USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 802 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 73 ASN : amide:sc= -2.64 K(o=-2.6,f=-10!) USER MOD Set 1.2: A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 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= -0.0267 USER MOD Single : A 14 CYS SG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ -173:sc= -7.95! (180deg=-8.44!) USER MOD Single : A 26 SER OG : rot -160:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 37 ASN : amide:sc= -3.03! C(o=-3!,f=-2.8!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= -0.0069 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= -0.721 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= -0.265 X(o=-0.26,f=-0.0034) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HE2:sc= -2.43 K(o=-2.4,f=-8.7!) USER MOD Single : A 87 GLN : amide:sc= -4.82! C(o=-4.8!,f=-8.9!) USER MOD Single : A 91 SER OG : rot -40:sc= 0.854 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.219 USER MOD Single : A 101 CYS SG : rot -0:sc= 0.176 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.838 36.056 -6.118 1.00 0.00 N ATOM 2 CA GLY A 1 -8.836 34.608 -6.013 1.00 0.00 C ATOM 3 C GLY A 1 -8.628 34.130 -4.590 1.00 0.00 C ATOM 4 O GLY A 1 -7.499 33.875 -4.172 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.984 36.332 -7.110 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.606 36.445 -5.534 1.00 0.00 H new ATOM 0 H3 GLY A 1 -7.926 36.429 -5.785 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.782 34.218 -6.389 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.049 34.202 -6.648 1.00 0.00 H new ATOM 8 N SER A 2 -9.720 34.011 -3.842 1.00 0.00 N ATOM 9 CA SER A 2 -9.652 33.566 -2.455 1.00 0.00 C ATOM 10 C SER A 2 -9.233 32.101 -2.375 1.00 0.00 C ATOM 11 O SER A 2 -9.804 31.242 -3.046 1.00 0.00 O ATOM 12 CB SER A 2 -11.006 33.758 -1.769 1.00 0.00 C ATOM 13 OG SER A 2 -11.964 32.839 -2.263 1.00 0.00 O ATOM 0 H SER A 2 -10.663 34.217 -4.173 1.00 0.00 H new ATOM 0 HA SER A 2 -8.903 34.169 -1.942 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.893 33.627 -0.693 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.358 34.777 -1.931 1.00 0.00 H new ATOM 0 HG SER A 2 -12.820 32.982 -1.807 1.00 0.00 H new ATOM 19 N SER A 3 -8.230 31.824 -1.548 1.00 0.00 N ATOM 20 CA SER A 3 -7.729 30.464 -1.381 1.00 0.00 C ATOM 21 C SER A 3 -8.257 29.846 -0.090 1.00 0.00 C ATOM 22 O SER A 3 -7.523 29.178 0.637 1.00 0.00 O ATOM 23 CB SER A 3 -6.200 30.458 -1.375 1.00 0.00 C ATOM 24 OG SER A 3 -5.683 30.858 -2.632 1.00 0.00 O ATOM 0 H SER A 3 -7.748 32.523 -0.983 1.00 0.00 H new ATOM 0 HA SER A 3 -8.084 29.867 -2.221 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.834 31.129 -0.598 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.838 29.459 -1.131 1.00 0.00 H new ATOM 0 HG SER A 3 -4.704 30.847 -2.601 1.00 0.00 H new ATOM 30 N GLY A 4 -9.537 30.074 0.189 1.00 0.00 N ATOM 31 CA GLY A 4 -10.142 29.534 1.392 1.00 0.00 C ATOM 32 C GLY A 4 -10.800 28.189 1.156 1.00 0.00 C ATOM 33 O GLY A 4 -11.909 28.117 0.627 1.00 0.00 O ATOM 0 H GLY A 4 -10.166 30.623 -0.397 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.379 29.432 2.164 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.885 30.237 1.769 1.00 0.00 H new ATOM 37 N SER A 5 -10.114 27.119 1.547 1.00 0.00 N ATOM 38 CA SER A 5 -10.636 25.769 1.369 1.00 0.00 C ATOM 39 C SER A 5 -9.896 24.779 2.264 1.00 0.00 C ATOM 40 O SER A 5 -8.681 24.871 2.438 1.00 0.00 O ATOM 41 CB SER A 5 -10.515 25.341 -0.094 1.00 0.00 C ATOM 42 OG SER A 5 -9.159 25.303 -0.504 1.00 0.00 O ATOM 0 H SER A 5 -9.196 27.161 1.989 1.00 0.00 H new ATOM 0 HA SER A 5 -11.689 25.772 1.652 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.966 24.358 -0.227 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.070 26.034 -0.726 1.00 0.00 H new ATOM 0 HG SER A 5 -9.109 25.025 -1.442 1.00 0.00 H new ATOM 48 N SER A 6 -10.638 23.832 2.828 1.00 0.00 N ATOM 49 CA SER A 6 -10.054 22.826 3.707 1.00 0.00 C ATOM 50 C SER A 6 -9.956 21.477 3.000 1.00 0.00 C ATOM 51 O SER A 6 -10.701 21.200 2.062 1.00 0.00 O ATOM 52 CB SER A 6 -10.888 22.687 4.982 1.00 0.00 C ATOM 53 OG SER A 6 -10.403 21.634 5.797 1.00 0.00 O ATOM 0 H SER A 6 -11.645 23.740 2.692 1.00 0.00 H new ATOM 0 HA SER A 6 -9.048 23.151 3.973 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.864 23.623 5.540 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.929 22.498 4.720 1.00 0.00 H new ATOM 0 HG SER A 6 -10.952 21.567 6.606 1.00 0.00 H new ATOM 59 N GLY A 7 -9.029 20.641 3.460 1.00 0.00 N ATOM 60 CA GLY A 7 -8.849 19.332 2.861 1.00 0.00 C ATOM 61 C GLY A 7 -7.695 18.567 3.476 1.00 0.00 C ATOM 62 O GLY A 7 -6.552 18.659 3.027 1.00 0.00 O ATOM 0 H GLY A 7 -8.400 20.847 4.236 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.766 18.754 2.976 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.676 19.446 1.791 1.00 0.00 H new ATOM 66 N PRO A 8 -7.988 17.792 4.530 1.00 0.00 N ATOM 67 CA PRO A 8 -6.978 16.993 5.232 1.00 0.00 C ATOM 68 C PRO A 8 -6.475 15.826 4.389 1.00 0.00 C ATOM 69 O PRO A 8 -7.213 15.270 3.578 1.00 0.00 O ATOM 70 CB PRO A 8 -7.726 16.480 6.465 1.00 0.00 C ATOM 71 CG PRO A 8 -9.161 16.477 6.064 1.00 0.00 C ATOM 72 CD PRO A 8 -9.329 17.634 5.119 1.00 0.00 C ATOM 0 HA PRO A 8 -6.088 17.576 5.469 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -7.391 15.481 6.744 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -7.557 17.125 7.327 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -9.429 15.537 5.582 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -9.809 16.586 6.933 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -10.080 17.425 4.357 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -9.647 18.536 5.641 1.00 0.00 H new ATOM 80 N GLY A 9 -5.212 15.459 4.589 1.00 0.00 N ATOM 81 CA GLY A 9 -4.632 14.359 3.840 1.00 0.00 C ATOM 82 C GLY A 9 -3.117 14.398 3.833 1.00 0.00 C ATOM 83 O GLY A 9 -2.461 13.363 3.953 1.00 0.00 O ATOM 0 H GLY A 9 -4.581 15.904 5.256 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.966 13.415 4.270 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.998 14.389 2.814 1.00 0.00 H new ATOM 87 N LEU A 10 -2.558 15.595 3.691 1.00 0.00 N ATOM 88 CA LEU A 10 -1.110 15.765 3.667 1.00 0.00 C ATOM 89 C LEU A 10 -0.554 15.906 5.081 1.00 0.00 C ATOM 90 O LEU A 10 0.495 16.516 5.289 1.00 0.00 O ATOM 91 CB LEU A 10 -0.734 16.993 2.835 1.00 0.00 C ATOM 92 CG LEU A 10 -1.458 18.292 3.191 1.00 0.00 C ATOM 93 CD1 LEU A 10 -2.731 18.436 2.370 1.00 0.00 C ATOM 94 CD2 LEU A 10 -1.773 18.337 4.679 1.00 0.00 C ATOM 0 H LEU A 10 -3.086 16.462 3.591 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.673 14.877 3.211 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.339 17.159 2.934 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.926 16.769 1.786 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.800 19.128 2.954 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.233 19.366 2.637 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.480 18.450 1.309 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.393 17.595 2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.288 19.268 4.914 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.411 17.493 4.941 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.846 18.282 5.249 1.00 0.00 H new ATOM 106 N ARG A 11 -1.264 15.336 6.050 1.00 0.00 N ATOM 107 CA ARG A 11 -0.842 15.397 7.444 1.00 0.00 C ATOM 108 C ARG A 11 -0.006 14.175 7.813 1.00 0.00 C ATOM 109 O ARG A 11 0.077 13.215 7.048 1.00 0.00 O ATOM 110 CB ARG A 11 -2.060 15.493 8.364 1.00 0.00 C ATOM 111 CG ARG A 11 -2.820 16.802 8.234 1.00 0.00 C ATOM 112 CD ARG A 11 -2.144 17.919 9.014 1.00 0.00 C ATOM 113 NE ARG A 11 -2.522 17.908 10.424 1.00 0.00 N ATOM 114 CZ ARG A 11 -1.786 18.454 11.386 1.00 0.00 C ATOM 115 NH1 ARG A 11 -0.640 19.051 11.091 1.00 0.00 N ATOM 116 NH2 ARG A 11 -2.197 18.403 12.647 1.00 0.00 N ATOM 0 H ARG A 11 -2.134 14.827 5.895 1.00 0.00 H new ATOM 0 HA ARG A 11 -0.227 16.288 7.573 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -2.736 14.667 8.145 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -1.735 15.373 9.397 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -2.889 17.081 7.183 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -3.840 16.669 8.596 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -1.062 17.818 8.928 