882 1.759 -5.620 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.660 4.069 -4.480 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -9.945 3.728 -4.368 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -9.942 3.368 -6.882 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.598 3.940 -6.905 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.222 4.809 -6.404 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -8.451 6.559 -6.465 1.00 0.00 H new ATOM 368 N GLU A 28 -9.547 1.034 -6.390 1.00 0.00 N ATOM 369 CA GLU A 28 -8.357 0.282 -6.771 1.00 0.00 C ATOM 370 C GLU A 28 -7.311 1.199 -7.398 1.00 0.00 C ATOM 371 O GLU A 28 -7.636 2.062 -8.214 1.00 0.00 O ATOM 372 CB GLU A 28 -8.724 -0.835 -7.750 1.00 0.00 C ATOM 373 CG GLU A 28 -9.247 -2.091 -7.073 1.00 0.00 C ATOM 374 CD GLU A 28 -9.994 -3.001 -8.028 1.00 0.00 C ATOM 375 OE1 GLU A 28 -11.046 -2.579 -8.551 1.00 0.00 O ATOM 376 OE2 GLU A 28 -9.525 -4.137 -8.253 1.00 0.00 O ATOM 0 H GLU A 28 -10.085 1.399 -7.176 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.934 -0.160 -5.869 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.479 -0.465 -8.444 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.845 -1.091 -8.342 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.412 -2.638 -6.635 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.908 -1.809 -6.254 1.00 0.00 H new ATOM 383 N ILE A 29 -6.055 1.007 -7.009 1.00 0.00 N ATOM 384 CA ILE A 29 -4.962 1.816 -7.533 1.00 0.00 C ATOM 385 C ILE A 29 -3.775 0.944 -7.930 1.00 0.00 C ATOM 386 O ILE A 29 -3.427 -0.007 -7.231 1.00 0.00 O ATOM 387 CB ILE A 29 -4.494 2.863 -6.505 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.674 3.723 -6.048 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.396 3.733 -7.098 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.310 4.730 -4.979 1.00 0.00 C ATOM 0 H ILE A 29 -5.769 0.299 -6.333 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.344 2.330 -8.415 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.090 2.343 -5.637 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.083 4.251 -6.909 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.462 3.072 -5.669 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.076 4.468 -6.360 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.548 3.108 -7.379 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.776 4.247 -7.981 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.195 5.304 -4.704 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.929 4.207 -4.102 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.544 5.405 -5.361 1.00 0.00 H new ATOM 402 N VAL A 30 -3.154 1.278 -9.058 1.00 0.00 N ATOM 403 CA VAL A 30 -2.004 0.528 -9.548 1.00 0.00 C ATOM 404 C VAL A 30 -0.767 1.415 -9.637 1.00 0.00 C ATOM 405 O VAL A 30 -0.792 2.469 -10.273 1.00 0.00 O ATOM 406 CB VAL A 30 -2.282 -0.087 -10.932 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.024 -0.729 -11.495 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.415 -1.099 -10.847 1.00 0.00 C ATOM 0 H VAL A 30 -3.429 2.063 -9.649 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.822 -0.274 -8.833 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.587 0.711 -11.609 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.241 -1.158 -12.473 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.244 0.026 -11.595 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.684 -1.516 -10.821 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.598 -1.524 -11.834 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.141 -1.895 -10.155 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.319 -0.604 -10.491 1.00 0.00 H new ATOM 418 N ILE A 31 0.313 0.981 -8.997 1.00 0.00 N ATOM 419 CA ILE A 31 1.560 1.735 -9.006 1.00 0.00 C ATOM 420 C ILE A 31 2.766 0.806 -8.915 1.00 0.00 C ATOM 421 O ILE A 31 2.812 -0.114 -8.098 1.00 0.00 O ATOM 422 CB ILE A 31 1.616 2.744 -7.843 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.984 3.428 -7.797 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.321 2.048 -6.523 1.00 0.00 C ATOM 425 CD1 ILE A 31 3.201 4.264 -6.556 1.00 0.00 C ATOM 0 H ILE A 31 0.350 0.111 -8.466 1.00 0.00 H new ATOM 0 HA ILE A 31 1.593 2.278 -9.951 1.00 0.00 H new ATOM 0 HB ILE A 31 0.855 3.507 -8.007 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.763 2.668 -7.854 1.00 0.00 H new ATOM 0 HG13 ILE A 31 3.093 4.063 -8.676 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.364 2.774 -5.711 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.326 1.604 -6.560 1.00 0.00 H new ATOM 0 HG23 ILE A 31 2.061 1.266 -6.351 1.00 0.00 H new ATOM 0 HD11 ILE A 31 4.191 4.718 -6.592 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.444 5.047 -6.508 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.124 3.630 -5.672 1.00 0.00 H new ATOM 437 N PRO A 32 3.767 1.050 -9.773 1.00 0.00 N ATOM 438 CA PRO A 32 4.993 0.248 -9.809 1.00 0.00 C ATOM 439 C PRO A 32 5.865 0.466 -8.577 1.00 0.00 C ATOM 440 O PRO A 32 6.197 1.600 -8.233 1.00 0.00 O ATOM 441 CB PRO A 32 5.708 0.748 -11.066 1.00 0.00 C ATOM 442 CG PRO A 32 5.202 2.135 -11.264 1.00 0.00 C ATOM 443 CD PRO A 32 3.779 2.130 -10.775 1.00 0.00 C ATOM 0 HA PRO A 32 4.780 -0.821 -9.820 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.790 0.736 -10.937 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.483 0.118 -11.926 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.804 2.853 -10.707 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.253 2.423 -12.314 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.501 3.088 -10.336 1.00 0.00 H new ATOM 0 HD3 PRO A 32 3.076 1.935 -11.585 1.00 0.00 H new ATOM 451 N PHE A 33 6.233 -0.627 -7.917 1.00 0.00 N ATOM 452 CA PHE A 33 7.066 -0.554 -6.723 1.00 0.00 C ATOM 453 C PHE A 33 8.276 -1.477 -6.846 1.00 0.00 C ATOM 454 O PHE A 33 8.174 -2.586 -7.371 1.00 0.00 O ATOM 455 CB PHE A 33 6.251 -0.927 -5.483 1.00 0.00 C ATOM 456 CG PHE A 33 6.750 -0.283 -4.221 1.00 0.00 C ATOM 457 CD1 PHE A 33 6.812 1.097 -4.110 1.00 0.00 C ATOM 458 CD2 PHE A 33 7.157 -1.056 -3.146 1.00 0.00 C ATOM 459 CE1 PHE A 33 7.270 1.694 -2.951 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.615 -0.465 -1.984 1.00 0.00 C ATOM 461 CZ PHE A 33 7.673 0.911 -1.887 1.00 0.00 C ATOM 0 H PHE A 33 5.967 -1.574 -8.189 1.00 0.00 H new ATOM 0 HA PHE A 33 7.422 0.471 -6.621 1.00 0.00 H new ATOM 0 HB2 PHE A 33 5.212 -0.640 -5.641 1.00 0.00 H new ATOM 0 HB3 PHE A 33 6.267 -2.010 -5.360 1.00 0.00 H new ATOM 0 HD1 PHE A 33 6.499 1.713 -4.940 1.00 0.00 H new ATOM 0 HD2 PHE A 33 7.116 -2.133 -3.217 1.00 0.00 H new ATOM 0 HE1 PHE A 33 7.313 2.771 -2.877 1.00 0.00 H new ATOM 0 HE2 PHE A 33 7.927 -1.079 -1.152 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.033 1.374 -0.980 1.00 0.00 H new ATOM 471 N LYS A 34 9.420 -1.009 -6.360 1.00 0.00 N ATOM 472 CA LYS A 34 10.651 -1.790 -6.414 1.00 0.00 C ATOM 473 C LYS A 34 10.692 -2.819 -5.289 1.00 0.00 C ATOM 474 O LYS A 34 10.613 -2.470 -4.111 1.00 0.00 O ATOM 475 CB LYS A 34 11.869 -0.868 -6.322 1.00 0.00 C ATOM 476 CG LYS A 34 12.357 -0.368 -7.670 1.00 0.00 C ATOM 477 CD LYS A 34 11.363 0.591 -8.303 1.00 0.00 C ATOM 478 CE LYS A 34 11.611 2.024 -7.858 1.00 0.00 C ATOM 479 NZ LYS A 34 10.830 3.000 -8.668 1.00 0.00 N ATOM 0 H LYS A 34 9.521 -0.092 -5.924 1.00 0.00 H new ATOM 0 HA LYS A 34 10.675 -2.319 -7.367 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.619 -0.012 -5.695 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.681 -1.401 -5.826 1.00 0.00 H new ATOM 0 HG2 LYS A 34 13.318 0.131 -7.547 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.521 -1.215 -8.336 1.00 0.00 H new ATOM 0 HD2 LYS A 34 11.436 0.528 -9.389 1.00 0.00 H new ATOM 0 HD3 LYS A 34 10.349 0.296 -8.034 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.344 2.129 -6.806 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.674 2.251 -7.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 11.027 3.965 -8.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.103 2.918 -9.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 9.814 2.800 -8.569 1.00 0.00 H new ATOM 493 N VAL A 35 10.818 -4.090 -5.659 1.00 0.00 N ATOM 494 CA VAL A 35 10.873 -5.169 -4.681 1.00 0.00 C ATOM 495 C VAL A 35 12.033 -4.974 -3.712 1.00 0.00 C ATOM 496 O VAL A 35 12.021 -5.500 -2.599 1.00 0.00 O ATOM 497 CB VAL A 35 11.016 -6.541 -5.366 1.00 0.00 C ATOM 498 CG1 VAL A 35 9.841 -6.799 -6.297 1.00 0.00 C ATOM 499 CG2 VAL A 35 12.334 -6.623 -6.123 1.00 0.00 C ATOM 0 H VAL A 35 10.884 -4.397 -6.629 1.00 0.00 H new ATOM 0 HA VAL A 35 9.934 -5.143 -4.129 1.00 0.00 H new ATOM 0 HB VAL A 35 11.015 -7.313 -4.597 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.960 -7.773 -6.772 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.913 -6.785 -5.725 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.807 -6.024 -7.063 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.419 -7.599 -6.601 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.366 -5.843 -6.883 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.162 -6.486 -5.428 1.00 0.00 H new ATOM 509 N ASP A 36 13.035 -4.214 -4.141 1.00 0.00 N ATOM 510 CA ASP A 36 14.203 -3.947 -3.311 1.00 0.00 C ATOM 511 C ASP A 36 13.990 -2.701 -2.457 1.00 0.00 C ATOM 512 O ASP A 36 14.788 -2.399 -1.569 1.00 0.00 O ATOM 513 CB ASP A 36 15.447 -3.776 -4.184 1.00 0.00 C ATOM 514 CG ASP A 36 15.312 -2.629 -5.166 1.00 0.00 C ATOM 515 OD1 ASP A 36 14.744 -1.585 -4.783 1.00 0.00 O ATOM 516 OD2 ASP A 36 15.773 -2.775 -6.317 1.00 0.00 O ATOM 0 H ASP A 36 13.061 -3.772 -5.060 1.00 0.00 H new ATOM 0 HA ASP A 36 14.349 -4.799 -2.647 1.00 0.00 H new ATOM 0 HB2 ASP A 36 16.314 -3.604 -3.546 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.632 -4.700 -4.732 1.00 0.00 H new ATOM 521 N THR A 37 12.908 -1.980 -2.732 1.00 0.00 N ATOM 522 CA THR A 37 12.591 -0.765 -1.991 1.00 0.00 C ATOM 523 C THR A 37 11.638 -1.058 -0.838 1.00 0.00 C ATOM 524 O THR A 37 10.563 -1.625 -1.037 1.00 0.00 O ATOM 525 CB THR A 37 11.959 0.302 -2.905 1.00 0.00 C ATOM 526 OG1 THR A 37 12.926 0.769 -3.853 1.00 0.00 O ATOM 527 CG2 THR A 37 11.435 1.473 -2.088 1.00 0.00 C ATOM 0 H THR A 37 12.236 -2.216 -3.462 1.00 0.00 H new ATOM 0 HA THR A 37 13.531 -0.382 -1.594 1.00 0.00 H new ATOM 0 HB THR A 37 11.122 -0.154 -3.434 1.00 0.00 H new ATOM 0 HG1 THR A 37 13.472 0.016 -4.161 1.00 0.00 H new ATOM 0 HG21 THR A 37 10.993 2.213 -2.755 1.00 0.00 H new ATOM 0 HG22 THR A 37 10.679 1.119 -1.388 1.00 0.00 H new ATOM 0 HG23 THR A 37 12.257 1.927 -1.535 1.00 0.00 H new ATOM 535 N ILE A 38 12.038 -0.666 0.368 1.00 0.00 N ATOM 536 CA ILE A 38 11.217 -0.886 1.552 1.00 0.00 C ATOM 537 C ILE A 38 9.769 -0.478 1.302 1.00 0.00 C ATOM 538 O ILE A 38 9.462 0.182 0.309 1.00 0.00 O ATOM 539 CB ILE A 38 11.757 -0.102 2.763 1.00 0.00 C ATOM 540 CG1 ILE A 38 11.980 1.365 2.391 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.049 -0.728 3.267 1.00 0.00 C ATOM 542 CD1 ILE A 38 12.506 2.205 3.533 1.00 0.00 C ATOM 0 H ILE A 38 12.924 -0.195 0.550 1.00 0.00 H new ATOM 0 HA ILE A 38 11.258 -1.953 1.771 1.00 0.00 H new ATOM 0 HB ILE A 38 11.018 -0.146 3.563 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.682 1.418 1.559 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.039 1.790 2.042 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.418 -0.162 4.123 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.861 -1.759 3.567 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.795 -0.712 2.473 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.640 3.233 3.197 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.795 2.183 4.359 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.463 1.805 3.868 1.00 0.00 H new ATOM 554 N LEU A 39 8.884 -0.875 2.209 1.00 0.00 N ATOM 555 CA LEU A 39 7.467 -0.550 2.088 1.00 0.00 C ATOM 556 C LEU A 39 7.212 0.913 2.437 1.00 0.00 C ATOM 557 O LEU A 39 6.419 1.590 1.782 1.00 0.00 O ATOM 558 CB LEU A 39 6.636 -1.455 2.998 1.00 0.00 C ATOM 559 CG LEU A 39 6.643 -2.944 2.651 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.363 -3.783 3.889 1.00 0.00 C ATOM 561 CD2 LEU A 39 5.624 -3.243 1.561 1.00 0.00 C ATOM 0 H LEU A 39 9.122 -1.422 3.036 1.00 0.00 H new ATOM 0 HA LEU A 39 7.169 -0.715 1.052 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.997 -1.339 4.020 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.604 -1.104 2.982 1.00 0.00 H new ATOM 0 HG LEU A 39 7.633 -3.205 2.277 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.372 -4.840 3.622 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.130 -3.592 4.639 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.386 -3.519 4.294 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.643 -4.307 1.327 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.629 -2.965 1.908 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.869 -2.670 0.667 1.00 0.00 H new ATOM 573 N LYS A 40 7.891 1.396 3.472 1.00 0.00 N ATOM 574 CA LYS A 40 7.742 2.779 3.908 1.00 0.00 C ATOM 575 C LYS A 40 7.556 3.709 2.713 1.00 0.00 C ATOM 576 O LYS A 40 6.563 4.430 2.624 1.00 0.00 O ATOM 577 CB LYS A 40 8.964 3.214 4.721 1.00 0.00 C ATOM 578 CG LYS A 40 8.657 4.283 5.755 1.00 0.00 C ATOM 579 CD LYS A 40 9.905 4.697 6.516 1.00 0.00 C ATOM 580 CE LYS A 40 9.579 5.684 7.627 1.00 0.00 C ATOM 581 NZ LYS A 40 8.950 5.012 8.798 1.00 0.00 N ATOM 0 H LYS A 40 8.551 0.849 4.025 1.00 0.00 H new ATOM 0 HA LYS A 40 6.854 2.842 4.537 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.384 2.343 5.225 1.00 0.00 H new ATOM 0 HB3 LYS A 40 9.729 3.588 4.040 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.225 5.154 5.262 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.910 3.909 6.455 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.383 3.814 6.941 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.620 5.146 5.827 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.492 6.188 7.944 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.907 6.452 7.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.758 5.715 9.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 8.057 4.566 8.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 9.594 4.285 9.168 1.00 0.00 H new ATOM 595 N TYR A 41 8.518 3.686 1.796 1.00 0.00 N ATOM 596 CA TYR A 41 8.460 4.527 0.607 1.00 0.00 C ATOM 597 C TYR A 41 7.026 4.661 0.103 1.00 0.00 C ATOM 598 O TYR A 41 6.489 5.766 0.010 1.00 0.00 O ATOM 599 CB TYR A 41 9.348 3.949 -0.496 1.00 0.00 C ATOM 600 CG TYR A 41 10.779 4.434 -0.438 1.00 0.00 C ATOM 601 CD1 TYR A 41 11.547 4.258 0.706 1.00 0.00 C ATOM 602 CD2 TYR A 41 11.363 5.067 -1.529 1.00 0.00 C ATOM 603 CE1 TYR A 41 12.855 4.700 0.763 1.00 0.00 C ATOM 604 CE2 TYR A 41 12.670 5.511 -1.481 1.00 0.00 C ATOM 605 CZ TYR A 41 13.412 5.326 -0.333 1.00 0.00 C ATOM 606 OH TYR A 41 14.714 5.767 -0.280 1.00 0.00 O ATOM 0 H TYR A 41 9.347 3.094 1.854 1.00 0.00 H new ATOM 0 HA TYR A 41 8.825 5.518 0.876 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.339 2.861 -0.426 1.00 0.00 H new ATOM 0 HB3 TYR A 41 8.924 4.209 -1.466 1.00 0.00 H new ATOM 0 HD1 TYR A 41 11.115 3.767 1.565 1.00 0.00 H new ATOM 0 HD2 TYR A 41 10.785 5.214 -2.429 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.438 4.556 1.661 1.00 0.00 H new ATOM 0 HE2 TYR A 41 13.109 6.001 -2.338 1.00 0.00 H new ATOM 0 HH TYR A 41 14.953 6.184 -1.134 1.00 0.00 H new ATOM 616 N LEU A 42 6.412 3.529 -0.220 1.00 0.00 N ATOM 617 CA LEU A 42 5.039 3.517 -0.714 1.00 0.00 C ATOM 618 C LEU A 42 4.092 4.160 0.294 1.00 0.00 C ATOM 619 O LEU A 42 3.196 4.920 -0.075 1.00 0.00 O ATOM 620 CB LEU A 42 4.594 2.083 -1.006 1.00 0.00 C ATOM 621 CG LEU A 42 3.366 1.932 -1.905 1.00 0.00 C ATOM 622 CD1 LEU A 42 3.701 2.318 -3.337 1.00 0.00 C ATOM 623 CD2 LEU A 42 2.833 0.508 -1.844 1.00 0.00 C ATOM 0 H LEU A 42 6.843 2.607 -0.149 1.00 0.00 H new ATOM 0 HA LEU A 42 5.006 4.096 -1.637 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.426 1.553 -1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.388 1.587 -0.057 1.00 0.00 H new ATOM 0 HG LEU A 42 2.589 2.605 -1.543 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.815 2.204 -3.961 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.034 3.355 -3.366 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.495 1.672 -3.712 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.959 0.419 -2.490 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.605 -0.184 -2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.552 0.268 -0.818 1.00 0.00 H new ATOM 635 N LYS A 43 4.298 3.853 1.571 1.00 0.00 N ATOM 636 CA LYS A 43 3.465 4.403 2.634 1.00 0.00 C ATOM 637 C LYS A 43 3.478 5.928 2.602 1.00 0.00 C ATOM 638 O LYS A 43 2.426 6.566 2.581 1.00 0.00 O ATOM 639 CB LYS A 43 3.951 3.907 3.998 1.00 0.00 C ATOM 640 CG LYS A 43 2.872 3.911 5.066 1.00 0.00 C ATOM 641 CD LYS A 43 3.295 3.115 6.289 1.00 0.00 C ATOM 642 CE LYS A 43 2.948 1.641 6.142 1.00 0.00 C ATOM 643 NZ LYS A 43 3.288 0.866 7.368 1.00 0.00 N ATOM 0 H LYS A 43 5.035 3.226 1.894 1.00 0.00 H new ATOM 0 HA LYS A 43 2.442 4.063 2.473 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.339 2.894 3.890 1.00 0.00 H new ATOM 0 HB3 LYS A 43 4.780 4.533 4.329 1.00 0.00 H new ATOM 0 HG2 LYS A 43 2.651 4.938 5.358 1.00 0.00 H new ATOM 0 HG3 LYS A 43 1.953 3.491 4.657 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.369 3.224 6.442 1.00 0.00 H new ATOM 0 HD3 LYS A 43 2.805 3.519 7.175 1.00 0.00 H new ATOM 0 HE2 LYS A 43 1.884 1.538 5.931 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.484 1.225 5.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.037 -0.133 7.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.308 0.943 7.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.757 1.246 8.177 1.00 0.00 H new ATOM 657 N ASP A 44 4.674 6.505 2.595 1.00 0.00 N ATOM 658 CA ASP A 44 4.824 7.955 2.562 1.00 0.00 C ATOM 659 C ASP A 44 4.121 8.546 1.344 1.00 0.00 C ATOM 660 O ASP A 44 3.445 9.571 1.440 1.00 0.00 O ATOM 661 CB ASP A 44 6.305 8.337 2.547 1.00 0.00 C ATOM 662 CG ASP A 44 6.917 8.335 3.934 1.00 0.00 C ATOM 663 OD1 ASP A 44 6.497 9.164 4.769 1.00 0.00 O ATOM 664 OD2 ASP A 44 7.815 7.505 4.185 1.00 0.00 O ATOM 0 H ASP A 44 5.555 5.991 2.612 1.00 0.00 H new ATOM 0 HA ASP A 44 4.361 8.364 3.460 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.851 7.640 1.911 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.418 9.327 2.105 1.00 0.00 H new ATOM 669 N HIS A 45 4.287 7.894 0.197 1.00 0.00 N ATOM 670 CA HIS A 45 3.669 8.355 -1.041 1.00 0.00 C ATOM 671 C HIS A 45 2.188 8.654 -0.830 1.00 0.00 C ATOM 672 O HIS A 45 1.638 9.575 -1.434 1.00 0.00 O ATOM 673 CB HIS A 45 3.839 7.308 -2.141 1.00 0.00 C ATOM 674 CG HIS A 45 3.672 7.859 -3.524 1.00 0.00 C ATOM 675 ND1 HIS A 45 4.632 7.732 -4.506 1.00 0.00 N ATOM 676 CD2 HIS A 45 2.649 8.542 -4.087 1.00 0.00 C ATOM 677 CE1 HIS A 45 4.207 8.314 -5.613 1.00 0.00 C ATOM 678 NE2 HIS A 45 3.005 8.813 -5.385 1.00 0.00 N ATOM 0 H HIS A 45 4.844 7.045 0.100 1.00 0.00 H new ATOM 0 HA HIS A 45 4.167 9.275 -1.346 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.829 6.860 -2.055 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.113 6.510 -1.987 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.724 8.822 -3.605 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.749 8.372 -6.545 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.434 9.318 -6.063 1.00 0.00 H new ATOM 687 N PHE A 46 1.547 7.869 0.029 1.00 0.00 N ATOM 688 CA PHE A 46 0.129 8.048 0.318 1.00 0.00 C ATOM 689 C PHE A 46 -0.070 8.986 1.505 1.00 0.00 C ATOM 690 O PHE A 46 -0.629 10.074 1.363 1.00 0.00 O ATOM 691 CB PHE A 46 -0.529 6.697 0.606 1.00 0.00 C ATOM 692 CG PHE A 46 -0.821 5.897 -0.631 1.00 0.00 C ATOM 693 CD1 PHE A 46 0.198 5.248 -1.309 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.115 5.794 -1.116 1.00 0.00 C ATOM 695 CE1 PHE A 46 -0.068 4.510 -2.448 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.387 5.058 -2.254 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.362 4.416 -2.921 1.00 0.00 C ATOM 0 H PHE A 46 1.987 7.102 0.538 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.341 8.494 -0.558 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.122 6.116 1.259 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.459 6.863 1.150 1.00 0.00 H new ATOM 0 HD1 PHE A 46 1.212 5.319 -0.944 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.920 6.295 -0.599 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.735 4.008 -2.967 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.400 4.985 -2.621 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.572 3.841 -3.811 1.00 0.00 H new ATOM 707 N SER A 47 0.390 8.556 2.675 1.00 0.00 N ATOM 708 CA SER A 47 0.259 9.355 3.888 1.00 0.00 C ATOM 709 C SER A 47 0.381 10.843 3.574 1.00 0.00 C ATOM 710 O SER A 47 -0.463 11.645 3.973 1.00 0.00 O ATOM 711 CB SER A 47 1.324 8.949 4.909 1.00 0.00 C ATOM 712 OG SER A 47 1.611 10.015 5.798 1.00 0.00 O ATOM 0 H SER A 47 0.857 7.659 2.809 1.00 0.00 H new ATOM 0 HA SER A 47 -0.729 9.170 4.310 1.00 0.00 H new ATOM 0 HB2 SER A 47 0.979 8.083 5.474 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.234 8.649 4.390 1.00 0.00 H new ATOM 0 HG SER A 47 0.775 10.445 6.074 1.00 0.00 H new ATOM 718 N HIS A 48 1.440 11.205 2.856 1.00 0.00 N ATOM 719 CA HIS A 48 1.674 12.597 2.487 1.00 0.00 C ATOM 720 C HIS A 48 0.536 13.128 1.620 1.00 0.00 C ATOM 721 O HIS A 48 -0.049 14.171 1.915 1.00 0.00 O ATOM 722 CB HIS A 48 3.003 12.733 1.744 1.00 0.00 C ATOM 723 CG HIS A 48 2.879 12.579 0.260 1.00 0.00 C ATOM 724 ND1 HIS A 48 3.374 11.492 -0.428 1.00 0.00 N ATOM 725 CD2 HIS A 48 2.308 13.382 -0.669 1.00 0.00 C ATOM 726 CE1 HIS A 48 3.116 11.634 -1.716 1.00 0.00 C ATOM 727 NE2 HIS A 48 2.469 12.773 -1.889 1.00 0.00 N ATOM 0 H HIS A 48 2.149 10.554 2.518 1.00 0.00 H new ATOM 0 HA HIS A 48 1.716 13.188 3.402 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.435 13.709 1.965 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.699 11.984 2.122 1.00 0.00 H new ATOM 0 HD1 HIS A 48 3.863 10.701 -0.008 1.00 0.00 H new ATOM 0 HD2 HIS A 48 1.817 14.326 -0.485 1.00 0.00 H new ATOM 0 HE1 HIS A 48 3.388 10.937 -2.495 1.00 0.00 H new ATOM 736 N LEU A 49 0.228 12.404 0.549 1.00 0.00 N ATOM 737 CA LEU A 49 -0.839 12.803 -0.362 1.00 0.00 C ATOM 738 C LEU A 49 -2.177 12.877 0.366 1.00 0.00 C ATOM 739 O LEU A 49 -2.785 13.944 0.463 1.00 0.00 O ATOM 740 CB LEU A 49 -0.935 11.818 -1.529 1.00 0.00 C ATOM 741 CG LEU A 49 -1.829 12.242 -2.694 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.206 12.646 -2.190 1.00 0.00 C ATOM 743 CD2 LEU A 49 -1.187 13.383 -3.471 1.00 0.00 C ATOM 0 H LEU A 49 0.702 11.538 0.291 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.601 13.794 -0.749 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.070 11.643 -1.914 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.300 10.865 -1.145 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.946 11.392 -3.366 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.829 12.945 -3.033 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.668 11.802 -1.679 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.109 13.481 -1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.837 13.672 -4.297 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.040 14.236 -2.809 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.224 13.059 -3.864 1.00 0.00 H new ATOM 755 N LEU A 50 -2.630 11.739 0.879 1.00 0.00 N ATOM 756 CA LEU A 50 -3.896 11.675 1.601 1.00 0.00 C ATOM 757 C LEU A 50 -3.981 12.780 2.649 1.00 0.00 C ATOM 758 O LEU A 50 -5.071 13.193 3.043 1.00 0.00 O ATOM 759 CB LEU A 50 -4.055 10.308 2.270 1.00 0.00 C ATOM 760 CG LEU A 50 -4.481 9.159 1.357 1.00 0.00 C ATOM 761 CD1 LEU A 50 -4.454 7.839 2.111 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.867 9.419 0.783 1.00 0.00 C ATOM 0 H LEU A 50 -2.140 10.847 0.809 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.704 11.818 0.883 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.107 10.042 2.737 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.789 10.401 3.070 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.773 9.096 0.531 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.760 7.033 1.444 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.444 7.647 2.472 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.139 7.890 2.958 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.154 8.591 0.135 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.587 9.510 1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.854 10.343 0.205 1.00 0.00 H new ATOM 774 N GLY A 51 -2.823 13.257 3.094 1.00 0.00 N ATOM 775 CA GLY A 51 -2.789 14.312 4.091 1.00 0.00 C ATOM 776 C GLY A 51 -2.591 13.777 5.495 1.00 0.00 C ATOM 777 O GLY A 51 -2.076 14.478 6.367 1.00 0.00 O ATOM 0 H GLY A 51 -1.908 12.932 2.782 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.983 15.006 3.853 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.720 14.877 4.049 1.00 0.00 H new ATOM 781 N ILE A 52 -3.002 12.533 5.716 1.00 0.00 N ATOM 782 CA ILE A 52 -2.868 11.905 7.025 1.00 0.00 C ATOM 783 C ILE A 52 -1.477 11.308 7.208 1.00 0.00 C ATOM 784 O ILE A 52 -0.819 10.899 6.251 1.00 0.00 O ATOM 785 CB ILE A 52 -3.920 10.799 7.229 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.873 9.800 6.072 1.00 0.00 C ATOM 787 CG2 ILE A 52 -5.309 11.406 7.356 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.773 8.601 6.272 1.00 0.00 C ATOM 0 H ILE A 52 -3.431 11.940 5.006 1.00 0.00 H new ATOM 0 HA ILE A 52 -3.026 12.687 7.768 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.692 10.267 8.153 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -4.159 10.309 5.151 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.847 9.456 5.941 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.041 10.612 7.500 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.334 12.082 8.211 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.548 11.960 6.448 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.689 7.935 5.413 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.474 8.068 7.175 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.806 8.934 6.373 1.00 0.00 H new ATOM 800 N PRO A 53 -1.017 11.254 8.466 1.00 0.00 N ATOM 801 CA PRO A 53 0.300 10.706 8.805 1.00 0.00 C ATOM 802 C PRO A 53 0.366 9.195 8.613 1.00 0.00 C ATOM 803 O PRO A 53 -0.633 8.494 8.775 1.00 0.00 O ATOM 804 CB PRO A 53 0.463 11.064 10.285 1.00 0.00 C ATOM 805 CG PRO A 53 -0.929 11.190 10.800 1.00 0.00 C ATOM 806 CD PRO A 53 -1.747 11.724 9.656 1.00 0.00 C ATOM 0 HA PRO A 53 1.086 11.109 8.166 1.00 0.00 H new ATOM 0 HB2 PRO A 53 1.015 10.292 10.821 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.017 11.995 10.408 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.310 10.225 11.135 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.969 11.863 11.656 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.767 11.341 9.679 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.814 12.812 9.683 1.00 0.00 H new ATOM 814 N HIS A 54 1.549 8.698 8.265 1.00 0.00 N ATOM 815 CA HIS A 54 1.745 7.269 8.051 1.00 0.00 C ATOM 816 C HIS A 54 1.663 6.506 9.370 1.00 0.00 C ATOM 817 O HIS A 54 1.498 5.286 9.384 1.00 0.00 O ATOM 818 CB HIS A 54 3.097 7.012 7.384 1.00 0.00 C ATOM 819 CG HIS A 54 4.239 7.711 8.055 1.00 0.00 C ATOM 820 ND1 HIS A 54 4.742 7.325 9.280 1.00 0.00 N ATOM 821 CD2 HIS A 54 4.978 8.776 7.665 1.00 0.00 C ATOM 822 CE1 HIS A 54 5.739 8.124 9.614 1.00 0.00 C ATOM 823 NE2 HIS A 54 5.903 9.013 8.651 1.00 0.00 N ATOM 0 H HIS A 54 2.386 9.264 8.125 1.00 0.00 H new ATOM 0 HA HIS A 54 0.951 6.913 7.395 1.00 0.00 H new ATOM 0 HB2 HIS A 54 3.292 5.940 7.378 1.00 0.00 H new ATOM 0 HB3 HIS A 54 3.046 7.333 6.344 1.00 0.00 H new ATOM 0 HD2 HIS A 54 4.861 9.335 6.748 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.322 8.061 10.521 1.00 0.00 H new ATOM 0 HE2 HIS A 54 6.603 9.755 8.642 1.00 0.00 H new ATOM 832 N SER A 55 1.781 7.232 10.477 1.00 0.00 N ATOM 833 CA SER A 55 1.724 6.623 11.801 1.00 0.00 C ATOM 834 C SER A 55 0.461 5.783 11.959 1.00 0.00 C ATOM 835 O SER A 55 0.530 4.577 12.200 1.00 0.00 O ATOM 836 CB SER A 55 1.771 7.703 12.884 1.00 0.00 C ATOM 837 OG SER A 55 3.108 8.021 13.229 1.00 0.00 O ATOM 0 H SER A 55 1.917 8.243 10.483 1.00 0.00 H new ATOM 0 HA SER A 55 2.589 5.970 11.911 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.260 8.599 12.531 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.236 7.359 13.769 1.00 0.00 H new ATOM 0 HG SER A 55 3.111 8.715 13.921 1.00 0.00 H new ATOM 843 N VAL A 56 -0.693 6.428 11.821 1.00 0.00 N ATOM 844 CA VAL A 56 -1.973 5.741 11.946 1.00 0.00 C ATOM 845 C VAL A 56 -2.214 4.807 10.766 1.00 0.00 C ATOM 846 O VAL A 56 -2.705 3.690 10.934 1.00 0.00 O ATOM 847 CB VAL A 56 -3.140 6.742 12.042 1.00 0.00 C ATOM 848 CG1 VAL A 56 -3.043 7.554 13.324 1.00 0.00 C ATOM 849 CG2 VAL A 56 -3.161 7.653 10.824 1.00 0.00 C ATOM 0 H VAL A 56 -0.768 7.426 11.623 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.929 5.156 12.865 1.00 0.00 H new ATOM 0 HB VAL A 56 -4.075 6.183 12.065 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.876 8.256 13.374 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.081 6.884 14.183 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.103 8.105 13.335 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.992 8.354 10.908 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -2.224 8.206 10.767 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.283 7.052 9.923 1.00 0.00 H new ATOM 859 N LEU A 57 -1.864 5.271 9.571 1.00 0.00 N ATOM 860 CA LEU A 57 -2.042 4.477 8.360 1.00 0.00 C ATOM 861 C LEU A 57 -1.133 3.252 8.374 1.00 0.00 C ATOM 862 O LEU A 57 0.030 3.336 8.769 1.00 0.00 O ATOM 863 CB LEU A 57 -1.752 5.327 7.122 1.00 0.00 C ATOM 864 CG LEU A 57 -1.316 4.564 5.871 1.00 0.00 C ATOM 865 CD1 LEU A 57 -2.509 3.881 5.220 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.633 5.501 4.886 1.00 0.00 C ATOM 0 H LEU A 57 -1.456 6.193 9.415 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.077 4.138 8.326 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.648 5.899 6.881 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.973 6.046 7.374 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.601 3.797 6.167 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.180 3.343 4.331 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.956 3.179 5.924 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.248 4.631 4.937 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.329 4.941 4.002 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.326 6.291 4.595 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.246 5.944 5.355 1.00 0.00 H new ATOM 878 N GLN A 58 -1.670 2.118 7.938 1.00 0.00 N ATOM 879 CA GLN A 58 -0.906 0.876 7.899 1.00 0.00 C ATOM 880 C GLN A 58 -1.291 0.038 6.685 1.00 0.00 C ATOM 881 O GLN A 58 -2.302 0.301 6.032 1.00 0.00 O ATOM 882 CB GLN A 58 -1.133 0.073 9.181 1.00 0.00 C ATOM 883 CG GLN A 58 -1.413 0.937 10.400 1.00 0.00 C ATOM 884 CD GLN A 58 -1.258 0.178 11.702 1.00 0.00 C ATOM 885 OE1 GLN A 58 -2.155 -0.558 12.115 1.00 0.00 O ATOM 886 NE2 GLN A 58 -0.117 0.352 12.358 1.00 0.00 N ATOM 0 H GLN A 58 -2.631 2.033 7.607 1.00 0.00 H new ATOM 0 HA GLN A 58 0.151 1.131 7.821 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -1.970 -0.608 9.029 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.254 -0.541 9.376 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.735 1.791 10.399 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -2.426 1.334 10.334 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.600 0.971 11.979 1.00 0.00 H new ATOM 0 HE22 GLN A 58 0.043 -0.134 13.241 1.00 0.00 H new ATOM 895 N ILE A 59 -0.479 -0.971 6.387 1.00 0.00 N ATOM 896 CA ILE A 59 -0.736 -1.848 5.251 1.00 0.00 C ATOM 897 C ILE A 59 -0.883 -3.298 5.699 1.00 0.00 C ATOM 898 O ILE A 59 -0.429 -3.674 6.780 1.00 0.00 O ATOM 899 CB ILE A 59 0.390 -1.757 4.204 1.00 0.00 C ATOM 900 CG1 ILE A 59 0.484 -0.335 3.646 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.153 -2.758 3.083 1.00 0.00 C ATOM 902 CD1 ILE A 59 1.708 -0.102 2.789 1.00 0.00 C ATOM 0 H ILE A 59 0.362 -1.201 6.916 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.670 -1.514 4.798 1.00 0.00 H new ATOM 0 HB ILE A 59 1.336 -2.000 4.687 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.408 -0.125 3.056 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.491 0.372 4.475 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.957 -2.682 2.351 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.132 -3.767 3.495 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.800 -2.543 2.599 1.00 0.00 H new ATOM 0 HD11 ILE A 59 1.709 0.926 2.428 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.606 -0.280 3.381 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.693 -0.785 1.939 1.00 0.00 H new ATOM 914 N ARG A 60 -1.518 -4.109 4.859 1.00 0.00 N ATOM 915 CA ARG A 60 -1.724 -5.519 5.168 1.00 0.00 C ATOM 916 C ARG A 60 -1.416 -6.392 3.955 1.00 0.00 C ATOM 917 O ARG A 60 -1.943 -6.167 2.865 1.00 0.00 O ATOM 918 CB ARG A 60 -3.164 -5.757 5.628 1.00 0.00 C ATOM 919 CG ARG A 60 -3.581 -7.218 5.591 1.00 0.00 C ATOM 920 CD ARG A 60 -4.722 -7.496 6.557 1.00 0.00 C ATOM 921 NE ARG A 60 -6.024 -7.190 5.969 1.00 0.00 N ATOM 922 CZ ARG A 60 -7.175 -7.637 6.460 1.00 0.00 C ATOM 923 NH1 ARG A 60 -7.185 -8.404 7.541 1.00 0.00 N ATOM 924 NH2 ARG A 60 -8.318 -7.316 5.869 1.00 0.00 N ATOM 0 H ARG A 60 -1.898 -3.814 3.960 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.042 -5.792 5.973 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.279 -5.381 6.645 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.839 -5.179 4.996 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -3.886 -7.485 4.579 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -2.728 -7.848 5.843 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -4.697 -8.544 6.856 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -4.584 -6.903 7.461 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.051 -6.601 5.136 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.308 -8.652 7.998 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.070 -8.746 7.916 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.314 -6.726 5.037 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -9.201 -7.659 6.246 1.00 0.00 H new ATOM 938 N TYR A 61 -0.558 -7.387 4.152 1.00 0.00 N ATOM 939 CA TYR A 61 -0.177 -8.292 3.074 1.00 0.00 C ATOM 940 C TYR A 61 -0.008 -9.716 3.593 1.00 0.00 C ATOM 941 O TYR A 61 0.750 -9.961 4.531 1.00 0.00 O ATOM 942 CB TYR A 61 1.121 -7.818 2.418 1.00 0.00 C ATOM 943 CG TYR A 61 1.665 -8.781 1.387 1.00 0.00 C ATOM 944 CD1 TYR A 61 1.059 -8.915 0.144 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.785 -9.558 1.656 1.00 0.00 C ATOM 946 CE1 TYR A 61 1.552 -9.794 -0.801 1.00 0.00 C ATOM 947 CE2 TYR A 61 3.286 -10.439 0.717 1.00 0.00 C ATOM 948 CZ TYR A 61 2.666 -10.554 -0.510 1.00 0.00 C ATOM 949 OH TYR A 61 3.161 -11.430 -1.449 1.00 0.00 O ATOM 0 H TYR A 61 -0.113 -7.587 5.048 1.00 0.00 H new ATOM 0 HA TYR A 61 -0.974 -8.288 2.331 1.00 0.00 H new ATOM 0 HB2 TYR A 61 0.947 -6.852 1.944 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.874 -7.663 3.191 1.00 0.00 H new ATOM 0 HD1 TYR A 61 0.187 -8.321 -0.088 1.00 0.00 H new ATOM 0 HD2 TYR A 61 3.272 -9.472 2.616 1.00 0.00 H new ATOM 0 HE1 TYR A 61 1.068 -9.886 -1.762 1.00 0.00 H new ATOM 0 HE2 TYR A 61 4.158 -11.034 0.942 1.00 0.00 H new ATOM 0 HH TYR A 61 3.949 -11.887 -1.087 1.00 0.00 H new ATOM 959 N SER A 62 -0.719 -10.653 2.974 1.00 0.00 N ATOM 960 CA SER A 62 -0.651 -12.054 3.374 1.00 0.00 C ATOM 961 C SER A 62 -1.286 -12.258 4.746 1.00 0.00 C ATOM 962 O SER A 62 -0.896 -13.152 5.496 1.00 0.00 O ATOM 963 CB SER A 62 0.802 -12.530 3.396 1.00 0.00 C ATOM 964 OG SER A 62 0.875 -13.941 3.501 1.00 0.00 O ATOM 0 H SER A 62 -1.349 -10.468 2.193 1.00 0.00 H new ATOM 0 HA SER A 62 -1.207 -12.642 2.644 1.00 0.00 H new ATOM 0 HB2 SER A 62 1.309 -12.203 2.488 1.00 0.00 H new ATOM 0 HB3 SER A 62 1.325 -12.072 4.235 1.00 0.00 H new ATOM 0 HG SER A 62 0.272 -14.248 4.210 1.00 0.00 H new ATOM 970 N GLY A 63 -2.269 -11.422 5.067 1.00 0.00 N ATOM 971 CA GLY A 63 -2.943 -11.526 6.348 1.00 0.00 C ATOM 972 C GLY A 63 -2.047 -11.139 7.508 1.00 0.00 C ATOM 973 O GLY A 63 -2.454 -11.211 8.668 1.00 0.00 O ATOM 0 H GLY A 63 -2.610 -10.675 4.463 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.825 -10.885 6.344 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.293 -12.549 6.489 1.00 0.00 H new ATOM 977 N LYS A 64 -0.822 -10.729 7.196 1.00 0.00 N ATOM 978 CA LYS A 64 0.135 -10.329 8.220 1.00 0.00 C ATOM 979 C LYS A 64 0.485 -8.850 8.090 1.00 0.00 C ATOM 980 O LYS A 64 0.553 -8.314 6.984 1.00 0.00 O ATOM 981 CB LYS A 64 1.406 -11.176 8.118 1.00 0.00 C ATOM 982 CG LYS A 64 2.345 -10.732 7.010 1.00 0.00 C ATOM 983 CD LYS A 64 3.725 -11.349 7.168 1.00 0.00 C ATOM 984 CE LYS A 64 3.749 -12.791 6.684 1.00 0.00 C ATOM 985 NZ LYS A 64 3.317 -13.740 7.746 1.00 0.00 N ATOM 0 H LYS A 64 -0.469 -10.665 6.241 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.325 -10.491 9.195 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.936 -11.137 9.070 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.127 -12.216 7.951 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.928 -11.014 6.043 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.428 -9.645 7.016 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.453 -10.763 6.607 1.00 0.00 H new ATOM 0 HD3 LYS A 64 4.024 -11.310 8.215 1.00 0.00 H new ATOM 0 HE2 LYS A 64 3.096 -12.894 5.817 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.756 -13.047 6.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.914 -14.591 7.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.411 -13.286 8.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.324 -14.007 7.590 1.00 0.00 H new ATOM 999 N ILE A 65 0.707 -8.198 9.226 1.00 0.00 N ATOM 1000 CA ILE A 65 1.053 -6.782 9.238 1.00 0.00 C ATOM 1001 C ILE A 65 2.530 -6.574 8.920 1.00 0.00 C ATOM 1002 O ILE A 65 3.404 -7.119 9.595 1.00 0.00 O ATOM 1003 CB ILE A 65 0.737 -6.136 10.600 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.742 -6.324 10.947 1.00 0.00 C ATOM 1005 CG2 ILE A 65 1.099 -4.659 10.583 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.679 -5.576 10.024 1.00 0.00 C ATOM 0 H ILE A 65 0.654 -8.627 10.150 1.00 0.00 H new ATOM 0 HA ILE A 65 0.447 -6.303 8.469 1.00 0.00 H new ATOM 0 HB ILE A 65 1.336 -6.628 11.366 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.983 -7.387 10.913 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.912 -5.992 11.971 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.870 -4.217 11.553 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.163 -4.548 10.376 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.524 -4.152 9.808 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.710 -5.755 10.329 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.465 -4.508 10.076 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.538 -5.925 9.001 1.00 0.00 H new ATOM 1018 N LEU A 66 2.801 -5.781 7.890 1.00 0.00 N ATOM 1019 CA LEU A 66 4.173 -5.498 7.483 1.00 0.00 C ATOM 1020 C LEU A 66 4.722 -4.283 8.224 1.00 0.00 C ATOM 1021 O LEU A 66 4.024 -3.665 9.028 1.00 0.00 O ATOM 1022 CB LEU A 66 4.240 -5.261 5.973 1.00 0.00 C ATOM 1023 CG LEU A 66 3.319 -6.130 5.116 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.440 -5.750 3.648 1.00 0.00 C ATOM 1025 CD2 LEU A 66 3.638 -7.604 5.316 1.00 0.00 C ATOM 0 H LEU A 66 2.089 -5.322 7.321 1.00 0.00 H new ATOM 0 HA LEU A 66 4.786 -6.363 7.737 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.004 -4.215 5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.267 -5.422 5.645 1.00 0.00 H new ATOM 0 HG LEU A 66 2.290 -5.956 5.431 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.777 -6.379 3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.161 -4.704 3.519 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.469 -5.894 3.319 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.973 -8.207 4.698 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.672 -7.795 5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.498 -7.868 6.364 1.00 0.00 H new ATOM 1037 N LYS A 67 5.977 -3.944 7.947 1.00 0.00 N ATOM 1038 CA LYS A 67 6.620 -2.801 8.584 1.00 0.00 C ATOM 1039 C LYS A 67 7.338 -1.936 7.553 1.00 0.00 C ATOM 1040 O LYS A 67 7.338 -2.245 6.363 1.00 0.00 O ATOM 1041 CB LYS A 67 7.612 -3.276 9.648 1.00 0.00 C ATOM 1042 CG LYS A 67 6.950 -3.749 10.930 1.00 0.00 C ATOM 1043 CD LYS A 67 6.509 -5.199 10.829 1.00 0.00 C ATOM 1044 CE LYS A 67 7.667 -6.152 11.081 1.00 0.00 C ATOM 1045 NZ LYS A 67 7.341 -7.544 10.664 1.00 0.00 N ATOM 0 H LYS A 67 6.569 -4.445 7.285 1.00 0.00 H new ATOM 0 HA LYS A 67 5.846 -2.199 9.061 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.211 -4.089 9.237 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.298 -2.462 9.882 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.645 -3.637 11.762 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.087 -3.120 11.148 1.00 0.00 H new ATOM 0 HD2 LYS A 67 5.715 -5.390 11.551 1.00 0.00 H new ATOM 0 HD3 LYS A 67 6.092 -5.385 9.840 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.546 -5.807 10.537 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.923 -6.141 12.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.156 -8.163 10.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.517 -7.883 11.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.122 -7.560 9.647 1.00 0.00 H new ATOM 1059 N ASN A 68 7.949 -0.853 8.020 1.00 0.00 N ATOM 1060 CA ASN A 68 8.672 0.056 7.138 1.00 0.00 C ATOM 1061 C ASN A 68 10.016 -0.538 6.728 1.00 0.00 C ATOM 1062 O ASN A 68 10.279 -0.745 5.544 1.00 0.00 O ATOM 1063 CB ASN A 68 8.887 1.405 7.827 1.00 0.00 C ATOM 1064 CG ASN A 68 9.286 1.254 9.282 1.00 0.00 C ATOM 1065 OD1 ASN A 68 8.539 0.697 10.087 1.00 0.00 O ATOM 1066 ND2 ASN A 68 10.468 1.752 9.627 1.00 0.00 N ATOM 0 H ASN A 68 7.958 -0.583 9.004 1.00 0.00 H new ATOM 0 HA ASN A 68 8.072 0.205 6.240 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.660 1.961 7.297 1.00 0.00 H new ATOM 0 HB3 ASN A 68 7.971 1.992 7.763 1.00 0.00 H new ATOM 0 HD21 ASN A 68 10.789 1.681 10.592 1.00 0.00 H new ATOM 0 HD22 ASN A 68 11.054 2.206 8.926 1.00 0.00 H new ATOM 1073 N ASN A 69 10.863 -0.810 7.715 1.00 0.00 N ATOM 1074 CA ASN A 69 12.180 -1.380 7.458 1.00 0.00 C ATOM 1075 C ASN A 69 12.063 -2.695 6.691 1.00 0.00 C ATOM 1076 O ASN A 69 13.053 -3.213 6.176 1.00 0.00 O ATOM 1077 CB ASN A 69 12.926 -1.609 8.774 1.00 0.00 C ATOM 1078 CG ASN A 69 12.269 -2.671 9.634 1.00 0.00 C ATOM 1079 OD1 ASN A 69 11.174 -2.471 10.158 1.00 0.00 O ATOM 1080 ND2 ASN A 69 12.938 -3.809 9.783 1.00 0.00 N ATOM 0 H ASN A 69 10.661 -0.645 8.701 1.00 0.00 H new ATOM 0 HA ASN A 69 12.742 -0.672 6.848 1.00 0.00 H new ATOM 0 HB2 ASN A 69 13.953 -1.903 8.560 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.972 -0.673 9.330 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.546 -4.560 10.351 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.844 -3.931 9.330 1.00 0.00 H new ATOM 1087 N GLU A 70 10.847 -3.226 6.621 1.00 0.00 N ATOM 1088 CA GLU A 70 10.601 -4.480 5.918 1.00 0.00 C ATOM 1089 C GLU A 70 10.598 -4.264 4.407 1.00 0.00 C ATOM 1090 O GLU A 70 10.057 -3.276 3.909 1.00 0.00 O ATOM 1091 CB GLU A 70 9.268 -5.085 6.360 1.00 0.00 C ATOM 1092 CG GLU A 70 9.372 -5.937 7.614 1.00 0.00 C ATOM 1093 CD GLU A 70 10.075 -7.257 7.366 1.00 0.00 C ATOM 1094 OE1 GLU A 70 11.234 -7.235 6.902 1.00 0.00 O ATOM 1095 OE2 GLU A 70 9.466 -8.313 7.637 1.00 0.00 O ATOM 0 H GLU A 70 10.017 -2.808 7.042 1.00 0.00 H new ATOM 0 HA GLU A 70 11.406 -5.171 6.168 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.554 -4.280 6.536 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.868 -5.694 5.549 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.910 -5.382 8.382 1.00 0.00 H new ATOM 0 HG3 GLU A 70 8.372 -6.130 8.002 1.00 0.00 H new ATOM 1102 N THR A 71 11.208 -5.196 3.681 1.00 0.00 N ATOM 1103 CA THR A 71 11.279 -5.109 2.228 1.00 0.00 C ATOM 1104 C THR A 71 10.470 -6.221 1.570 1.00 0.00 C ATOM 1105 O THR A 71 10.340 -7.316 2.119 1.00 0.00 O ATOM 1106 CB THR A 71 12.734 -5.185 1.730 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.609 -4.560 2.675 1.00 0.00 O ATOM 1108 CG2 THR A 71 12.879 -4.511 0.374 1.00 0.00 C ATOM 0 H THR A 71 11.660 -6.020 4.076 1.00 0.00 H new ATOM 0 HA THR A 71 10.858 -4.143 1.949 1.00 0.00 H new ATOM 0 HB THR A 71 13.004 -6.236 1.626 1.00 0.00 H new ATOM 0 HG1 THR A 71 14.532 -4.614 2.351 1.00 0.00 H new ATOM 0 HG21 THR A 71 13.916 -4.578 0.043 1.00 0.00 H new ATOM 0 HG22 THR A 71 12.234 -5.009 -0.350 1.00 0.00 H new ATOM 0 HG23 THR A 71 12.591 -3.463 0.456 1.00 0.00 H new ATOM 1116 N LEU A 72 9.927 -5.934 0.392 1.00 0.00 N ATOM 1117 CA LEU A 72 9.130 -6.912 -0.341 1.00 0.00 C ATOM 1118 C LEU A 72 9.915 -8.201 -0.559 1.00 0.00 C ATOM 1119 O LEU A 72 9.412 -9.297 -0.308 1.00 0.00 O ATOM 1120 CB LEU A 72 8.692 -6.334 -1.688 1.00 0.00 