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -2.410 18.880 8.575 1.00 0.00 H new ATOM 0 HE ARG A 11 -3.399 17.457 10.685 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -0.321 19.092 10.123 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -0.077 19.469 11.832 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -3.078 17.944 12.878 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -1.631 18.822 13.385 1.00 0.00 H new ATOM 130 N GLU A 12 0.611 14.220 8.989 1.00 0.00 N ATOM 131 CA GLU A 12 1.441 13.116 9.458 1.00 0.00 C ATOM 132 C GLU A 12 0.581 11.996 10.037 1.00 0.00 C ATOM 133 O GLU A 12 -0.026 12.150 11.098 1.00 0.00 O ATOM 134 CB GLU A 12 2.435 13.608 10.512 1.00 0.00 C ATOM 135 CG GLU A 12 3.485 12.576 10.888 1.00 0.00 C ATOM 136 CD GLU A 12 4.340 13.014 12.060 1.00 0.00 C ATOM 137 OE1 GLU A 12 3.877 12.885 13.213 1.00 0.00 O ATOM 138 OE2 GLU A 12 5.472 13.486 11.826 1.00 0.00 O ATOM 0 H GLU A 12 0.552 15.008 9.634 1.00 0.00 H new ATOM 0 HA GLU A 12 1.993 12.722 8.605 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.934 14.502 10.139 1.00 0.00 H new ATOM 0 HB3 GLU A 12 1.887 13.899 11.408 1.00 0.00 H new ATOM 0 HG2 GLU A 12 2.993 11.635 11.134 1.00 0.00 H new ATOM 0 HG3 GLU A 12 4.126 12.385 10.027 1.00 0.00 H new ATOM 145 N LEU A 13 0.533 10.871 9.333 1.00 0.00 N ATOM 146 CA LEU A 13 -0.253 9.724 9.776 1.00 0.00 C ATOM 147 C LEU A 13 0.647 8.529 10.071 1.00 0.00 C ATOM 148 O LEU A 13 1.823 8.518 9.704 1.00 0.00 O ATOM 149 CB LEU A 13 -1.286 9.348 8.712 1.00 0.00 C ATOM 150 CG LEU A 13 -2.338 10.412 8.393 1.00 0.00 C ATOM 151 CD1 LEU A 13 -1.861 11.313 7.265 1.00 0.00 C ATOM 152 CD2 LEU A 13 -3.664 9.758 8.032 1.00 0.00 C ATOM 0 H LEU A 13 1.029 10.728 8.453 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.770 10.002 10.694 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.757 9.101 7.792 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.800 8.443 9.037 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.488 11.026 9.281 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.622 12.063 7.052 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -0.936 11.808 7.561 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.682 10.714 6.372 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.401 10.529 7.808 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.529 9.120 7.158 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -4.013 9.156 8.871 1.00 0.00 H new ATOM 164 N CYS A 14 0.087 7.523 10.734 1.00 0.00 N ATOM 165 CA CYS A 14 0.839 6.321 11.078 1.00 0.00 C ATOM 166 C CYS A 14 -0.049 5.084 11.000 1.00 0.00 C ATOM 167 O CYS A 14 -1.273 5.178 11.099 1.00 0.00 O ATOM 168 CB CYS A 14 1.433 6.450 12.482 1.00 0.00 C ATOM 169 SG CYS A 14 0.243 6.963 13.742 1.00 0.00 S ATOM 0 H CYS A 14 -0.885 7.516 11.044 1.00 0.00 H new ATOM 0 HA CYS A 14 1.649 6.210 10.358 1.00 0.00 H new ATOM 0 HB2 CYS A 14 1.863 5.491 12.772 1.00 0.00 H new ATOM 0 HB3 CYS A 14 2.250 7.171 12.454 1.00 0.00 H new ATOM 0 HG CYS A 14 0.839 7.042 14.895 1.00 0.00 H new ATOM 175 N ILE A 15 0.575 3.925 10.819 1.00 0.00 N ATOM 176 CA ILE A 15 -0.159 2.669 10.726 1.00 0.00 C ATOM 177 C ILE A 15 0.295 1.686 11.801 1.00 0.00 C ATOM 178 O ILE A 15 1.401 1.149 11.737 1.00 0.00 O ATOM 179 CB ILE A 15 0.015 2.015 9.342 1.00 0.00 C ATOM 180 CG1 ILE A 15 -0.653 2.870 8.263 1.00 0.00 C ATOM 181 CG2 ILE A 15 -0.562 0.608 9.345 1.00 0.00 C ATOM 182 CD1 ILE A 15 -0.323 2.429 6.854 1.00 0.00 C ATOM 0 H ILE A 15 1.587 3.830 10.734 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.212 2.908 10.876 1.00 0.00 H new ATOM 0 HB ILE A 15 1.080 1.948 9.118 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.734 2.837 8.402 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.346 3.908 8.392 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.432 0.159 8.360 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.045 0.004 10.091 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -1.624 0.651 9.586 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.830 3.079 6.141 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.754 2.489 6.697 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.655 1.401 6.707 1.00 0.00 H new ATOM 194 N GLN A 16 -0.567 1.455 12.786 1.00 0.00 N ATOM 195 CA GLN A 16 -0.254 0.536 13.873 1.00 0.00 C ATOM 196 C GLN A 16 -0.461 -0.911 13.439 1.00 0.00 C ATOM 197 O GLN A 16 -1.571 -1.314 13.090 1.00 0.00 O ATOM 198 CB GLN A 16 -1.123 0.844 15.095 1.00 0.00 C ATOM 199 CG GLN A 16 -0.481 1.821 16.067 1.00 0.00 C ATOM 200 CD GLN A 16 -1.503 2.606 16.865 1.00 0.00 C ATOM 201 OE1 GLN A 16 -1.930 2.179 17.939 1.00 0.00 O ATOM 202 NE2 GLN A 16 -1.902 3.760 16.345 1.00 0.00 N ATOM 0 H GLN A 16 -1.487 1.891 12.853 1.00 0.00 H new ATOM 0 HA GLN A 16 0.795 0.670 14.138 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.076 1.252 14.759 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.341 -0.086 15.619 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.167 1.274 16.752 1.00 0.00 H new ATOM 0 HG3 GLN A 16 0.153 2.514 15.514 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.522 4.076 15.453 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.588 4.331 16.838 1.00 0.00 H new ATOM 211 N LYS A 17 0.615 -1.690 13.463 1.00 0.00 N ATOM 212 CA LYS A 17 0.552 -3.094 13.073 1.00 0.00 C ATOM 213 C LYS A 17 1.176 -3.984 14.143 1.00 0.00 C ATOM 214 O LYS A 17 1.793 -3.495 15.089 1.00 0.00 O ATOM 215 CB LYS A 17 1.268 -3.306 11.738 1.00 0.00 C ATOM 216 CG LYS A 17 2.746 -3.627 11.883 1.00 0.00 C ATOM 217 CD LYS A 17 3.545 -3.128 10.691 1.00 0.00 C ATOM 218 CE LYS A 17 3.845 -1.641 10.803 1.00 0.00 C ATOM 219 NZ LYS A 17 5.110 -1.385 11.545 1.00 0.00 N ATOM 0 H LYS A 17 1.541 -1.373 13.748 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.497 -3.368 12.963 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.780 -4.118 11.199 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.158 -2.408 11.130 1.00 0.00 H new ATOM 0 HG2 LYS A 17 3.130 -3.172 12.796 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.877 -4.704 11.985 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.480 -3.684 10.620 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.989 -3.320 9.773 1.00 0.00 H new ATOM 0 HE2 LYS A 17 3.916 -1.209 9.805 1.00 0.00 H new ATOM 0 HE3 LYS A 17 3.019 -1.141 11.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 5.219 -0.363 11.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.080 -1.876 12.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.916 -1.737 10.989 1.00 0.00 H new ATOM 233 N ALA A 18 1.013 -5.294 13.986 1.00 0.00 N ATOM 234 CA ALA A 18 1.564 -6.252 14.937 1.00 0.00 C ATOM 235 C ALA A 18 3.035 -5.963 15.217 1.00 0.00 C ATOM 236 O ALA A 18 3.680 -5.174 14.528 1.00 0.00 O ATOM 237 CB ALA A 18 1.392 -7.671 14.416 1.00 0.00 C ATOM 0 H ALA A 18 0.504 -5.716 13.209 1.00 0.00 H new ATOM 0 HA ALA A 18 1.017 -6.152 15.874 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.808 -8.376 15.136 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.332 -7.880 14.274 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.913 -7.775 13.464 1.00 0.00 H new ATOM 243 N PRO A 19 3.580 -6.617 16.254 1.00 0.00 N ATOM 244 CA PRO A 19 4.981 -6.447 16.650 1.00 0.00 C ATOM 245 C PRO A 19 5.947 -7.050 15.635 1.00 0.00 C ATOM 246 O PRO A 19 7.160 -7.043 15.839 1.00 0.00 O ATOM 247 CB PRO A 19 5.067 -7.196 17.982 1.00 0.00 C ATOM 248 CG PRO A 19 3.975 -8.207 17.919 1.00 0.00 C ATOM 249 CD PRO A 19 2.870 -7.573 17.120 1.00 0.00 C ATOM 0 HA PRO A 19 5.261 -5.396 16.719 1.00 0.00 H new ATOM 0 HB2 PRO A 19 6.040 -7.671 18.107 1.00 0.00 H new ATOM 0 HB3 PRO A 19 4.932 -6.520 18.826 1.00 0.00 H new ATOM 0 HG2 PRO A 19 4.321 -9.126 17.446 1.00 0.00 H new ATOM 0 HG3 PRO A 19 3.631 -8.473 18.919 1.00 0.00 H new ATOM 0 HD2 PRO A 19 2.321 -8.312 16.537 1.00 0.00 H new ATOM 0 HD3 PRO A 19 2.146 -7.072 17.763 1.00 0.00 H new ATOM 257 N GLY A 20 5.400 -7.572 14.542 1.00 0.00 N ATOM 258 CA GLY A 20 6.228 -8.172 13.512 1.00 0.00 C ATOM 259 C GLY A 20 5.444 -8.501 12.257 1.00 0.00 C ATOM 260 O GLY A 20 5.720 -9.498 11.590 1.00 0.00 O ATOM 0 H GLY A 20 4.398 -7.590 14.351 1.00 0.00 H new ATOM 0 HA2 GLY A 20 7.041 -7.491 13.261 1.00 0.00 H new ATOM 0 HA3 GLY A 20 6.684 -9.082 13.901 1.00 0.00 H new ATOM 264 N GLU A 21 4.464 -7.662 11.935 1.00 0.00 N ATOM 265 CA GLU A 21 3.637 -7.872 10.753 1.00 0.00 C ATOM 266 C GLU A 21 4.036 -6.915 9.633 1.00 0.00 C ATOM 267 O GLU A 21 4.159 -5.709 9.849 1.00 0.00 O ATOM 268 CB GLU A 21 2.159 -7.684 11.097 1.00 0.00 C ATOM 269 CG GLU A 21 1.229 -7.869 9.910 1.00 0.00 C ATOM 270 CD GLU A 21 1.345 -9.246 9.286 1.00 0.00 C ATOM 271 OE1 GLU A 21 1.794 -10.178 9.984 1.00 0.00 O ATOM 272 OE2 GLU A 21 0.988 -9.390 8.098 1.00 0.00 O ATOM 0 H GLU A 21 4.224 -6.831 12.476 1.00 0.00 H new ATOM 0 HA GLU A 21 3.795 -8.894 10.408 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.883 -8.393 11.878 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.015 -6.685 11.508 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.200 -7.705 10.231 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.452 -7.113 9.157 1.00 0.00 H new ATOM 279 N ARG A 22 4.236 -7.461 8.439 1.00 0.00 N ATOM 280 CA ARG A 22 4.622 -6.656 7.286 1.00 0.00 C ATOM 281 C ARG A 22 3.407 -5.962 6.676 1.00 0.00 C ATOM 282 O ARG A 22 2.479 -6.617 6.200 1.00 0.00 O ATOM 283 CB ARG A 22 5.305 -7.531 6.233 1.00 0.00 C ATOM 284 CG ARG A 22 4.449 -8.693 5.758 1.00 0.00 C ATOM 285 CD ARG A 22 5.302 -9.893 5.376 1.00 0.00 C ATOM 286 NE ARG A 22 4.538 -11.138 5.403 1.00 0.00 N ATOM 287 CZ ARG A 22 4.326 -11.846 6.506 1.00 0.00 C ATOM 288 NH1 ARG A 22 4.816 -11.435 7.667 1.00 0.00 N ATOM 289 NH2 ARG A 22 3.620 -12.969 6.450 1.00 0.00 N ATOM 0 H ARG A 22 4.137 -8.457 8.244 1.00 0.00 H new ATOM 0 HA ARG A 22 5.323 -5.893 7.625 1.00 0.00 H new ATOM 0 HB2 ARG A 22 5.571 -6.912 5.376 1.00 0.00 H new ATOM 0 HB3 ARG A 22 6.236 -7.921 6.645 1.00 0.00 H new ATOM 0 HG2 ARG A 22 3.750 -8.977 6.545 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.853 -8.381 4.900 1.00 0.00 H new ATOM 0 HD2 ARG A 22 5.714 -9.742 4.378 1.00 0.00 H new ATOM 0 HD3 ARG A 22 6.146 -9.971 6.061 1.00 0.00 H new ATOM 0 HE ARG A 22 4.146 -11.482 4.526 1.00 0.00 H new ATOM 0 HH11 ARG A 22 5.358 -10.572 7.715 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.651 -11.981 8.512 1.00 0.00 H new ATOM 0 HH21 ARG A 22 3.240 -13.289 5.559 1.00 0.00 H new ATOM 0 HH22 ARG A 22 3.458 -13.512 7.298 1.00 0.00 H new ATOM 303 N LEU A 23 3.420 -4.634 6.694 1.00 0.00 N ATOM 304 CA LEU A 23 2.320 -3.851 6.143 1.00 0.00 C ATOM 305 C LEU A 23 1.697 -4.556 4.943 1.00 0.00 C ATOM 306 O LEU A 23 0.481 -4.730 4.875 1.00 0.00 O ATOM 307 CB LEU A 23 2.812 -2.461 5.734 1.00 0.00 C ATOM 308 CG LEU A 23 1.888 -1.293 6.079 1.00 0.00 C ATOM 309 CD1 LEU A 23 2.296 -0.663 7.401 1.00 0.00 C ATOM 310 CD2 LEU A 23 1.901 -0.256 4.965 1.00 0.00 C ATOM 0 H LEU A 23 4.180 -4.077 7.084 1.00 0.00 H new ATOM 0 HA LEU A 23 1.558 -3.747 6.915 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.778 -2.286 6.207 1.00 0.00 H new ATOM 0 HB3 LEU A 23 2.980 -2.459 4.657 1.00 0.00 H new ATOM 0 HG LEU A 23 0.872 -1.675 6.180 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.627 0.167 7.630 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.234 -1.409 8.194 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.319 -0.295 7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.238 0.568 5.227 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.915 0.122 4.832 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.560 -0.715 4.037 1.00 0.00 H new ATOM 322 N GLY A 24 2.539 -4.962 3.998 1.00 0.00 N ATOM 323 CA GLY A 24 2.053 -5.646 2.814 1.00 0.00 C ATOM 324 C GLY A 24 1.443 -4.694 1.804 1.00 0.00 C ATOM 325 O GLY A 24 0.351 -4.939 1.291 1.00 0.00 O ATOM 0 H GLY A 24 3.550 -4.829 4.031 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.876 -6.187 2.347 1.00 0.00 H new ATOM 0 HA3 GLY A 24 1.309 -6.387 3.106 1.00 0.00 H new ATOM 329 N ILE A 25 2.149 -3.605 1.520 1.00 0.00 N ATOM 330 CA ILE A 25 1.670 -2.613 0.565 1.00 0.00 C ATOM 331 C ILE A 25 2.540 -2.589 -0.687 1.00 0.00 C ATOM 332 O ILE A 25 3.695 -3.016 -0.661 1.00 0.00 O ATOM 333 CB ILE A 25 1.642 -1.203 1.184 1.00 0.00 C ATOM 334 CG1 ILE A 25 2.872 -0.987 2.069 1.00 0.00 C ATOM 335 CG2 ILE A 25 0.364 -1.001 1.985 1.00 0.00 C ATOM 336 CD1 ILE A 25 3.221 0.471 2.272 1.00 0.00 C ATOM 0 H ILE A 25 3.054 -3.387 1.937 1.00 0.00 H new ATOM 0 HA ILE A 25 0.655 -2.902 0.293 1.00 0.00 H new ATOM 0 HB ILE A 25 1.663 -0.468 0.379 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.696 -1.449 3.041 1.00 0.00 H new ATOM 0 HG13 ILE A 25 3.725 -1.498 1.623 1.00 0.00 H new ATOM 0 HG21 ILE A 25 0.359 0.000 2.416 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.499 -1.118 1.329 1.00 0.00 H new ATOM 0 HG23 ILE A 25 0.315 -1.740 2.784 1.00 0.00 H new ATOM 0 HD11 ILE A 25 4.102 0.549 2.909 1.00 0.00 H new ATOM 0 HD12 ILE A 25 3.429 0.933 1.307 1.00 0.00 H new ATOM 0 HD13 ILE A 25 2.384 0.983 2.747 1.00 0.00 H new ATOM 348 N SER A 26 1.979 -2.086 -1.782 1.00 0.00 N ATOM 349 CA SER A 26 2.704 -2.008 -3.045 1.00 0.00 C ATOM 350 C SER A 26 2.706 -0.580 -3.583 1.00 0.00 C ATOM 351 O SER A 26 1.675 0.094 -3.587 1.00 0.00 O ATOM 352 CB SER A 26 2.079 -2.952 -4.074 1.00 0.00 C ATOM 353 OG SER A 26 2.672 -4.238 -4.012 1.00 0.00 O ATOM 0 H SER A 26 1.025 -1.727 -1.820 1.00 0.00 H new ATOM 0 HA SER A 26 3.735 -2.311 -2.864 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.007 -3.033 -3.894 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.204 -2.538 -5.075 1.00 0.00 H new ATOM 0 HG SER A 26 2.503 -4.717 -4.850 1.00 0.00 H new ATOM 359 N ILE A 27 3.870 -0.127 -4.036 1.00 0.00 N ATOM 360 CA ILE A 27 4.006 1.219 -4.577 1.00 0.00 C ATOM 361 C ILE A 27 4.634 1.192 -5.966 1.00 0.00 C ATOM 362 O ILE A 27 5.228 0.193 -6.371 1.00 0.00 O ATOM 363 CB ILE A 27 4.860 2.112 -3.657 1.00 0.00 C ATOM 364 CG1 ILE A 27 6.308 1.618 -3.632 1.00 0.00 C ATOM 365 CG2 ILE A 27 4.278 2.135 -2.252 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.237 2.509 -2.837 1.00 0.00 C ATOM 0 H ILE A 27 4.732 -0.672 -4.039 1.00 0.00 H new ATOM 0 HA ILE A 27 3.001 1.636 -4.643 1.00 0.00 H new ATOM 0 HB ILE A 27 4.849 3.129 -4.050 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.333 0.613 -3.211 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.676 1.544 -4.655 1.00 0.00 H new ATOM 0 HG21 ILE A 27 4.893 2.770 -1.614 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.262 2.529 -2.285 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.262 1.123 -1.848 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.246 2.098 -2.863 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.242 3.509 -3.271 1.00 0.00 H new ATOM 0 HD13 ILE A 27 6.894 2.563 -1.804 1.00 0.00 H new ATOM 378 N ARG A 28 4.500 2.298 -6.692 1.00 0.00 N ATOM 379 CA ARG A 28 5.055 2.401 -8.036 1.00 0.00 C ATOM 380 C ARG A 28 5.742 3.748 -8.238 1.00 0.00 C ATOM 381 O ARG A 28 5.143 4.801 -8.023 1.00 0.00 O ATOM 382 CB ARG A 28 3.953 2.217 -9.081 1.00 0.00 C ATOM 383 CG ARG A 28 3.022 3.411 -9.201 1.00 0.00 C ATOM 384 CD ARG A 28 1.934 3.168 -10.236 1.00 0.00 C ATOM 385 NE ARG A 28 0.716 3.916 -9.936 1.00 0.00 N ATOM 386 CZ ARG A 28 -0.331 3.973 -10.751 1.00 0.00 C ATOM 387 NH1 ARG A 28 -0.309 3.329 -11.910 1.00 0.00 N ATOM 388 NH2 ARG A 28 -1.404 4.675 -10.408 1.00 0.00 N ATOM 0 H ARG A 28 4.012 3.135 -6.372 1.00 0.00 H new ATOM 0 HA ARG A 28 5.797 1.612 -8.157 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.412 2.026 -10.051 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.367 1.334 -8.827 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.565 3.616 -8.233 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.597 4.295 -9.476 1.00 0.00 H new ATOM 0 HD2 ARG A 28 2.301 3.454 -11.222 1.00 0.00 H new ATOM 0 HD3 ARG A 28 1.705 2.103 -10.278 1.00 0.00 H new ATOM 0 HE ARG A 28 0.667 4.422 -9.052 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.513 2.788 -12.177 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.115 3.374 -12.534 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.425 5.172 -9.517 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.207 4.718 -11.035 1.00 0.00 H new ATOM 402 N GLY A 29 7.005 3.706 -8.653 1.00 0.00 N ATOM 403 CA GLY A 29 7.753 4.930 -8.877 1.00 0.00 C ATOM 404 C GLY A 29 9.249 4.728 -8.739 1.00 0.00 C ATOM 405 O GLY A 29 9.777 3.678 -9.103 1.00 0.00 O ATOM 0 H GLY A 29 7.523 2.847 -8.838 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.531 5.311 -9.874 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.425 5.688 -8.166 1.00 0.00 H new ATOM 409 N GLY A 30 9.935 5.738 -8.212 1.00 0.00 N ATOM 410 CA GLY A 30 11.373 5.647 -8.038 1.00 0.00 C ATOM 411 C GLY A 30 12.127 6.620 -8.922 1.00 0.00 C ATOM 412 O GLY A 30 11.611 7.066 -9.947 1.00 0.00 O ATOM 0 H GLY A 30 9.521 