C ATOM 1121 CG LEU A 72 7.597 -5.268 -1.638 1.00 0.00 C ATOM 1122 CD1 LEU A 72 6.258 -5.894 -1.281 1.00 0.00 C ATOM 1123 CD2 LEU A 72 7.961 -4.177 -0.641 1.00 0.00 C ATOM 0 H LEU A 72 10.024 -5.033 -0.076 1.00 0.00 H new ATOM 0 HA LEU A 72 8.246 -7.143 0.253 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.566 -5.905 -2.178 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.344 -7.154 -2.317 1.00 0.00 H new ATOM 0 HG LEU A 72 7.511 -4.816 -2.626 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.491 -5.120 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.993 -6.638 -2.032 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.329 -6.373 -0.305 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.171 -3.427 -0.618 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.075 -4.614 0.351 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.898 -3.708 -0.941 1.00 0.00 H new ATOM 1135 N VAL A 73 11.152 -8.064 -1.025 1.00 0.00 N ATOM 1136 CA VAL A 73 12.009 -9.217 -1.272 1.00 0.00 C ATOM 1137 C VAL A 73 12.246 -10.011 0.007 1.00 0.00 C ATOM 1138 O VAL A 73 12.353 -11.236 -0.022 1.00 0.00 O ATOM 1139 CB VAL A 73 13.368 -8.791 -1.859 1.00 0.00 C ATOM 1140 CG1 VAL A 73 13.239 -8.494 -3.345 1.00 0.00 C ATOM 1141 CG2 VAL A 73 13.916 -7.585 -1.111 1.00 0.00 C ATOM 0 H VAL A 73 11.583 -7.165 -1.239 1.00 0.00 H new ATOM 0 HA VAL A 73 11.491 -9.847 -1.995 1.00 0.00 H new ATOM 0 HB VAL A 73 14.071 -9.615 -1.738 1.00 0.00 H new ATOM 0 HG11 VAL A 73 14.209 -8.195 -3.742 1.00 0.00 H new ATOM 0 HG12 VAL A 73 12.894 -9.387 -3.866 1.00 0.00 H new ATOM 0 HG13 VAL A 73 12.522 -7.687 -3.494 1.00 0.00 H new ATOM 0 HG21 VAL A 73 14.876 -7.297 -1.539 1.00 0.00 H new ATOM 0 HG22 VAL A 73 13.216 -6.754 -1.198 1.00 0.00 H new ATOM 0 HG23 VAL A 73 14.048 -7.839 -0.059 1.00 0.00 H new ATOM 1151 N GLN A 74 12.327 -9.303 1.130 1.00 0.00 N ATOM 1152 CA GLN A 74 12.552 -9.942 2.421 1.00 0.00 C ATOM 1153 C GLN A 74 11.376 -10.837 2.797 1.00 0.00 C ATOM 1154 O GLN A 74 11.534 -11.809 3.537 1.00 0.00 O ATOM 1155 CB GLN A 74 12.771 -8.885 3.505 1.00 0.00 C ATOM 1156 CG GLN A 74 14.217 -8.431 3.628 1.00 0.00 C ATOM 1157 CD GLN A 74 14.541 -7.882 5.003 1.00 0.00 C ATOM 1158 OE1 GLN A 74 14.394 -8.573 6.012 1.00 0.00 O ATOM 1159 NE2 GLN A 74 14.984 -6.631 5.052 1.00 0.00 N ATOM 0 H GLN A 74 12.240 -8.288 1.171 1.00 0.00 H new ATOM 0 HA GLN A 74 13.445 -10.561 2.341 1.00 0.00 H new ATOM 0 HB2 GLN A 74 12.144 -8.020 3.289 1.00 0.00 H new ATOM 0 HB3 GLN A 74 12.442 -9.286 4.464 1.00 0.00 H new ATOM 0 HG2 GLN A 74 14.877 -9.271 3.411 1.00 0.00 H new ATOM 0 HG3 GLN A 74 14.419 -7.666 2.879 1.00 0.00 H new ATOM 0 HE21 GLN A 74 15.091 -6.094 4.192 1.00 0.00 H new ATOM 0 HE22 GLN A 74 15.217 -6.207 5.950 1.00 0.00 H new ATOM 1168 N HIS A 75 10.196 -10.504 2.283 1.00 0.00 N ATOM 1169 CA HIS A 75 8.993 -11.278 2.566 1.00 0.00 C ATOM 1170 C HIS A 75 8.846 -12.433 1.579 1.00 0.00 C ATOM 1171 O HIS A 75 8.256 -13.464 1.898 1.00 0.00 O ATOM 1172 CB HIS A 75 7.757 -10.380 2.506 1.00 0.00 C ATOM 1173 CG HIS A 75 7.532 -9.587 3.756 1.00 0.00 C ATOM 1174 ND1 HIS A 75 6.914 -10.106 4.875 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.847 -8.307 4.062 1.00 0.00 C ATOM 1176 CE1 HIS A 75 6.858 -9.178 5.814 1.00 0.00 C ATOM 1177 NE2 HIS A 75 7.417 -8.077 5.345 1.00 0.00 N ATOM 0 H HIS A 75 10.048 -9.703 1.669 1.00 0.00 H new ATOM 0 HA HIS A 75 9.084 -11.691 3.571 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.856 -9.695 1.664 1.00 0.00 H new ATOM 0 HB3 HIS A 75 6.879 -10.997 2.314 1.00 0.00 H new ATOM 0 HD1 HIS A 75 6.556 -11.057 4.964 1.00 0.00 H new ATOM 0 HD2 HIS A 75 8.344 -7.598 3.417 1.00 0.00 H new ATOM 0 HE1 HIS A 75 6.428 -9.299 6.797 1.00 0.00 H new ATOM 1186 N GLY A 76 9.386 -12.250 0.377 1.00 0.00 N ATOM 1187 CA GLY A 76 9.303 -13.284 -0.637 1.00 0.00 C ATOM 1188 C GLY A 76 8.631 -12.799 -1.906 1.00 0.00 C ATOM 1189 O GLY A 76 7.691 -13.424 -2.398 1.00 0.00 O ATOM 0 H GLY A 76 9.879 -11.405 0.088 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.306 -13.638 -0.873 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.750 -14.135 -0.239 1.00 0.00 H new ATOM 1193 N VAL A 77 9.112 -11.679 -2.438 1.00 0.00 N ATOM 1194 CA VAL A 77 8.551 -11.109 -3.657 1.00 0.00 C ATOM 1195 C VAL A 77 9.623 -10.940 -4.728 1.00 0.00 C ATOM 1196 O VAL A 77 10.668 -10.337 -4.486 1.00 0.00 O ATOM 1197 CB VAL A 77 7.891 -9.744 -3.386 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.306 -9.170 -4.668 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.820 -9.874 -2.314 1.00 0.00 C ATOM 0 H VAL A 77 9.889 -11.149 -2.043 1.00 0.00 H new ATOM 0 HA VAL A 77 7.793 -11.806 -4.013 1.00 0.00 H new ATOM 0 HB VAL A 77 8.655 -9.056 -3.023 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.844 -8.206 -4.457 1.00 0.00 H new ATOM 0 HG12 VAL A 77 8.100 -9.039 -5.403 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.555 -9.854 -5.063 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.364 -8.900 -2.135 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.056 -10.577 -2.646 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.271 -10.238 -1.391 1.00 0.00 H new ATOM 1209 N LYS A 78 9.356 -11.475 -5.914 1.00 0.00 N ATOM 1210 CA LYS A 78 10.295 -11.383 -7.025 1.00 0.00 C ATOM 1211 C LYS A 78 9.873 -10.294 -8.006 1.00 0.00 C ATOM 1212 O LYS A 78 8.720 -9.864 -8.034 1.00 0.00 O ATOM 1213 CB LYS A 78 10.394 -12.727 -7.750 1.00 0.00 C ATOM 1214 CG LYS A 78 11.432 -13.663 -7.156 1.00 0.00 C ATOM 1215 CD LYS A 78 12.844 -13.162 -7.409 1.00 0.00 C ATOM 1216 CE LYS A 78 13.878 -14.035 -6.713 1.00 0.00 C ATOM 1217 NZ LYS A 78 13.756 -13.964 -5.231 1.00 0.00 N ATOM 0 H LYS A 78 8.495 -11.978 -6.131 1.00 0.00 H new ATOM 0 HA LYS A 78 11.273 -11.123 -6.620 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.420 -13.216 -7.726 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.635 -12.548 -8.798 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.266 -13.758 -6.083 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.315 -14.658 -7.586 1.00 0.00 H new ATOM 0 HD2 LYS A 78 13.040 -13.149 -8.481 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.936 -12.135 -7.055 1.00 0.00 H new ATOM 0 HE2 LYS A 78 13.759 -15.069 -7.038 1.00 0.00 H new ATOM 0 HE3 LYS A 78 14.878 -13.721 -7.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.621 -14.340 -4.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.623 -12.974 -4.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 12.939 -14.528 -4.923 1.00 0.00 H new ATOM 1231 N PRO A 79 10.826 -9.838 -8.832 1.00 0.00 N ATOM 1232 CA PRO A 79 10.575 -8.795 -9.831 1.00 0.00 C ATOM 1233 C PRO A 79 9.686 -9.284 -10.969 1.00 0.00 C ATOM 1234 O PRO A 79 9.706 -10.464 -11.320 1.00 0.00 O ATOM 1235 CB PRO A 79 11.975 -8.459 -10.352 1.00 0.00 C ATOM 1236 CG PRO A 79 12.775 -9.692 -10.111 1.00 0.00 C ATOM 1237 CD PRO A 79 12.222 -10.305 -8.854 1.00 0.00 C ATOM 0 HA PRO A 79 10.047 -7.941 -9.405 1.00 0.00 H new ATOM 0 HB2 PRO A 79 11.952 -8.203 -11.411 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.398 -7.603 -9.826 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.692 -10.382 -10.951 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.833 -9.455 -9.997 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.281 -11.393 -8.878 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.770 -9.975 -7.971 1.00 0.00 H new ATOM 1245 N GLN A 80 8.908 -8.371 -11.541 1.00 0.00 N ATOM 1246 CA GLN A 80 8.012 -8.711 -12.640 1.00 0.00 C ATOM 1247 C GLN A 80 6.912 -9.657 -12.171 1.00 0.00 C ATOM 1248 O GLN A 80 6.602 -10.643 -12.840 1.00 0.00 O ATOM 1249 CB GLN A 80 8.797 -9.351 -13.787 1.00 0.00 C ATOM 1250 CG GLN A 80 10.036 -8.566 -14.188 1.00 0.00 C ATOM 1251 CD GLN A 80 10.978 -9.371 -15.062 1.00 0.00 C ATOM 1252 OE1 GLN A 80 10.557 -10.004 -16.030 1.00 0.00 O ATOM 1253 NE2 GLN A 80 12.262 -9.349 -14.724 1.00 0.00 N ATOM 0 H GLN A 80 8.880 -7.390 -11.262 1.00 0.00 H new ATOM 0 HA GLN A 80 7.548 -7.791 -12.996 1.00 0.00 H new ATOM 0 HB2 GLN A 80 9.094 -10.358 -13.496 1.00 0.00 H new ATOM 0 HB3 GLN A 80 8.143 -9.449 -14.653 1.00 0.00 H new ATOM 0 HG2 GLN A 80 9.734 -7.664 -14.720 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.564 -8.245 -13.290 1.00 0.00 H new ATOM 0 HE21 GLN A 80 12.567 -8.810 -13.913 1.00 0.00 H new ATOM 0 HE22 GLN A 80 12.943 -9.871 -15.275 1.00 0.00 H new ATOM 1262 N GLU A 81 6.325 -9.351 -11.018 1.00 0.00 N ATOM 1263 CA GLU A 81 5.260 -10.175 -10.461 1.00 0.00 C ATOM 1264 C GLU A 81 4.053 -9.322 -10.082 1.00 0.00 C ATOM 1265 O GLU A 81 4.167 -8.108 -9.911 1.00 0.00 O ATOM 1266 CB GLU A 81 5.764 -10.938 -9.234 1.00 0.00 C ATOM 1267 CG GLU A 81 5.574 -10.184 -7.928 1.00 0.00 C ATOM 1268 CD GLU A 81 5.921 -11.024 -6.714 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.838 -11.865 -6.816 1.00 0.00 O ATOM 1270 OE2 GLU A 81 5.275 -10.839 -5.661 1.00 0.00 O ATOM 0 H GLU A 81 6.569 -8.538 -10.452 1.00 0.00 H new ATOM 0 HA GLU A 81 4.953 -10.890 -11.224 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.243 -11.893 -9.171 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.823 -11.160 -9.365 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.196 -9.289 -7.936 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.539 -9.852 -7.852 1.00 0.00 H new ATOM 1277 N ILE A 82 2.897 -9.965 -9.954 1.00 0.00 N ATOM 1278 CA ILE A 82 1.670 -9.266 -9.595 1.00 0.00 C ATOM 1279 C ILE A 82 1.206 -9.653 -8.195 1.00 0.00 C ATOM 1280 O ILE A 82 1.026 -10.833 -7.893 1.00 0.00 O ATOM 1281 CB ILE A 82 0.540 -9.563 -10.599 1.00 0.00 C ATOM 1282 CG1 ILE A 82 0.992 -9.231 -12.022 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.710 -8.774 -10.237 1.00 0.00 C ATOM 1284 CD1 ILE A 82 0.154 -9.895 -13.093 1.00 0.00 C ATOM 0 H ILE A 82 2.785 -10.969 -10.094 1.00 0.00 H new ATOM 0 HA ILE A 82 1.895 -8.200 -9.618 1.00 0.00 H new ATOM 0 HB ILE A 82 0.302 -10.626 -10.552 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.957 -8.151 -12.163 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.031 -9.535 -12.145 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.500 -8.994 -10.955 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.040 -9.055 -9.237 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.486 -7.707 -10.259 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.532 -9.615 -14.076 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.208 -10.978 -12.978 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.882 -9.571 -12.997 1.00 0.00 H new ATOM 1296 N VAL A 83 1.012 -8.651 -7.344 1.00 0.00 N ATOM 1297 CA VAL A 83 0.566 -8.885 -5.976 1.00 0.00 C ATOM 1298 C VAL A 83 -0.658 -8.038 -5.644 1.00 0.00 C ATOM 1299 O VAL A 83 -1.096 -7.221 -6.453 1.00 0.00 O ATOM 1300 CB VAL A 83 1.682 -8.576 -4.961 1.00 0.00 C ATOM 1301 CG1 VAL A 83 3.010 -9.143 -5.438 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.786 -7.077 -4.725 1.00 0.00 C ATOM 0 H VAL A 83 1.157 -7.669 -7.578 1.00 0.00 H new ATOM 0 HA VAL A 83 0.303 -9.940 -5.905 1.00 0.00 H new ATOM 0 HB VAL A 83 1.431 -9.053 -4.014 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.786 -8.915 -4.708 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.925 -10.224 -5.551 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.272 -8.698 -6.398 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.579 -6.876 -4.005 1.00 0.00 H new ATOM 0 HG22 VAL A 83 2.014 -6.576 -5.666 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.839 -6.704 -4.335 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.202 -8.238 -4.448 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.376 -7.491 -4.010 1.00 0.00 C ATOM 1314 C GLN A 84 -2.260 -7.110 -2.537 1.00 0.00 C ATOM 1315 O GLN A 84 -2.003 -7.960 -1.684 1.00 0.00 O ATOM 1316 CB GLN A 84 -3.645 -8.314 -4.237 1.00 0.00 C ATOM 1317 CG GLN A 84 -4.926 -7.551 -3.945 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.167 -8.301 -4.388 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.186 -9.532 -4.413 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.211 -7.561 -4.742 1.00 0.00 N ATOM 0 H GLN A 84 -0.850 -8.910 -3.766 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.434 -6.577 -4.600 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.665 -8.658 -5.271 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.609 -9.202 -3.606 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -4.989 -7.351 -2.875 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -4.891 -6.585 -4.448 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.151 -6.543 -4.706 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.073 -8.010 -5.050 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.450 -5.827 -2.246 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.367 -5.334 -0.877 1.00 0.00 C ATOM 1331 C VAL A 85 -3.519 -4.386 -0.564 1.00 0.00 C ATOM 1332 O VAL A 85 -4.003 -3.672 -1.440 1.00 0.00 O ATOM 1333 CB VAL A 85 -1.034 -4.606 -0.622 1.00 0.00 C ATOM 1334 CG1 VAL A 85 0.140 -5.474 -1.049 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -1.010 -3.269 -1.348 1.00 0.00 C ATOM 0 H VAL A 85 -2.662 -5.111 -2.940 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.428 -6.204 -0.223 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.944 -4.415 0.447 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.073 -4.942 -0.861 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.131 -6.404 -0.480 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.058 -5.699 -2.112 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.061 -2.768 -1.157 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.124 -3.435 -2.419 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.828 -2.645 -0.989 1.00 0.00 H new ATOM 1345 N GLU A 86 -3.953 -4.386 0.693 1.00 0.00 N ATOM 1346 CA GLU A 86 -5.050 -3.525 1.122 1.00 0.00 C ATOM 1347 C GLU A 86 -4.549 -2.436 2.065 1.00 0.00 C ATOM 1348 O GLU A 86 -3.725 -2.691 2.944 1.00 0.00 O ATOM 1349 CB GLU A 86 -6.137 -4.352 1.811 1.00 0.00 C ATOM 1350 CG GLU A 86 -7.118 -4.994 0.844 1.00 0.00 C ATOM 1351 CD GLU A 86 -8.185 -5.808 1.551 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -7.831 -6.598 2.450 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -9.375 -5.653 1.204 1.00 0.00 O ATOM 0 H GLU A 86 -3.562 -4.972 1.431 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.472 -3.049 0.237 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.665 -5.132 2.408 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.686 -3.712 2.501 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.595 -4.217 0.247 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.573 -5.638 0.153 1.00 0.00 H new ATOM 1360 N ILE A 87 -5.052 -1.220 1.876 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.657 -0.092 2.710 1.00 0.00 C ATOM 1362 C ILE A 87 -5.808 0.362 3.602 1.00 0.00 C ATOM 1363 O ILE A 87 -6.965 0.373 3.183 1.00 0.00 O ATOM 1364 CB ILE A 87 -4.183 1.099 1.857 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.792 0.821 1.282 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -4.173 2.374 2.687 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -2.213 1.987 0.511 1.00 0.00 C ATOM 0 H ILE A 87 -5.734 -0.991 1.153 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.831 -0.434 3.333 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.878 1.233 1.028 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -2.116 0.563 2.097 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.846 -0.047 0.625 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.836 3.207 2.070 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.179 2.578 3.053 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.497 2.252 3.533 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.227 1.719 0.133 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.868 2.232 -0.325 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -2.127 2.851 1.169 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.481 0.737 4.834 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.487 1.194 5.786 1.00 0.00 C ATOM 1381 C PHE A 88 -5.851 2.034 6.889 1.00 0.00 C ATOM 1382 O PHE A 88 -4.628 2.161 6.961 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.219 -0.002 6.399 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.323 -0.913 7.189 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -5.965 -0.597 8.490 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -5.840 -2.085 6.631 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.140 -1.433 9.218 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.015 -2.925 7.355 1.00 0.00 C ATOM 1389 CZ PHE A 88 -4.665 -2.599 8.651 1.00 0.00 C ATOM 0 H PHE A 88 -4.528 0.734 5.197 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.204 1.815 5.249 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.015 0.363 7.048 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.694 -0.574 5.602 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.335 0.313 8.940 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.111 -2.346 5.619 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.867 -1.174 10.230 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.644 -3.836 6.908 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.022 -3.254 9.219 1.00 0.00 H new ATOM 1399 N SER A 89 -6.689 2.608 7.746 1.00 0.00 N ATOM 1400 CA SER A 89 -6.210 3.441 8.843 1.00 0.00 C ATOM 1401 C SER A 89 -6.776 2.962 10.176 1.00 0.00 C ATOM 1402 O SER A 89 -7.967 2.667 10.289 1.00 0.00 O ATOM 1403 CB SER A 89 -6.595 4.903 8.607 1.00 0.00 C ATOM 1404 OG SER A 89 -5.819 5.771 9.414 1.00 0.00 O ATOM 0 H SER A 89 -7.703 2.512 7.702 1.00 0.00 H new ATOM 0 HA SER A 89 -5.124 3.361 8.880 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.453 5.155 7.556 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.653 5.044 8.829 1.00 0.00 H new ATOM 0 HG SER A 89 -6.223 6.664 9.417 1.00 0.00 H new ATOM 1410 N THR A 90 -5.914 2.887 11.185 1.00 0.00 N ATOM 1411 CA THR A 90 -6.326 2.443 12.511 1.00 0.00 C ATOM 1412 C THR A 90 -7.242 3.465 13.173 1.00 0.00 C ATOM 1413 O THR A 90 -8.215 3.105 13.834 1.00 0.00 O ATOM 1414 CB THR A 90 -5.110 2.194 13.423 1.00 0.00 C ATOM 1415 OG1 THR A 90 -4.297 3.370 13.488 1.00 0.00 O ATOM 1416 CG2 THR A 90 -4.281 1.025 12.912 1.00 0.00 C ATOM 0 H THR A 90 -4.926 3.128 11.109 1.00 0.00 H new ATOM 0 HA THR A 90 -6.868 1.507 12.376 1.00 0.00 H new ATOM 0 HB THR A 90 -5.476 1.951 14.421 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.762 3.444 12.670 1.00 0.00 H new ATOM 0 HG21 THR A 90 -3.428 0.868 13.572 1.00 0.00 H new ATOM 0 HG22 THR A 90 -4.895 0.125 12.892 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.925 1.244 11.905 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.926 4.743 12.990 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.722 5.819 13.570 1.00 0.00 C ATOM 1426 C ASN A 91 -8.484 6.576 12.487 1.00 0.00 C ATOM 1427 O ASN A 91 -8.072 7.645 12.036 1.00 0.00 O ATOM 1428 CB ASN A 91 -6.824 6.783 14.348 1.00 0.00 C ATOM 1429 CG ASN A 91 -6.650 6.371 15.797 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -5.895 5.448 16.104 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -7.350 7.054 16.694 1.00 0.00 N ATOM 0 H ASN A 91 -6.124 5.059 12.445 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.445 5.375 14.254 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.847 6.832 13.868 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -7.250 7.785 14.307 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.275 6.822 17.684 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.963 7.811 16.393 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.623 6.012 12.060 1.00 0.00 N ATOM 1439 CA PRO A 92 -10.467 6.617 11.026 1.00 0.00 C ATOM 1440 C PRO A 92 -11.163 7.883 11.514 1.00 0.00 C ATOM 1441 O PRO A 92 -11.461 8.782 10.727 1.00 0.00 O ATOM 1442 CB PRO A 92 -11.496 5.525 10.723 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.559 4.709 11.968 1.00 0.00 C ATOM 1444 CD PRO A 92 -10.174 4.739 12.554 1.00 0.00 C ATOM 0 HA PRO A 92 -9.887 6.928 10.157 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.469 5.954 10.481 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.192 4.921 9.868 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.287 5.120 12.667 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.868 3.687 11.749 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.198 4.707 13.643 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.579 3.888 12.223 1.00 0.00 H new ATOM 1452 N ASP A 93 -11.419 7.948 12.816 1.00 0.00 N ATOM 1453 CA ASP A 93 -12.078 9.106 13.409 1.00 0.00 C ATOM 1454 C ASP A 93 -11.153 10.319 13.407 1.00 0.00 C ATOM 1455 O ASP A 93 -11.583 11.441 13.136 1.00 0.00 O ATOM 1456 CB ASP A 93 -12.522 8.790 14.838 1.00 0.00 C ATOM 1457 CG ASP A 93 -13.504 7.636 14.898 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -13.215 6.580 14.297 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -14.561 7.789 15.545 1.00 0.00 O ATOM 0 H ASP A 93 -11.180 7.212 13.481 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.956 9.341 12.807 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -11.647 8.550 15.442 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.980 9.676 15.277 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.881 10.086 13.710 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.894 11.160 13.744 1.00 0.00 C ATOM 1466 C LEU A 94 -8.295 11.393 12.361 1.00 0.00 C ATOM 1467 O LEU A 94 -8.248 12.524 11.877 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.785 10.828 14.744 1.00 0.00 C ATOM 1469 CG LEU A 94 -8.143 10.988 16.222 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -7.167 10.214 17.094 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -8.158 12.459 16.611 1.00 0.00 C ATOM 0 H LEU A 94 -9.509 9.164 13.936 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.398 12.074 14.060 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.469 9.798 14.577 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.926 11.464 14.528 1.00 0.00 H new ATOM 0 HG LEU A 94 -9.142 10.581 16.380 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.437 10.340 18.142 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.206 9.156 16.833 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.157 10.591 16.932 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.415 12.554 17.666 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.173 12.891 16.437 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.897 12.987 16.009 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.840 10.316 11.730 