6.617 -7.903 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.623 5.841 -6.995 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.699 4.631 -8.261 1.00 0.00 H new ATOM 416 N ALA A 31 13.351 6.953 -8.524 1.00 0.00 N ATOM 417 CA ALA A 31 14.176 7.881 -9.287 1.00 0.00 C ATOM 418 C ALA A 31 14.609 7.265 -10.614 1.00 0.00 C ATOM 419 O ALA A 31 15.219 7.934 -11.449 1.00 0.00 O ATOM 420 CB ALA A 31 15.393 8.296 -8.474 1.00 0.00 C ATOM 0 H ALA A 31 13.793 6.594 -7.678 1.00 0.00 H new ATOM 0 HA ALA A 31 13.579 8.767 -9.504 1.00 0.00 H new ATOM 0 HB1 ALA A 31 16.000 8.989 -9.056 1.00 0.00 H new ATOM 0 HB2 ALA A 31 15.068 8.783 -7.555 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.984 7.414 -8.228 1.00 0.00 H new ATOM 426 N ARG A 32 14.290 5.989 -10.801 1.00 0.00 N ATOM 427 CA ARG A 32 14.648 5.284 -12.026 1.00 0.00 C ATOM 428 C ARG A 32 13.456 4.502 -12.571 1.00 0.00 C ATOM 429 O ARG A 32 13.243 4.440 -13.781 1.00 0.00 O ATOM 430 CB ARG A 32 15.819 4.334 -11.769 1.00 0.00 C ATOM 431 CG ARG A 32 17.164 5.036 -11.677 1.00 0.00 C ATOM 432 CD ARG A 32 17.626 5.536 -13.038 1.00 0.00 C ATOM 433 NE ARG A 32 18.411 4.533 -13.751 1.00 0.00 N ATOM 434 CZ ARG A 32 19.288 4.828 -14.705 1.00 0.00 C ATOM 435 NH1 ARG A 32 19.490 6.090 -15.057 1.00 0.00 N ATOM 436 NH2 ARG A 32 19.965 3.860 -15.308 1.00 0.00 N ATOM 0 H ARG A 32 13.784 5.422 -10.120 1.00 0.00 H new ATOM 0 HA ARG A 32 14.946 6.025 -12.768 1.00 0.00 H new ATOM 0 HB2 ARG A 32 15.638 3.791 -10.842 1.00 0.00 H new ATOM 0 HB3 ARG A 32 15.858 3.595 -12.569 1.00 0.00 H new ATOM 0 HG2 ARG A 32 17.091 5.875 -10.985 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.906 4.350 -11.269 1.00 0.00 H new ATOM 0 HD2 ARG A 32 16.758 5.810 -13.637 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.223 6.439 -12.909 1.00 0.00 H new ATOM 0 HE ARG A 32 18.279 3.552 -13.504 1.00 0.00 H new ATOM 0 HH11 ARG A 32 18.972 6.837 -14.595 1.00 0.00 H new ATOM 0 HH12 ARG A 32 20.164 6.314 -15.789 1.00 0.00 H new ATOM 0 HH21 ARG A 32 19.813 2.888 -15.040 1.00 0.00 H new ATOM 0 HH22 ARG A 32 20.638 4.088 -16.040 1.00 0.00 H new ATOM 450 N GLY A 33 12.681 3.908 -11.669 1.00 0.00 N ATOM 451 CA GLY A 33 11.521 3.138 -12.079 1.00 0.00 C ATOM 452 C GLY A 33 10.669 3.871 -13.095 1.00 0.00 C ATOM 453 O GLY A 33 10.389 5.060 -12.939 1.00 0.00 O ATOM 0 H GLY A 33 12.836 3.946 -10.662 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.850 2.189 -12.502 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.916 2.904 -11.203 1.00 0.00 H new ATOM 457 N HIS A 34 10.256 3.162 -14.141 1.00 0.00 N ATOM 458 CA HIS A 34 9.430 3.753 -15.188 1.00 0.00 C ATOM 459 C HIS A 34 8.473 4.788 -14.606 1.00 0.00 C ATOM 460 O HIS A 34 7.577 4.453 -13.832 1.00 0.00 O ATOM 461 CB HIS A 34 8.642 2.667 -15.920 1.00 0.00 C ATOM 462 CG HIS A 34 9.422 1.988 -17.003 1.00 0.00 C ATOM 463 ND1 HIS A 34 10.519 1.191 -16.754 1.00 0.00 N ATOM 464 CD2 HIS A 34 9.257 1.989 -18.347 1.00 0.00 C ATOM 465 CE1 HIS A 34 10.996 0.732 -17.898 1.00 0.00 C ATOM 466 NE2 HIS A 34 10.247 1.202 -18.880 1.00 0.00 N ATOM 0 H HIS A 34 10.480 2.177 -14.286 1.00 0.00 H new ATOM 0 HA HIS A 34 10.090 4.253 -15.897 1.00 0.00 H new ATOM 0 HB2 HIS A 34 8.312 1.920 -15.198 1.00 0.00 H new ATOM 0 HB3 HIS A 34 7.745 3.110 -16.353 1.00 0.00 H new ATOM 0 HD2 HIS A 34 8.489 2.512 -18.897 1.00 0.00 H new ATOM 0 HE1 HIS A 34 11.852 0.083 -18.011 1.00 0.00 H new ATOM 0 HE2 HIS A 34 10.383 1.011 -19.873 1.00 0.00 H new ATOM 475 N ALA A 35 8.670 6.048 -14.982 1.00 0.00 N ATOM 476 CA ALA A 35 7.823 7.131 -14.498 1.00 0.00 C ATOM 477 C ALA A 35 6.377 6.672 -14.346 1.00 0.00 C ATOM 478 O ALA A 35 5.702 6.379 -15.332 1.00 0.00 O ATOM 479 CB ALA A 35 7.904 8.324 -15.439 1.00 0.00 C ATOM 0 H ALA A 35 9.409 6.343 -15.620 1.00 0.00 H new ATOM 0 HA ALA A 35 8.186 7.431 -13.515 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.267 9.126 -15.066 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.934 8.675 -15.493 1.00 0.00 H new ATOM 0 HB3 ALA A 35 7.569 8.027 -16.433 1.00 0.00 H new ATOM 485 N GLY A 36 5.908 6.610 -13.104 1.00 0.00 N ATOM 486 CA GLY A 36 4.545 6.185 -12.846 1.00 0.00 C ATOM 487 C GLY A 36 3.546 6.842 -13.777 1.00 0.00 C ATOM 488 O GLY A 36 2.703 6.170 -14.369 1.00 0.00 O ATOM 0 H GLY A 36 6.448 6.847 -12.272 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.479 5.102 -12.953 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.284 6.420 -11.814 1.00 0.00 H new ATOM 492 N ASN A 37 3.640 8.162 -13.907 1.00 0.00 N ATOM 493 CA ASN A 37 2.735 8.911 -14.771 1.00 0.00 C ATOM 494 C ASN A 37 3.290 9.003 -16.190 1.00 0.00 C ATOM 495 O ASN A 37 4.421 9.435 -16.414 1.00 0.00 O ATOM 496 CB ASN A 37 2.507 10.316 -14.209 1.00 0.00 C ATOM 497 CG ASN A 37 1.171 10.897 -14.632 1.00 0.00 C ATOM 498 OD1 ASN A 37 0.150 10.210 -14.616 1.00 0.00 O ATOM 499 ND2 ASN A 37 1.173 12.169 -15.013 1.00 0.00 N ATOM 0 H ASN A 37 4.333 8.734 -13.425 1.00 0.00 H new ATOM 0 HA ASN A 37 1.783 8.381 -14.805 1.00 0.00 H new ATOM 0 HB2 ASN A 37 2.557 10.282 -13.121 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.309 10.973 -14.545 1.00 0.00 H new ATOM 0 HD21 ASN A 37 0.304 12.614 -15.308 1.00 0.00 H new ATOM 0 HD22 ASN A 37 2.043 12.701 -15.010 1.00 0.00 H new ATOM 506 N PRO A 38 2.476 8.587 -17.171 1.00 0.00 N ATOM 507 CA PRO A 38 2.863 8.613 -18.585 1.00 0.00 C ATOM 508 C PRO A 38 2.959 10.032 -19.133 1.00 0.00 C ATOM 509 O PRO A 38 3.755 10.308 -20.031 1.00 0.00 O ATOM 510 CB PRO A 38 1.732 7.848 -19.276 1.00 0.00 C ATOM 511 CG PRO A 38 0.558 8.008 -18.372 1.00 0.00 C ATOM 512 CD PRO A 38 1.115 8.059 -16.976 1.00 0.00 C ATOM 0 HA PRO A 38 3.850 8.179 -18.746 1.00 0.00 H new ATOM 0 HB2 PRO A 38 1.527 8.254 -20.267 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.989 6.797 -19.409 1.00 0.00 H new ATOM 0 HG2 PRO A 38 0.007 8.919 -18.606 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.138 7.176 -18.485 1.00 0.00 H new ATOM 0 HD2 PRO A 38 0.522 8.706 -16.330 1.00 0.00 H new ATOM 0 HD3 PRO A 38 1.129 7.072 -16.513 1.00 0.00 H new ATOM 520 N ARG A 39 2.144 10.929 -18.588 1.00 0.00 N ATOM 521 CA ARG A 39 2.137 12.320 -19.024 1.00 0.00 C ATOM 522 C ARG A 39 3.561 12.845 -19.190 1.00 0.00 C ATOM 523 O ARG A 39 4.015 13.092 -20.307 1.00 0.00 O ATOM 524 CB ARG A 39 1.377 13.188 -18.019 1.00 0.00 C ATOM 525 CG ARG A 39 -0.111 12.883 -17.955 1.00 0.00 C ATOM 526 CD ARG A 39 -0.876 13.988 -17.245 1.00 0.00 C ATOM 527 NE ARG A 39 -2.314 13.901 -17.486 1.00 0.00 N ATOM 528 CZ ARG A 39 -3.215 14.623 -16.829 1.00 0.00 C ATOM 529 NH1 ARG A 39 -2.828 15.481 -15.895 1.00 0.00 N ATOM 530 NH2 ARG A 39 -4.505 14.488 -17.106 1.00 0.00 N ATOM 0 H ARG A 39 1.480 10.717 -17.843 1.00 0.00 H new ATOM 0 HA ARG A 39 1.634 12.369 -19.990 1.00 0.00 H new ATOM 0 HB2 ARG A 39 1.811 13.048 -17.029 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.513 14.237 -18.281 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -0.502 12.759 -18.965 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -0.268 11.938 -17.435 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -0.684 13.931 -16.174 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.510 14.957 -17.583 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.645 13.250 -18.198 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -1.837 15.588 -15.680 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -3.522 16.034 -15.392 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -4.806 13.829 -17.824 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.196 15.043 -16.601 1.00 0.00 H new ATOM 544 N ASP A 40 4.258 13.012 -18.072 1.00 0.00 N ATOM 545 CA ASP A 40 5.630 13.507 -18.093 1.00 0.00 C ATOM 546 C ASP A 40 6.599 12.442 -17.589 1.00 0.00 C ATOM 547 O ASP A 40 6.516 11.981 -16.451 1.00 0.00 O ATOM 548 CB ASP A 40 5.752 14.771 -17.240 1.00 0.00 C ATOM 549 CG ASP A 40 5.354 16.022 -17.998 1.00 0.00 C ATOM 550 OD1 ASP A 40 5.517 16.043 -19.236 1.00 0.00 O ATOM 551 OD2 ASP A 40 4.878 16.979 -17.353 1.00 0.00 O ATOM 0 H ASP A 40 3.896 12.812 -17.140 1.00 0.00 H new ATOM 0 HA ASP A 40 5.888 13.748 -19.124 1.00 0.00 H new ATOM 0 HB2 ASP A 40 5.124 14.671 -16.355 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.780 14.873 -16.891 1.00 0.00 H new ATOM 556 N PRO A 41 7.540 12.041 -18.456 1.00 0.00 N ATOM 557 CA PRO A 41 8.543 11.026 -18.122 1.00 0.00 C ATOM 558 C PRO A 41 9.559 11.528 -17.101 1.00 0.00 C ATOM 559 O PRO A 41 10.256 10.739 -16.462 1.00 0.00 O ATOM 560 CB PRO A 41 9.227 10.747 -19.463 1.00 0.00 C ATOM 561 CG PRO A 41 9.030 11.993 -20.254 1.00 0.00 C ATOM 562 CD PRO A 41 7.699 12.548 -19.830 1.00 0.00 C ATOM 0 HA PRO A 41 8.093 10.144 -17.666 1.00 0.00 H new ATOM 0 HB2 PRO A 41 10.286 10.526 -19.329 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.783 9.886 -19.963 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.830 12.708 -20.061 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.042 11.782 -21.323 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.690 13.638 -19.860 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.895 12.205 -20.481 1.00 0.00 H new ATOM 570 N THR A 42 9.637 12.846 -16.950 1.00 0.00 N ATOM 571 CA THR A 42 10.568 13.454 -16.008 1.00 0.00 C ATOM 572 C THR A 42 9.937 13.597 -14.627 1.00 0.00 C ATOM 573 O THR A 42 10.094 14.623 -13.966 1.00 0.00 O ATOM 574 CB THR A 42 11.034 14.840 -16.493 1.00 0.00 C ATOM 575 OG1 THR A 42 9.900 15.661 -16.793 1.00 0.00 O ATOM 576 CG2 THR A 42 11.916 14.713 -17.726 1.00 0.00 C ATOM 0 H THR A 42 9.066 13.513 -17.469 1.00 0.00 H new ATOM 0 HA THR A 42 11.431 12.791 -15.944 1.00 0.00 H new ATOM 0 HB THR A 42 11.616 15.303 -15.696 1.00 0.00 H new ATOM 0 HG1 THR A 42 10.205 16.541 -17.099 1.00 0.00 H new ATOM 0 HG21 THR A 42 12.233 15.704 -18.050 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.793 14.112 -17.486 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.355 14.231 -18.527 1.00 0.00 H new ATOM 584 N ASP A 43 9.224 12.562 -14.198 1.00 0.00 N ATOM 585 CA ASP A 43 8.570 12.572 -12.894 1.00 0.00 C ATOM 586 C ASP A 43 8.901 11.305 -12.111 1.00 0.00 C ATOM 587 O ASP A 43 8.376 10.230 -12.402 1.00 0.00 O ATOM 588 CB ASP A 43 7.055 12.703 -13.061 1.00 0.00 C ATOM 589 CG ASP A 43 6.323 12.675 -11.733 1.00 0.00 C ATOM 590 OD1 ASP A 43 6.013 11.566 -11.250 1.00 0.00 O ATOM 591 OD2 ASP A 43 6.058 13.762 -11.178 1.00 0.00 O ATOM 0 H ASP A 43 9.084 11.705 -14.734 1.00 0.00 H new ATOM 0 HA ASP A 43 8.941 13.431 -12.334 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.828 13.635 -13.578 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.690 11.892 -13.691 1.00 0.00 H new ATOM 596 N GLU A 44 9.774 11.440 -11.119 1.00 0.00 N ATOM 597 CA GLU A 44 10.176 10.305 -10.296 1.00 0.00 C ATOM 598 C GLU A 44 9.238 10.138 -9.104 1.00 0.00 C ATOM 599 O GLU A 44 9.629 9.618 -8.060 1.00 0.00 O ATOM 600 CB GLU A 44 11.614 10.486 -9.805 1.00 0.00 C ATOM 601 CG GLU A 44 12.642 10.498 -10.925 1.00 0.00 C ATOM 602 CD GLU A 44 12.511 11.713 -11.823 1.00 0.00 C ATOM 603 OE1 GLU A 44 12.621 12.845 -11.310 1.00 0.00 O ATOM 604 OE2 GLU A 44 12.299 11.529 -13.040 1.00 0.00 O ATOM 0 H GLU A 44 10.217 12.323 -10.865 1.00 0.00 H new ATOM 0 HA GLU A 44 10.120 9.406 -10.910 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.684 11.421 -9.249 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.856 9.682 -9.110 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.643 10.475 -10.495 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.532 9.594 -11.524 1.00 0.00 H new ATOM 611 N GLY A 45 7.996 10.585 -9.268 1.00 0.00 N ATOM 612 CA GLY A 45 7.021 10.478 -8.199 1.00 0.00 C ATOM 613 C GLY A 45 6.732 9.039 -7.821 1.00 0.00 C ATOM 614 O GLY A 45 6.833 8.139 -8.655 1.00 0.00 O ATOM 0 H GLY A 45 7.648 11.019 -10.123 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.386 11.014 -7.323 1.00 0.00 H new ATOM 0 HA3 GLY A 45 6.094 10.963 -8.506 1.00 0.00 H new ATOM 618 N ILE A 46 6.372 8.820 -6.560 1.00 0.00 N ATOM 619 CA ILE A 46 6.068 7.480 -6.074 1.00 0.00 C ATOM 620 C ILE A 46 4.688 7.431 -5.427 1.00 0.00 C ATOM 621 O ILE A 46 4.437 8.099 -4.424 1.00 0.00 O ATOM 622 CB ILE A 46 7.118 6.999 -5.056 1.00 0.00 C ATOM 623 CG1 ILE A 46 8.516 7.033 -5.677 1.00 0.00 C ATOM 624 CG2 ILE A 46 6.782 5.596 -4.572 1.00 0.00 C ATOM 625 CD1 ILE A 46 9.629 7.110 -4.656 1.00 0.00 C ATOM 0 H ILE A 46 6.284 9.554 -5.857 1.00 0.00 H new ATOM 0 HA ILE A 46 6.085 6.818 -6.940 1.00 0.00 H new ATOM 0 HB ILE A 46 7.106 7.672 -4.198 1.00 0.00 H new ATOM 0 HG12 ILE A 46 8.655 6.141 -6.288 1.00 0.00 H new ATOM 0 HG13 ILE A 46 8.587 7.891 -6.345 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.533 5.270 -3.853 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.802 5.600 -4.096 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.770 4.912 -5.420 1.00 0.00 H new ATOM 0 HD11 ILE A 46 10.591 7.131 -5.168 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.515 8.016 -4.061 1.00 0.00 H new ATOM 0 HD13 ILE A 46 9.584 6.239 -4.002 1.00 0.00 H new ATOM 637 N PHE A 47 3.797 6.633 -6.006 1.00 0.00 N ATOM 638 CA PHE A 47 2.442 6.494 -5.485 1.00 0.00 C ATOM 639 C PHE A 47 2.078 5.024 -5.301 1.00 0.00 C ATOM 640 O PHE A 47 2.624 4.149 -5.974 1.00 0.00 O ATOM 641 CB PHE A 47 1.440 7.165 -6.427 1.00 0.00 C ATOM 642 CG PHE A 47 1.782 8.592 -6.748 1.00 0.00 C ATOM 643 CD1 PHE A 47 2.971 8.907 -7.387 1.00 0.00 C ATOM 644 CD2 PHE A 47 0.915 9.619 -6.410 1.00 0.00 C ATOM 645 CE1 PHE A 47 3.288 10.219 -7.685 1.00 0.00 C ATOM 646 CE2 PHE A 47 1.227 10.933 -6.706 1.00 0.00 C ATOM 647 CZ PHE A 47 2.416 11.233 -7.342 1.00 0.00 C ATOM 0 H PHE A 47 3.989 6.073 -6.836 1.00 0.00 H new ATOM 0 HA PHE A 47 2.401 6.984 -4.512 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.387 6.595 -7.355 1.00 0.00 H new ATOM 0 HB3 PHE A 47 0.449 7.130 -5.975 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.658 8.118 -7.655 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -0.015 9.390 -5.910 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.217 10.451 -8.185 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.542 11.724 -6.440 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.663 12.259 -7.571 1.00 0.00 H new ATOM 657 N ILE A 48 1.152 4.760 -4.385 1.00 0.00 N ATOM 658 CA ILE A 48 0.714 3.397 -4.112 1.00 0.00 C ATOM 659 C ILE A 48 0.027 2.787 -5.329 1.00 0.00 C ATOM 660 O ILE A 48 -0.913 3.362 -5.877 1.00 0.00 O ATOM 661 CB ILE A 48 -0.249 3.345 -2.912 1.00 0.00 C ATOM 662 CG1 ILE A 48 0.441 3.875 -1.653 1.00 0.00 C ATOM 663 CG2 ILE A 48 -0.744 1.923 -2.692 1.00 0.00 C ATOM 664 CD1 ILE A 48 -0.508 4.114 -0.500 1.00 0.00 C ATOM 0 H ILE A 48 0.691 5.472 -3.819 1.00 0.00 H new ATOM 0 HA ILE A 48 1.607 2.819 -3.875 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.109 3.980 -3.127 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.207 3.165 -1.342 1.00 0.00 H new ATOM 0 HG13 ILE A 48 0.951 4.808 -1.893 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -1.424 1.902 -1.840 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.268 1.578 -3.583 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.105 1.269 -2.495 1.00 0.00 H new ATOM 0 HD11 ILE A 48 0.049 4.489 0.358 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.259 4.847 -0.793 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -0.999 3.178 -0.233 1.00 0.00 H new ATOM 676 N SER A 49 0.500 1.617 -5.745 1.00 0.00 N ATOM 677 CA SER A 49 -0.068 0.928 -6.898 1.00 0.00 C ATOM 678 C SER A 49 -0.944 -0.240 -6.456 1.00 0.00 C ATOM 679 O SER A 49 -1.767 -0.739 -7.223 1.00 0.00 O ATOM 680 CB SER A 49 1.046 0.425 -7.818 1.00 0.00 C ATOM 681 OG SER A 49 0.576 -0.601 -8.674 1.00 0.00 O ATOM 0 H SER A 49 1.276 1.126 -5.301 1.00 0.00 H new ATOM 0 HA SER A 49 -0.688 1.638 -7.445 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.431 1.252 -8.414 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.876 0.051 -7.218 1.00 0.00 H new ATOM 0 HG SER A 49 1.306 -0.904 -9.253 1.00 0.00 H new ATOM 687 N LYS A 50 -0.761 -0.671 -5.213 1.00 0.00 N ATOM 688 CA LYS A 50 -1.534 -1.779 -4.665 1.00 0.00 C ATOM 689 C LYS A 50 -1.394 -1.843 -3.148 1.00 0.00 C ATOM 690 O LYS A 50 -0.457 -1.285 -2.577 1.00 0.00 O ATOM 691 CB LYS A 50 -1.079 -3.102 -5.286 1.00 0.00 C ATOM 692 CG LYS A 50 -1.228 -4.294 -4.357 1.00 0.00 C ATOM 693 CD LYS A 50 -0.612 -5.548 -4.954 1.00 0.00 C ATOM 694 CE LYS A 50 -1.273 -5.919 -6.273 1.00 0.00 C ATOM 695 NZ LYS A 50 -0.631 -7.109 -6.899 1.00 0.00 N ATOM 0 H LYS A 50 -0.083 -0.269 -4.565 1.00 0.00 H new ATOM 0 HA LYS A 50 -2.583 -1.612 -4.908 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.655 -3.285 -6.193 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -0.034 -3.013 -5.584 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -0.752 -4.073 -3.402 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.285 -4.468 -4.154 1.00 0.00 H new ATOM 0 HD2 LYS A 50 0.455 -5.391 -5.112 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -0.712 -6.374 -4.250 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -2.330 -6.123 -6.105 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -1.217 -5.073 -6.