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.244 10.403 10.402 1.00 0.00 C ATOM 1485 C TYR A 95 -7.908 9.421 9.442 1.00 0.00 C ATOM 1486 O TYR A 95 -7.385 8.345 9.154 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.742 10.125 10.476 1.00 0.00 C ATOM 1488 CG TYR A 95 -5.030 10.922 11.547 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -4.960 10.457 12.854 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.428 12.138 11.250 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -4.312 11.182 13.835 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -3.776 12.869 12.225 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.721 12.387 13.516 1.00 0.00 C ATOM 1494 OH TYR A 95 -3.073 13.111 14.490 1.00 0.00 O ATOM 0 H TYR A 95 -7.873 9.373 12.117 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.402 11.414 10.026 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.587 9.062 10.662 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.292 10.348 9.509 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.420 9.513 13.107 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.470 12.519 10.240 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -4.268 10.807 14.847 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.312 13.812 11.977 1.00 0.00 H new ATOM 0 HH TYR A 95 -2.711 13.934 14.100 1.00 0.00 H new ATOM 1504 N PRO A 96 -9.089 9.801 8.932 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.851 8.970 7.995 1.00 0.00 C ATOM 1506 C PRO A 96 -9.181 8.875 6.628 1.00 0.00 C ATOM 1507 O PRO A 96 -8.420 9.759 6.236 1.00 0.00 O ATOM 1508 CB PRO A 96 -11.192 9.699 7.884 1.00 0.00 C ATOM 1509 CG PRO A 96 -10.881 11.117 8.217 1.00 0.00 C ATOM 1510 CD PRO A 96 -9.772 11.071 9.232 1.00 0.00 C ATOM 0 HA PRO A 96 -9.938 7.940 8.341 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.609 9.610 6.881 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.927 9.283 8.573 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -10.574 11.668 7.328 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.758 11.625 8.620 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.099 11.923 9.131 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.159 11.089 10.251 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.470 7.797 5.907 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.897 7.587 4.582 1.00 0.00 C ATOM 1520 C VAL A 97 -9.822 8.119 3.493 1.00 0.00 C ATOM 1521 O VAL A 97 -11.041 7.969 3.572 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.619 6.095 4.321 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -7.985 5.902 2.952 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -7.732 5.520 5.414 1.00 0.00 C ATOM 0 H VAL A 97 -10.097 7.055 6.218 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.955 8.135 4.554 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.568 5.558 4.335 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.796 4.842 2.785 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.660 6.276 2.182 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.044 6.450 2.906 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.546 4.465 5.214 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.784 6.058 5.434 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.229 5.624 6.378 1.00 0.00 H new ATOM 1534 N ARG A 98 -9.233 8.740 2.476 1.00 0.00 N ATOM 1535 CA ARG A 98 -10.005 9.295 1.370 1.00 0.00 C ATOM 1536 C ARG A 98 -9.538 8.716 0.038 1.00 0.00 C ATOM 1537 O ARG A 98 -8.625 7.892 -0.006 1.00 0.00 O ATOM 1538 CB ARG A 98 -9.879 10.820 1.348 1.00 0.00 C ATOM 1539 CG ARG A 98 -10.835 11.524 2.297 1.00 0.00 C ATOM 1540 CD ARG A 98 -10.971 13.000 1.957 1.00 0.00 C ATOM 1541 NE ARG A 98 -11.870 13.221 0.827 1.00 0.00 N ATOM 1542 CZ ARG A 98 -12.345 14.414 0.488 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -12.008 15.488 1.188 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -13.158 14.534 -0.554 1.00 0.00 N ATOM 0 H ARG A 98 -8.225 8.871 2.395 1.00 0.00 H new ATOM 0 HA ARG A 98 -11.051 9.026 1.517 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.856 11.095 1.606 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.059 11.176 0.334 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -11.814 11.047 2.249 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -10.478 11.417 3.321 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -11.344 13.540 2.828 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -9.988 13.410 1.724 1.00 0.00 H new ATOM 0 HE ARG A 98 -12.148 12.415 0.268 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -11.383 15.399 1.989 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -12.374 16.403 0.926 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -13.419 13.710 -1.095 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -13.522 15.451 -0.814 1.00 0.00 H new ATOM 1558 N ARG A 99 -10.173 9.152 -1.045 1.00 0.00 N ATOM 1559 CA ARG A 99 -9.824 8.676 -2.378 1.00 0.00 C ATOM 1560 C ARG A 99 -8.889 9.657 -3.079 1.00 0.00 C ATOM 1561 O ARG A 99 -8.874 10.848 -2.765 1.00 0.00 O ATOM 1562 CB ARG A 99 -11.088 8.473 -3.217 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.837 9.762 -3.513 1.00 0.00 C ATOM 1564 CD ARG A 99 -13.326 9.512 -3.694 1.00 0.00 C ATOM 1565 NE ARG A 99 -13.621 8.868 -4.971 1.00 0.00 N ATOM 1566 CZ ARG A 99 -14.847 8.532 -5.359 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -15.885 8.778 -4.572 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -15.035 7.950 -6.536 1.00 0.00 N ATOM 0 H ARG A 99 -10.931 9.834 -1.025 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.308 7.722 -2.272 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -10.816 7.997 -4.159 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -11.755 7.787 -2.694 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.682 10.469 -2.698 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -11.432 10.221 -4.415 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -13.690 8.886 -2.879 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.863 10.459 -3.633 1.00 0.00 H new ATOM 0 HE ARG A 99 -12.844 8.665 -5.600 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -15.744 9.226 -3.667 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -16.825 8.519 -4.872 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -14.238 7.760 -7.144 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -15.976 7.692 -6.833 1.00 0.00 H new ATOM 1582 N ILE A 100 -8.110 9.148 -4.028 1.00 0.00 N ATOM 1583 CA ILE A 100 -7.172 9.980 -4.772 1.00 0.00 C ATOM 1584 C ILE A 100 -7.316 9.761 -6.275 1.00 0.00 C ATOM 1585 O ILE A 100 -7.382 8.624 -6.743 1.00 0.00 O ATOM 1586 CB ILE A 100 -5.716 9.693 -4.361 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -5.547 9.860 -2.849 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -4.763 10.612 -5.110 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.205 9.389 -2.335 1.00 0.00 C ATOM 0 H ILE A 100 -8.110 8.165 -4.299 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.411 11.016 -4.533 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.477 8.662 -4.623 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.677 10.911 -2.591 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -6.336 9.307 -2.340 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.738 10.397 -4.809 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -4.868 10.449 -6.183 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.000 11.650 -4.876 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.156 9.538 -1.256 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.080 8.330 -2.562 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.411 9.959 -2.816 1.00 0.00 H new ATOM 1601 N ASP A 101 -7.364 10.856 -7.024 1.00 0.00 N ATOM 1602 CA ASP A 101 -7.498 10.785 -8.475 1.00 0.00 C ATOM 1603 C ASP A 101 -6.359 11.532 -9.163 1.00 0.00 C ATOM 1604 O ASP A 101 -6.463 12.727 -9.436 1.00 0.00 O ATOM 1605 CB ASP A 101 -8.843 11.365 -8.913 1.00 0.00 C ATOM 1606 CG ASP A 101 -10.017 10.668 -8.254 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -10.013 9.420 -8.205 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -10.940 11.369 -7.789 1.00 0.00 O ATOM 0 H ASP A 101 -7.312 11.804 -6.651 1.00 0.00 H new ATOM 0 HA ASP A 101 -7.451 9.736 -8.769 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.873 12.427 -8.672 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -8.936 11.281 -9.996 1.00 0.00 H new ATOM 1613 N GLY A 102 -5.272 10.818 -9.439 1.00 0.00 N ATOM 1614 CA GLY A 102 -4.129 11.430 -10.092 1.00 0.00 C ATOM 1615 C GLY A 102 -4.039 11.070 -11.561 1.00 0.00 C ATOM 1616 O GLY A 102 -3.308 11.708 -12.321 1.00 0.00 O ATOM 0 H GLY A 102 -5.162 9.827 -9.222 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.193 12.513 -9.990 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.215 11.116 -9.588 1.00 0.00 H new ATOM 1620 N LEU A 103 -4.783 10.046 -11.965 1.00 0.00 N ATOM 1621 CA LEU A 103 -4.783 9.601 -13.354 1.00 0.00 C ATOM 1622 C LEU A 103 -6.196 9.260 -13.816 1.00 0.00 C ATOM 1623 O LEU A 103 -7.081 8.994 -13.002 1.00 0.00 O ATOM 1624 CB LEU A 103 -3.873 8.382 -13.519 1.00 0.00 C ATOM 1625 CG LEU A 103 -3.760 7.459 -12.306 1.00 0.00 C ATOM 1626 CD1 LEU A 103 -3.054 6.166 -12.683 1.00 0.00 C ATOM 1627 CD2 LEU A 103 -3.025 8.158 -11.171 1.00 0.00 C ATOM 0 H LEU A 103 -5.394 9.508 -11.350 1.00 0.00 H new ATOM 0 HA LEU A 103 -4.405 10.416 -13.971 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -4.234 7.796 -14.364 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.874 8.732 -13.778 1.00 0.00 H new ATOM 0 HG LEU A 103 -4.766 7.214 -11.965 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.983 5.522 -11.807 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -3.620 5.657 -13.463 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.053 6.392 -13.050 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.954 7.486 -10.316 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.023 8.433 -11.501 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.571 9.056 -10.883 1.00 0.00 H new ATOM 1639 N THR A 104 -6.402 9.269 -15.130 1.00 0.00 N ATOM 1640 CA THR A 104 -7.706 8.961 -15.701 1.00 0.00 C ATOM 1641 C THR A 104 -8.055 7.489 -15.513 1.00 0.00 C ATOM 1642 O THR A 104 -7.178 6.625 -15.540 1.00 0.00 O ATOM 1643 CB THR A 104 -7.757 9.301 -17.203 1.00 0.00 C ATOM 1644 OG1 THR A 104 -9.068 9.047 -17.719 1.00 0.00 O ATOM 1645 CG2 THR A 104 -6.734 8.483 -17.977 1.00 0.00 C ATOM 0 H THR A 104 -5.681 9.487 -15.818 1.00 0.00 H new ATOM 0 HA THR A 104 -8.435 9.575 -15.172 1.00 0.00 H new ATOM 0 HB THR A 104 -7.519 10.358 -17.322 1.00 0.00 H new ATOM 0 HG1 THR A 104 -9.092 9.267 -18.674 1.00 0.00 H new ATOM 0 HG21 THR A 104 -6.788 8.740 -19.035 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.734 8.701 -17.601 1.00 0.00 H new ATOM 0 HG23 THR A 104 -6.946 7.421 -17.850 1.00 0.00 H new ATOM 1653 N ASP A 105 -9.340 7.210 -15.323 1.00 0.00 N ATOM 1654 CA ASP A 105 -9.805 5.841 -15.132 1.00 0.00 C ATOM 1655 C ASP A 105 -10.111 5.179 -16.472 1.00 0.00 C ATOM 1656 O ASP A 105 -10.107 5.833 -17.514 1.00 0.00 O ATOM 1657 CB ASP A 105 -11.049 5.822 -14.242 1.00 0.00 C ATOM 1658 CG ASP A 105 -10.851 6.594 -12.953 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -9.938 6.237 -12.181 