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -1.109 -7.330 -7.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.372 -6.906 -7.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -0.707 -7.923 -6.256 1.00 0.00 H new ATOM 709 N VAL A 51 -2.330 -2.529 -2.499 1.00 0.00 N ATOM 710 CA VAL A 51 -2.309 -2.668 -1.048 1.00 0.00 C ATOM 711 C VAL A 51 -3.092 -3.898 -0.603 1.00 0.00 C ATOM 712 O VAL A 51 -4.247 -4.083 -0.984 1.00 0.00 O ATOM 713 CB VAL A 51 -2.895 -1.422 -0.356 1.00 0.00 C ATOM 714 CG1 VAL A 51 -2.956 -1.627 1.150 1.00 0.00 C ATOM 715 CG2 VAL A 51 -2.077 -0.187 -0.702 1.00 0.00 C ATOM 0 H VAL A 51 -3.113 -2.997 -2.956 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.265 -2.780 -0.756 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.911 -1.270 -0.719 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.372 -0.737 1.622 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.588 -2.486 1.375 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.952 -1.805 1.534 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -2.505 0.684 -0.205 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.049 -0.326 -0.368 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.091 -0.032 -1.781 1.00 0.00 H new ATOM 725 N SER A 52 -2.454 -4.737 0.208 1.00 0.00 N ATOM 726 CA SER A 52 -3.090 -5.952 0.704 1.00 0.00 C ATOM 727 C SER A 52 -4.227 -5.618 1.664 1.00 0.00 C ATOM 728 O SER A 52 -4.145 -4.685 2.463 1.00 0.00 O ATOM 729 CB SER A 52 -2.061 -6.841 1.404 1.00 0.00 C ATOM 730 OG SER A 52 -2.430 -8.207 1.326 1.00 0.00 O ATOM 0 H SER A 52 -1.498 -4.597 0.535 1.00 0.00 H new ATOM 0 HA SER A 52 -3.505 -6.489 -0.149 1.00 0.00 H new ATOM 0 HB2 SER A 52 -1.082 -6.699 0.947 1.00 0.00 H new ATOM 0 HB3 SER A 52 -1.971 -6.545 2.449 1.00 0.00 H new ATOM 0 HG SER A 52 -1.755 -8.754 1.779 1.00 0.00 H new ATOM 736 N PRO A 53 -5.316 -6.398 1.584 1.00 0.00 N ATOM 737 CA PRO A 53 -6.491 -6.205 2.439 1.00 0.00 C ATOM 738 C PRO A 53 -6.217 -6.569 3.894 1.00 0.00 C ATOM 739 O PRO A 53 -6.739 -5.936 4.812 1.00 0.00 O ATOM 740 CB PRO A 53 -7.527 -7.157 1.836 1.00 0.00 C ATOM 741 CG PRO A 53 -6.723 -8.212 1.158 1.00 0.00 C ATOM 742 CD PRO A 53 -5.482 -7.528 0.655 1.00 0.00 C ATOM 0 HA PRO A 53 -6.811 -5.163 2.463 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.169 -7.583 2.607 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -8.177 -6.639 1.130 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.472 -9.016 1.850 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.281 -8.661 0.336 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -4.620 -8.194 0.675 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -5.599 -7.188 -0.374 1.00 0.00 H new ATOM 750 N THR A 54 -5.393 -7.592 4.098 1.00 0.00 N ATOM 751 CA THR A 54 -5.049 -8.041 5.441 1.00 0.00 C ATOM 752 C THR A 54 -3.796 -7.339 5.951 1.00 0.00 C ATOM 753 O THR A 54 -3.308 -7.633 7.042 1.00 0.00 O ATOM 754 CB THR A 54 -4.825 -9.564 5.485 1.00 0.00 C ATOM 755 OG1 THR A 54 -3.559 -9.889 4.899 1.00 0.00 O ATOM 756 CG2 THR A 54 -5.935 -10.296 4.746 1.00 0.00 C ATOM 0 H THR A 54 -4.951 -8.125 3.349 1.00 0.00 H new ATOM 0 HA THR A 54 -5.892 -7.787 6.084 1.00 0.00 H new ATOM 0 HB THR A 54 -4.835 -9.881 6.528 1.00 0.00 H new ATOM 0 HG1 THR A 54 -3.423 -10.859 4.932 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.755 -11.370 4.791 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.894 -10.069 5.212 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.953 -9.974 3.705 1.00 0.00 H new ATOM 764 N GLY A 55 -3.279 -6.408 5.155 1.00 0.00 N ATOM 765 CA GLY A 55 -2.086 -5.678 5.544 1.00 0.00 C ATOM 766 C GLY A 55 -2.381 -4.579 6.545 1.00 0.00 C ATOM 767 O GLY A 55 -3.526 -4.153 6.692 1.00 0.00 O ATOM 0 H GLY A 55 -3.665 -6.146 4.248 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.363 -6.372 5.973 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.624 -5.244 4.657 1.00 0.00 H new ATOM 771 N ALA A 56 -1.344 -4.118 7.238 1.00 0.00 N ATOM 772 CA ALA A 56 -1.497 -3.062 8.230 1.00 0.00 C ATOM 773 C ALA A 56 -2.246 -1.867 7.649 1.00 0.00 C ATOM 774 O ALA A 56 -2.984 -1.182 8.357 1.00 0.00 O ATOM 775 CB ALA A 56 -0.135 -2.629 8.754 1.00 0.00 C ATOM 0 H ALA A 56 -0.389 -4.460 7.130 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.084 -3.458 9.058 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.264 -1.840 9.494 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.365 -3.481 9.215 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.471 -2.256 7.928 1.00 0.00 H new ATOM 781 N ALA A 57 -2.052 -1.624 6.358 1.00 0.00 N ATOM 782 CA ALA A 57 -2.711 -0.513 5.682 1.00 0.00 C ATOM 783 C ALA A 57 -4.145 -0.871 5.308 1.00 0.00 C ATOM 784 O ALA A 57 -5.095 -0.268 5.806 1.00 0.00 O ATOM 785 CB ALA A 57 -1.926 -0.108 4.443 1.00 0.00 C ATOM 0 H ALA A 57 -1.444 -2.181 5.758 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.743 0.331 6.371 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.430 0.722 3.948 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -0.921 0.198 4.733 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -1.864 -0.954 3.759 1.00 0.00 H new ATOM 791 N GLY A 58 -4.295 -1.856 4.428 1.00 0.00 N ATOM 792 CA GLY A 58 -5.617 -2.276 4.002 1.00 0.00 C ATOM 793 C GLY A 58 -6.593 -2.377 5.157 1.00 0.00 C ATOM 794 O GLY A 58 -7.785 -2.116 4.996 1.00 0.00 O ATOM 0 H GLY A 58 -3.524 -2.371 4.002 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -6.000 -1.568 3.267 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -5.545 -3.244 3.505 1.00 0.00 H new ATOM 798 N ARG A 59 -6.088 -2.759 6.326 1.00 0.00 N ATOM 799 CA ARG A 59 -6.924 -2.897 7.512 1.00 0.00 C ATOM 800 C ARG A 59 -7.160 -1.542 8.171 1.00 0.00 C ATOM 801 O ARG A 59 -8.290 -1.197 8.519 1.00 0.00 O ATOM 802 CB ARG A 59 -6.275 -3.857 8.511 1.00 0.00 C ATOM 803 CG ARG A 59 -5.115 -3.244 9.278 1.00 0.00 C ATOM 804 CD ARG A 59 -4.495 -4.243 10.242 1.00 0.00 C ATOM 805 NE ARG A 59 -3.890 -3.586 11.398 1.00 0.00 N ATOM 806 CZ ARG A 59 -3.674 -4.193 12.559 1.00 0.00 C ATOM 807 NH1 ARG A 59 -4.010 -5.466 12.718 1.00 0.00 N ATOM 808 NH2 ARG A 59 -3.119 -3.528 13.564 1.00 0.00 N ATOM 0 H ARG A 59 -5.103 -2.978 6.477 1.00 0.00 H new ATOM 0 HA ARG A 59 -7.887 -3.303 7.202 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.030 -4.195 9.220 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.921 -4.739 7.977 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.357 -2.895 8.576 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.463 -2.371 9.831 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.260 -4.942 10.581 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.738 -4.828 9.720 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.619 -2.607 11.308 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.435 -5.981 11.947 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.843 -5.930 13.611 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.858 -2.549 13.445 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.954 -3.996 14.455 1.00 0.00 H new ATOM 822 N ASP A 60 -6.086 -0.778 8.341 1.00 0.00 N ATOM 823 CA ASP A 60 -6.176 0.541 8.959 1.00 0.00 C ATOM 824 C ASP A 60 -7.412 1.288 8.468 1.00 0.00 C ATOM 825 O ASP A 60 -8.336 1.551 9.236 1.00 0.00 O ATOM 826 CB ASP A 60 -4.918 1.356 8.655 1.00 0.00 C ATOM 827 CG ASP A 60 -4.809 2.595 9.521 1.00 0.00 C ATOM 828 OD1 ASP A 60 -5.821 3.312 9.661 1.00 0.00 O ATOM 829 OD2 ASP A 60 -3.710 2.849 10.058 1.00 0.00 O ATOM 0 H ASP A 60 -5.144 -1.049 8.060 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.260 0.405 10.037 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -4.038 0.731 8.807 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.923 1.649 7.605 1.00 0.00 H new ATOM 834 N GLY A 61 -7.421 1.627 7.182 1.00 0.00 N ATOM 835 CA GLY A 61 -8.548 2.341 6.612 1.00 0.00 C ATOM 836 C GLY A 61 -8.163 3.713 6.095 1.00 0.00 C ATOM 837 O GLY A 61 -8.928 4.347 5.367 1.00 0.00 O ATOM 0 H GLY A 61 -6.668 1.420 6.526 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -8.971 1.754 5.797 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.327 2.446 7.367 1.00 0.00 H new ATOM 841 N ARG A 62 -6.975 4.174 6.472 1.00 0.00 N ATOM 842 CA ARG A 62 -6.491 5.481 6.044 1.00 0.00 C ATOM 843 C ARG A 62 -5.557 5.349 4.845 1.00 0.00 C ATOM 844 O ARG A 62 -5.226 6.339 4.190 1.00 0.00 O ATOM 845 CB ARG A 62 -5.766 6.182 7.194 1.00 0.00 C ATOM 846 CG ARG A 62 -6.486 6.067 8.528 1.00 0.00 C ATOM 847 CD ARG A 62 -7.694 6.988 8.590 1.00 0.00 C ATOM 848 NE ARG A 62 -8.779 6.527 7.728 1.00 0.00 N ATOM 849 CZ ARG A 62 -9.904 7.207 7.535 1.00 0.00 C ATOM 850 NH1 ARG A 62 -10.090 8.372 8.139 1.00 0.00 N ATOM 851 NH2 ARG A 62 -10.845 6.721 6.736 1.00 0.00 N ATOM 0 H ARG A 62 -6.330 3.662 7.073 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.352 6.080 5.748 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.766 5.760 7.293 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.644 7.236 6.946 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.805 5.036 8.683 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.798 6.313 9.337 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.050 7.050 9.618 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.398 7.994 8.293 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.667 5.634 7.248 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.368 8.749 8.754 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.955 8.892 7.989 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -10.705 5.825 6.269 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.708 7.244 6.588 1.00 0.00 H new ATOM 865 N LEU A 63 -5.136 4.122 4.562 1.00 0.00 N ATOM 866 CA LEU A 63 -4.239 3.859 3.442 1.00 0.00 C ATOM 867 C LEU A 63 -4.956 3.084 2.341 1.00 0.00 C ATOM 868 O LEU A 63 -5.663 2.113 2.611 1.00 0.00 O ATOM 869 CB LEU A 63 -3.013 3.078 3.916 1.00 0.00 C ATOM 870 CG LEU A 63 -1.833 3.026 2.945 1.00 0.00 C ATOM 871 CD1 LEU A 63 -2.242 2.351 1.644 1.00 0.00 C ATOM 872 CD2 LEU A 63 -1.300 4.425 2.677 1.00 0.00 C ATOM 0 H LEU A 63 -5.401 3.292 5.093 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.916 4.817 3.035 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.668 3.516 4.852 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.321 2.056 4.137 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.037 2.438 3.402 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.390 2.323 0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.575 1.334 1.851 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.055 2.912 1.183 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.461 4.368 1.984 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.089 5.038 2.241 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.968 4.873 3.613 1.00 0.00 H new ATOM 884 N ARG A 64 -4.766 3.518 1.099 1.00 0.00 N ATOM 885 CA ARG A 64 -5.393 2.864 -0.043 1.00 0.00 C ATOM 886 C ARG A 64 -4.589 3.105 -1.317 1.00 0.00 C ATOM 887 O ARG A 64 -3.803 4.049 -1.399 1.00 0.00 O ATOM 888 CB ARG A 64 -6.824 3.373 -0.227 1.00 0.00 C ATOM 889 CG ARG A 64 -6.986 4.855 0.068 1.00 0.00 C ATOM 890 CD ARG A 64 -7.308 5.099 1.534 1.00 0.00 C ATOM 891 NE ARG A 64 -7.958 6.390 1.744 1.00 0.00 N ATOM 892 CZ ARG A 64 -9.178 6.679 1.306 1.00 0.00 C ATOM 893 NH1 ARG A 64 -9.878 5.773 0.638 1.00 0.00 N ATOM 894 NH2 ARG A 64 -9.701 7.877 1.537 1.00 0.00 N ATOM 0 H ARG A 64 -4.183 4.320 0.858 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.418 1.792 0.153 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -7.141 3.178 -1.252 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.489 2.807 0.425 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.070 5.382 -0.197 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -7.781 5.266 -0.554 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.956 4.303 1.900 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -6.389 5.056 2.119 1.00 0.00 H new ATOM 0 HE ARG A 64 -7.447 7.109 2.255 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -9.480 4.851 0.459 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -10.815 5.998 0.303 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.166 8.577 2.051 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -10.638 8.098 1.200 1.00 0.00 H new ATOM 908 N VAL A 65 -4.789 2.243 -2.309 1.00 0.00 N ATOM 909 CA VAL A 65 -4.084 2.363 -3.580 1.00 0.00 C ATOM 910 C VAL A 65 -4.471 3.646 -4.306 1.00 0.00 C ATOM 911 O VAL A 65 -5.498 3.704 -4.981 1.00 0.00 O ATOM 912 CB VAL A 65 -4.373 1.160 -4.497 1.00 0.00 C ATOM 913 CG1 VAL A 65 -3.549 1.251 -5.773 1.00 0.00 C ATOM 914 CG2 VAL A 65 -4.096 -0.146 -3.767 1.00 0.00 C ATOM 0 H VAL A 65 -5.433 1.454 -2.257 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.019 2.388 -3.349 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.428 1.180 -4.771 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -3.766 0.393 -6.409 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.801 2.169 -6.304 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.488 1.257 -5.522 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.306 -0.985 -4.430 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.050 -0.177 -3.462 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -4.734 -0.212 -2.885 1.00 0.00 H new ATOM 924 N GLY A 66 -3.641 4.675 -4.162 1.00 0.00 N ATOM 925 CA GLY A 66 -3.913 5.944 -4.810 1.00 0.00 C ATOM 926 C GLY A 66 -3.241 7.108 -4.110 1.00 0.00 C ATOM 927 O GLY A 66 -3.040 8.168 -4.705 1.00 0.00 O ATOM 0 H GLY A 66 -2.785 4.652 -3.608 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.572 5.901 -5.845 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.990 6.112 -4.836 1.00 0.00 H new ATOM 931 N LEU A 67 -2.893 6.914 -2.843 1.00 0.00 N ATOM 932 CA LEU A 67 -2.240 7.958 -2.060 1.00 0.00 C ATOM 933 C LEU A 67 -0.765 8.075 -2.432 1.00 0.00 C ATOM 934 O LEU A 67 -0.071 7.070 -2.582 1.00 0.00 O ATOM 935 CB LEU A 67 -2.378 7.663 -0.565 1.00 0.00 C ATOM 936 CG LEU A 67 -3.808 7.560 -0.031 1.00 0.00 C ATOM 937 CD1 LEU A 67 -3.808 7.033 1.395 1.00 0.00 C ATOM 938 CD2 LEU A 67 -4.502 8.913 -0.102 1.00 0.00 C ATOM 0 H LEU A 67 -3.052 6.044 -2.336 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.729 8.906 -2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.863 6.727 -0.351 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.860 8.446 -0.011 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.360 6.858 -0.656 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.834 6.966 1.758 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.350 6.044 1.417 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.240 7.710 2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.518 8.821 0.282 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.951 9.636 0.499 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.534 9.251 -1.138 1.00 0.00 H new ATOM 950 N ARG A 68 -0.294 9.309 -2.578 1.00 0.00 N ATOM 951 CA ARG A 68 1.098 9.559 -2.932 1.00 0.00 C ATOM 952 C ARG A 68 1.986 9.537 -1.691 1.00 0.00 C ATOM 953 O ARG A 68 1.757 10.281 -0.737 1.00 0.00 O ATOM 954 CB ARG A 68 1.232 10.906 -3.644 1.00 0.00 C ATOM 955 CG ARG A 68 2.629 11.174 -4.182 1.00 0.00 C ATOM 956 CD ARG A 68 2.788 12.621 -4.621 1.00 0.00 C ATOM 957 NE ARG A 68 4.183 12.961 -4.889 1.00 0.00 N ATOM 958 CZ ARG A 68 4.583 14.164 -5.283 1.00 0.00 C ATOM 959 NH1 ARG A 68 3.699 15.138 -5.454 1.00 0.00 N ATOM 960 NH2 ARG A 68 5.870 14.397 -5.507 1.00 0.00 N ATOM 0 H ARG A 68 -0.856 10.151 -2.457 1.00 0.00 H new ATOM 0 HA ARG A 68 1.424 8.766 -3.606 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.521 10.944 -4.469 1.00 0.00 H new ATOM 0 HB3 ARG A 68 0.959 11.702 -2.951 1.00 0.00 H new ATOM 0 HG2 ARG A 68 3.367 10.942 -3.414 1.00 0.00 H new ATOM 0 HG3 ARG A 68 2.829 10.513 -5.025 1.00 0.00 H new ATOM 0 HD2 ARG A 68 2.194 12.795 -5.518 1.00 0.00 H new ATOM 0 HD3 ARG A 68 2.397 13.280 -3.846 1.00 0.00 H new ATOM 0 HE ARG A 68 4.888 12.234 -4.767 1.00 0.00 H new ATOM 0 HH11 ARG A 68 2.709 14.964 -5.283 1.00 0.00 H new ATOM 0 HH12 ARG A 68 4.010 16.061 -5.757 1.00 0.00 H new ATOM 0 HH21 ARG A 68 6.554 13.651 -5.377 1.00 0.00 H new ATOM 0 HH22 ARG A 68 6.176 15.322 -5.810 1.00 0.00 H new ATOM 974 N LEU A 69 3.000 8.679 -1.711 1.00 0.00 N ATOM 975 CA LEU A 69 3.923 8.559 -0.587 1.00 0.00 C ATOM 976 C LEU A 69 4.850 9.768 -0.513 1.00 0.00 C ATOM 977 O LEU A 69 5.709 9.959 -1.375 1.00 0.00 O ATOM 978 CB LEU A 69 4.748 7.276 -0.714 1.00 0.00 C ATOM 979 CG LEU A 69 4.235 6.069 0.071 1.00 0.00 C ATOM 980 CD1 LEU A 69 4.574 6.209 1.547 1.00 0.00 C ATOM 981 CD2 LEU A 69 2.734 5.906 -0.120 1.00 0.00 C ATOM 0 H LEU A 69 3.204 8.056 -2.493 1.00 0.00 H new ATOM 0 HA LEU A 69 3.336 8.517 0.331 