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -11.610 7.558 -12.718 1.00 0.00 O ATOM 0 H ASP A 105 -10.078 7.914 -15.297 1.00 0.00 H new ATOM 0 HA ASP A 105 -9.010 5.278 -14.643 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.891 6.246 -14.790 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -11.309 4.790 -14.007 1.00 0.00 H new ATOM 1665 N VAL A 106 -10.376 3.877 -16.436 1.00 0.00 N ATOM 1666 CA VAL A 106 -10.685 3.126 -17.647 1.00 0.00 C ATOM 1667 C VAL A 106 -12.187 2.902 -17.787 1.00 0.00 C ATOM 1668 O VAL A 106 -12.815 2.284 -16.927 1.00 0.00 O ATOM 1669 CB VAL A 106 -9.970 1.762 -17.660 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -10.426 0.909 -16.486 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -10.216 1.045 -18.978 1.00 0.00 C ATOM 0 H VAL A 106 -10.383 3.320 -15.581 1.00 0.00 H new ATOM 0 HA VAL A 106 -10.330 3.722 -18.488 1.00 0.00 H new ATOM 0 HB VAL A 106 -8.898 1.932 -17.560 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.910 -0.051 -16.512 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -10.193 1.421 -15.552 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -11.502 0.745 -16.552 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.704 0.083 -18.970 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -11.286 0.885 -19.111 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -9.835 1.652 -19.799 1.00 0.00 H new ATOM 1681 N SER A 107 -12.756 3.407 -18.876 1.00 0.00 N ATOM 1682 CA SER A 107 -14.186 3.265 -19.127 1.00 0.00 C ATOM 1683 C SER A 107 -14.524 3.635 -20.568 1.00 0.00 C ATOM 1684 O SER A 107 -13.662 4.088 -21.321 1.00 0.00 O ATOM 1685 CB SER A 107 -14.985 4.143 -18.162 1.00 0.00 C ATOM 1686 OG SER A 107 -14.913 3.642 -16.839 1.00 0.00 O ATOM 0 H SER A 107 -12.249 3.918 -19.599 1.00 0.00 H new ATOM 0 HA SER A 107 -14.456 2.221 -18.965 1.00 0.00 H new ATOM 0 HB2 SER A 107 -14.600 5.163 -18.190 1.00 0.00 H new ATOM 0 HB3 SER A 107 -16.026 4.186 -18.482 1.00 0.00 H new ATOM 0 HG SER A 107 -14.383 2.818 -16.830 1.00 0.00 H new ATOM 1692 N GLN A 108 -15.783 3.438 -20.943 1.00 0.00 N ATOM 1693 CA GLN A 108 -16.236 3.750 -22.294 1.00 0.00 C ATOM 1694 C GLN A 108 -17.070 5.026 -22.307 1.00 0.00 C ATOM 1695 O GLN A 108 -17.005 5.812 -23.253 1.00 0.00 O ATOM 1696 CB GLN A 108 -17.051 2.588 -22.863 1.00 0.00 C ATOM 1697 CG GLN A 108 -16.210 1.374 -23.225 1.00 0.00 C ATOM 1698 CD GLN A 108 -15.201 1.668 -24.317 1.00 0.00 C ATOM 1699 OE1 GLN A 108 -14.005 1.423 -24.156 1.00 0.00 O ATOM 1700 NE2 GLN A 108 -15.679 2.195 -25.438 1.00 0.00 N ATOM 0 H GLN A 108 -16.508 3.064 -20.331 1.00 0.00 H new ATOM 0 HA GLN A 108 -15.356 3.906 -22.918 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -17.805 2.293 -22.134 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -17.583 2.929 -23.751 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -15.686 1.022 -22.337 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -16.866 0.566 -23.549 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -16.678 2.382 -25.528 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -15.048 2.413 -26.209 1.00 0.00 H new ATOM 1709 N ILE A 109 -17.853 5.226 -21.252 1.00 0.00 N ATOM 1710 CA ILE A 109 -18.700 6.408 -21.143 1.00 0.00 C ATOM 1711 C ILE A 109 -19.302 6.526 -19.747 1.00 0.00 C ATOM 1712 O ILE A 109 -19.590 5.520 -19.098 1.00 0.00 O ATOM 1713 CB ILE A 109 -19.838 6.383 -22.180 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -20.599 7.710 -22.167 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -20.782 5.222 -21.903 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -19.789 8.876 -22.690 1.00 0.00 C ATOM 0 H ILE A 109 -17.919 4.585 -20.461 1.00 0.00 H new ATOM 0 HA ILE A 109 -18.063 7.271 -21.336 1.00 0.00 H new ATOM 0 HB ILE A 109 -19.404 6.245 -23.170 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -21.503 7.607 -22.768 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -20.917 7.927 -21.147 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -21.581 5.218 -22.644 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -20.231 4.283 -21.959 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -21.212 5.332 -20.907 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -20.391 9.784 -22.652 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -18.898 9.005 -22.075 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -19.493 8.680 -23.721 1.00 0.00 H new ATOM 1728 N ILE A 110 -19.491 7.760 -19.292 1.00 0.00 N ATOM 1729 CA ILE A 110 -20.062 8.009 -17.975 1.00 0.00 C ATOM 1730 C ILE A 110 -21.100 9.124 -18.027 1.00 0.00 C ATOM 1731 O ILE A 110 -20.904 10.140 -18.696 1.00 0.00 O ATOM 1732 CB ILE A 110 -18.973 8.383 -16.951 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -19.606 8.703 -15.595 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -18.159 9.566 -17.454 1.00 0.00 C ATOM 1735 CD1 ILE A 110 -20.071 7.477 -14.841 1.00 0.00 C ATOM 0 H ILE A 110 -19.257 8.603 -19.816 1.00 0.00 H new ATOM 0 HA ILE A 110 -20.543 7.083 -17.660 1.00 0.00 H new ATOM 0 HB ILE A 110 -18.303 7.532 -16.826 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -18.883 9.243 -14.984 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.455 9.369 -15.748 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -17.394 9.819 -16.720 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -17.683 9.305 -18.399 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -18.816 10.423 -17.603 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -20.509 7.779 -13.890 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.818 6.948 -15.432 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -19.222 6.819 -14.657 1.00 0.00 H new ATOM 1747 N THR A 111 -22.206 8.930 -17.315 1.00 0.00 N ATOM 1748 CA THR A 111 -23.276 9.919 -17.280 1.00 0.00 C ATOM 1749 C THR A 111 -22.717 11.336 -17.345 1.00 0.00 C ATOM 1750 O THR A 111 -22.843 12.017 -18.362 1.00 0.00 O ATOM 1751 CB THR A 111 -24.132 9.775 -16.007 1.00 0.00 C ATOM 1752 OG1 THR A 111 -23.291 9.510 -14.879 1.00 0.00 O ATOM 1753 CG2 THR A 111 -25.148 8.654 -16.163 1.00 0.00 C ATOM 0 H THR A 111 -22.384 8.096 -16.755 1.00 0.00 H new ATOM 0 HA THR A 111 -23.903 9.738 -18.153 1.00 0.00 H new ATOM 0 HB THR A 111 -24.668 10.711 -15.848 1.00 0.00 H new ATOM 0 HG1 THR A 111 -23.842 9.422 -14.074 1.00 0.00 H new ATOM 0 HG21 THR A 111 -25.741 8.571 -15.252 1.00 0.00 H new ATOM 0 HG22 THR A 111 -25.805 8.873 -17.005 1.00 0.00 H new ATOM 0 HG23 THR A 111 -24.627 7.714 -16.344 1.00 0.00 H new ATOM 1761 N VAL A 112 -22.097 11.774 -16.254 1.00 0.00 N ATOM 1762 CA VAL A 112 -21.517 13.110 -16.188 1.00 0.00 C ATOM 1763 C VAL A 112 -20.480 13.313 -17.287 1.00 0.00 C ATOM 1764 O VAL A 112 -20.064 12.360 -17.945 1.00 0.00 O ATOM 1765 CB VAL A 112 -20.858 13.368 -14.820 1.00 0.00 C ATOM 1766 CG1 VAL A 112 -21.914 13.489 -13.732 1.00 0.00 C ATOM 1767 CG2 VAL A 112 -19.865 12.264 -14.490 1.00 0.00 C ATOM 0 H VAL A 112 -21.983 11.223 -15.403 1.00 0.00 H new ATOM 0 HA VAL A 112 -22.334 13.818 -16.328 1.00 0.00 H new ATOM 0 HB VAL A 112 -20.314 14.311 -14.871 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -21.429 13.671 -12.773 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -22.582 14.318 -13.964 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -22.489 12.564 -13.678 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -19.409 12.463 -13.520 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -20.384 11.306 -14.458 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -19.090 12.231 -15.255 1.00 0.00 H new ATOM 1777 N SER A 113 -20.066 14.561 -17.478 1.00 0.00 N ATOM 1778 CA SER A 113 -19.079 14.891 -18.500 1.00 0.00 C ATOM 1779 C SER A 113 -17.796 15.419 -17.865 1.00 0.00 C ATOM 1780 O SER A 113 -17.836 16.192 -16.909 1.00 0.00 O ATOM 1781 CB SER A 113 -19.646 15.928 -19.471 1.00 0.00 C ATOM 1782 OG SER A 113 -20.774 15.418 -20.160 1.00 0.00 O ATOM 0 H SER A 113 -20.398 15.361 -16.939 1.00 0.00 H new ATOM 0 HA SER A 113 -18.843 13.980 -19.050 1.00 0.00 H new ATOM 0 HB2 SER A 113 -19.926 16.828 -18.924 1.00 0.00 H new ATOM 0 HB3 SER A 113 -18.878 16.217 -20.188 1.00 0.00 H new ATOM 0 HG SER A 113 -21.119 16.100 -20.773 1.00 0.00 H new ATOM 1788 N GLY A 114 -16.657 14.995 -18.406 1.00 0.00 N ATOM 1789 CA GLY A 114 -15.378 15.435 -17.881 1.00 0.00 C ATOM 1790 C GLY A 114 -14.237 14.528 -18.298 1.00 0.00 C ATOM 1791 O GLY A 114 -13.558 14.769 -19.296 1.00 0.00 O ATOM 0 H GLY A 114 -16.598 14.355 -19.198 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -15.177 16.449 -18.226 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -15.429 15.473 -16.793 1.00 0.00 H new ATOM 1795 N PRO A 115 -14.013 13.457 -17.522 1.00 0.00 N ATOM 1796 CA PRO A 115 -12.946 12.491 -17.796 1.00 0.00 C ATOM 1797 C PRO A 115 -13.228 11.653 -19.038 1.00 0.00 C ATOM 1798 O PRO A 115 -12.366 10.909 -19.506 1.00 0.00 O ATOM 1799 CB PRO A 115 -12.937 11.607 -16.546 1.00 0.00 C ATOM 1800 CG PRO A 115 -14.318 11.715 -15.997 1.00 0.00 C ATOM 1801 CD PRO A 115 -14.784 13.108 -16.317 1.00 0.00 C ATOM 0 HA PRO A 115 -11.993 12.982 -17.994 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -12.688 10.575 -16.793 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -12.196 11.950 -15.824 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -14.976 10.971 -16.446 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -14.325 11.539 -14.921 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -15.857 13.140 -16.504 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -14.582 13.797 -15.497 1.00 0.00 H new ATOM 1809 N SER A 116 -14.440 11.778 -19.568 1.00 0.00 N ATOM 1810 CA SER A 116 -14.837 11.029 -20.755 1.00 0.00 C ATOM 1811 C SER A 116 -14.475 11.793 -22.025 1.00 0.00 C ATOM 1812 O SER A 116 -14.649 13.009 -22.102 1.00 0.00 O ATOM 1813 CB SER A 116 -16.341 10.747 -20.727 1.00 0.00 C ATOM 1814 OG SER A 116 -16.791 10.257 -21.978 1.00 0.00 O ATOM 0 H SER A 116 -15.165 12.391 -19.194 1.00 0.00 H new ATOM 0 HA SER A 116 -14.297 10.082 -20.755 1.00 0.00 H new ATOM 0 HB2 SER A 116 -16.563 10.019 -19.947 1.00 0.00 H new ATOM 0 HB3 SER A 116 -16.881 11.660 -20.475 1.00 0.00 H new ATOM 0 HG SER A 116 -17.577 10.767 -22.266 1.00 0.00 H new ATOM 1820 N SER A 117 -13.971 11.069 -23.020 1.00 0.00 N ATOM 1821 CA SER A 117 -13.581 11.677 -24.286 1.00 0.00 C ATOM 1822 C SER A 117 -14.801 11.930 -25.166 1.00 0.00 C ATOM 1823 O SER A 117 -15.670 11.070 -25.305 1.00 0.00 O ATOM 1824 CB SER A 117 -12.584 10.779 -25.022 1.00 0.00 C ATOM 1825 OG SER A 117 -11.390 10.624 -24.275 1.00 0.00 O ATOM 0 H SER A 117 -13.823 10.061 -22.973 1.00 0.00 H new ATOM 0 HA SER A 117 -13.106 12.634 -24.070 1.00 0.00 H new ATOM 0 HB2 SER A 117 -13.033 9.802 -25.202 1.00 0.00 H new ATOM 0 HB3 SER A 117 -12.354 11.209 -25.997 1.00 0.00 H new ATOM 0 HG SER A 117 -10.770 10.045 -24.766 1.00 0.00 H new ATOM 1831 N GLY A 118 -14.858 13.118 -25.761 1.00 0.00 N ATOM 1832 CA GLY A 118 -15.975 13.465 -26.620 1.00 0.00 C ATOM 1833 C GLY A 118 -16.054 12.584 -27.852 1.00 0.00 C ATOM 1834 O GLY A 118 -15.621 11.432 -27.828 1.00 0.00 O ATOM 0 H GLY A 118 -14.150 13.846 -25.663 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -16.904 13.380 -26.056 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -15.883 14.507 -26.927 1.00 0.00 H new TER 1838 GLY A 118