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.799 7.004 -1.768 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.767 7.489 -0.390 1.00 0.00 H new ATOM 0 HG LEU A 69 4.728 5.175 -0.311 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.201 5.341 2.090 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.655 6.275 1.667 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.109 7.112 1.943 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.387 5.042 0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.223 6.801 0.234 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.516 5.758 -1.178 1.00 0.00 H new ATOM 993 N LEU A 70 4.673 10.580 0.523 1.00 0.00 N ATOM 994 CA LEU A 70 5.495 11.770 0.712 1.00 0.00 C ATOM 995 C LEU A 70 6.742 11.446 1.529 1.00 0.00 C ATOM 996 O LEU A 70 7.856 11.800 1.144 1.00 0.00 O ATOM 997 CB LEU A 70 4.687 12.867 1.406 1.00 0.00 C ATOM 998 CG LEU A 70 3.596 13.531 0.566 1.00 0.00 C ATOM 999 CD1 LEU A 70 2.906 14.631 1.359 1.00 0.00 C ATOM 1000 CD2 LEU A 70 4.181 14.089 -0.724 1.00 0.00 C ATOM 0 H LEU A 70 3.967 10.436 1.245 1.00 0.00 H new ATOM 0 HA LEU A 70 5.809 12.125 -0.270 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.224 12.441 2.296 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.377 13.640 1.745 1.00 0.00 H new ATOM 0 HG LEU A 70 2.853 12.776 0.309 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.133 15.092 0.745 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.452 14.205 2.254 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.638 15.385 1.647 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.390 14.558 -1.309 1.00 0.00 H new ATOM 0 HD22 LEU A 70 4.945 14.830 -0.487 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.628 13.279 -1.301 1.00 0.00 H new ATOM 1012 N GLU A 71 6.546 10.770 2.656 1.00 0.00 N ATOM 1013 CA GLU A 71 7.655 10.398 3.526 1.00 0.00 C ATOM 1014 C GLU A 71 7.274 9.221 4.421 1.00 0.00 C ATOM 1015 O GLU A 71 6.149 9.142 4.915 1.00 0.00 O ATOM 1016 CB GLU A 71 8.081 11.590 4.386 1.00 0.00 C ATOM 1017 CG GLU A 71 8.005 12.922 3.659 1.00 0.00 C ATOM 1018 CD GLU A 71 8.287 14.100 4.571 1.00 0.00 C ATOM 1019 OE1 GLU A 71 8.538 13.873 5.773 1.00 0.00 O ATOM 1020 OE2 GLU A 71 8.257 15.249 4.083 1.00 0.00 O ATOM 0 H GLU A 71 5.630 10.469 2.988 1.00 0.00 H new ATOM 0 HA GLU A 71 8.492 10.097 2.896 1.00 0.00 H new ATOM 0 HB2 GLU A 71 7.448 11.633 5.272 1.00 0.00 H new ATOM 0 HB3 GLU A 71 9.103 11.432 4.731 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.720 12.924 2.837 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.014 13.036 3.220 1.00 0.00 H new ATOM 1027 N VAL A 72 8.220 8.310 4.624 1.00 0.00 N ATOM 1028 CA VAL A 72 7.985 7.138 5.459 1.00 0.00 C ATOM 1029 C VAL A 72 8.813 7.198 6.737 1.00 0.00 C ATOM 1030 O VAL A 72 10.038 7.088 6.701 1.00 0.00 O ATOM 1031 CB VAL A 72 8.317 5.836 4.706 1.00 0.00 C ATOM 1032 CG1 VAL A 72 8.089 4.628 5.601 1.00 0.00 C ATOM 1033 CG2 VAL A 72 7.490 5.731 3.433 1.00 0.00 C ATOM 0 H VAL A 72 9.156 8.361 4.222 1.00 0.00 H new ATOM 0 HA VAL A 72 6.926 7.140 5.716 1.00 0.00 H new ATOM 0 HB VAL A 72 9.370 5.857 4.427 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.329 3.718 5.052 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.729 4.701 6.480 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.045 4.599 5.914 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.737 4.805 2.914 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.430 5.733 3.687 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.709 6.580 2.786 1.00 0.00 H new ATOM 1043 N ASN A 73 8.136 7.375 7.867 1.00 0.00 N ATOM 1044 CA ASN A 73 8.810 7.450 9.158 1.00 0.00 C ATOM 1045 C ASN A 73 9.701 8.686 9.235 1.00 0.00 C ATOM 1046 O ASN A 73 10.817 8.627 9.752 1.00 0.00 O ATOM 1047 CB ASN A 73 9.644 6.190 9.396 1.00 0.00 C ATOM 1048 CG ASN A 73 8.883 5.130 10.168 1.00 0.00 C ATOM 1049 OD1 ASN A 73 7.936 5.434 10.893 1.00 0.00 O ATOM 1050 ND2 ASN A 73 9.295 3.877 10.015 1.00 0.00 N ATOM 0 H ASN A 73 7.121 7.469 7.915 1.00 0.00 H new ATOM 0 HA ASN A 73 8.048 7.524 9.934 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.960 5.780 8.437 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.549 6.455 9.943 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.822 3.121 10.509 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.085 3.671 9.403 1.00 0.00 H new ATOM 1057 N GLN A 74 9.201 9.803 8.717 1.00 0.00 N ATOM 1058 CA GLN A 74 9.952 11.053 8.727 1.00 0.00 C ATOM 1059 C GLN A 74 11.213 10.937 7.876 1.00 0.00 C ATOM 1060 O GLN A 74 12.232 11.560 8.173 1.00 0.00 O ATOM 1061 CB GLN A 74 10.324 11.437 10.160 1.00 0.00 C ATOM 1062 CG GLN A 74 9.134 11.870 11.002 1.00 0.00 C ATOM 1063 CD GLN A 74 9.399 11.755 12.490 1.00 0.00 C ATOM 1064 OE1 GLN A 74 10.173 12.527 13.057 1.00 0.00 O ATOM 1065 NE2 GLN A 74 8.757 10.786 13.133 1.00 0.00 N ATOM 0 H GLN A 74 8.279 9.868 8.285 1.00 0.00 H new ATOM 0 HA GLN A 74 9.319 11.832 8.302 1.00 0.00 H new ATOM 0 HB2 GLN A 74 10.809 10.587 10.641 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.053 12.247 10.133 1.00 0.00 H new ATOM 0 HG2 GLN A 74 8.880 12.902 10.761 1.00 0.00 H new ATOM 0 HG3 GLN A 74 8.269 11.260 10.743 1.00 0.00 H new ATOM 0 HE21 GLN A 74 8.124 10.168 12.624 1.00 0.00 H new ATOM 0 HE22 GLN A 74 8.897 10.660 14.135 1.00 0.00 H new ATOM 1074 N GLN A 75 11.135 10.135 6.819 1.00 0.00 N ATOM 1075 CA GLN A 75 12.271 9.938 5.926 1.00 0.00 C ATOM 1076 C GLN A 75 11.873 10.190 4.475 1.00 0.00 C ATOM 1077 O GLN A 75 11.448 9.276 3.770 1.00 0.00 O ATOM 1078 CB GLN A 75 12.824 8.520 6.076 1.00 0.00 C ATOM 1079 CG GLN A 75 13.165 8.148 7.510 1.00 0.00 C ATOM 1080 CD GLN A 75 14.247 7.090 7.598 1.00 0.00 C ATOM 1081 OE1 GLN A 75 15.418 7.360 7.333 1.00 0.00 O ATOM 1082 NE2 GLN A 75 13.859 5.876 7.971 1.00 0.00 N ATOM 0 H GLN A 75 10.298 9.612 6.560 1.00 0.00 H new ATOM 0 HA GLN A 75 13.046 10.654 6.201 1.00 0.00 H new ATOM 0 HB2 GLN A 75 12.092 7.811 5.690 1.00 0.00 H new ATOM 0 HB3 GLN A 75 13.719 8.421 5.461 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.490 9.040 8.045 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.267 7.786 8.011 1.00 0.00 H new ATOM 0 HE21 GLN A 75 12.877 5.697 8.181 1.00 0.00 H new ATOM 0 HE22 GLN A 75 14.543 5.123 8.047 1.00 0.00 H new ATOM 1091 N SER A 76 12.014 11.437 4.037 1.00 0.00 N ATOM 1092 CA SER A 76 11.666 11.811 2.671 1.00 0.00 C ATOM 1093 C SER A 76 12.159 10.762 1.678 1.00 0.00 C ATOM 1094 O SER A 76 13.321 10.356 1.712 1.00 0.00 O ATOM 1095 CB SER A 76 12.262 13.177 2.326 1.00 0.00 C ATOM 1096 OG SER A 76 11.749 13.661 1.096 1.00 0.00 O ATOM 0 H SER A 76 12.367 12.205 4.608 1.00 0.00 H new ATOM 0 HA SER A 76 10.580 11.869 2.602 1.00 0.00 H new ATOM 0 HB2 SER A 76 12.037 13.887 3.122 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.348 13.099 2.266 1.00 0.00 H new ATOM 0 HG SER A 76 12.144 14.536 0.899 1.00 0.00 H new ATOM 1102 N LEU A 77 11.267 10.328 0.794 1.00 0.00 N ATOM 1103 CA LEU A 77 11.610 9.327 -0.210 1.00 0.00 C ATOM 1104 C LEU A 77 12.322 9.967 -1.397 1.00 0.00 C ATOM 1105 O LEU A 77 12.584 9.311 -2.406 1.00 0.00 O ATOM 1106 CB LEU A 77 10.350 8.602 -0.686 1.00 0.00 C ATOM 1107 CG LEU A 77 9.408 8.102 0.409 1.00 0.00 C ATOM 1108 CD1 LEU A 77 8.351 7.178 -0.176 1.00 0.00 C ATOM 1109 CD2 LEU A 77 10.192 7.394 1.504 1.00 0.00 C ATOM 0 H LEU A 77 10.301 10.654 0.752 1.00 0.00 H new ATOM 0 HA LEU A 77 12.286 8.605 0.248 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.792 9.275 -1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.654 7.749 -1.293 1.00 0.00 H new ATOM 0 HG LEU A 77 8.904 8.963 0.849 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.690 6.832 0.619 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.769 7.718 -0.923 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.836 6.321 -0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.505 7.045 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.723 6.543 1.079 1.00 0.00 H new ATOM 0 HD23 LEU A 77 10.910 8.087 1.944 1.00 0.00 H new ATOM 1121 N LEU A 78 12.636 11.252 -1.269 1.00 0.00 N ATOM 1122 CA LEU A 78 13.320 11.981 -2.330 1.00 0.00 C ATOM 1123 C LEU A 78 14.808 11.646 -2.350 1.00 0.00 C ATOM 1124 O LEU A 78 15.503 11.802 -1.347 1.00 0.00 O ATOM 1125 CB LEU A 78 13.128 13.488 -2.147 1.00 0.00 C ATOM 1126 CG LEU A 78 13.214 14.335 -3.417 1.00 0.00 C ATOM 1127 CD1 LEU A 78 14.540 14.102 -4.125 1.00 0.00 C ATOM 1128 CD2 LEU A 78 12.050 14.024 -4.345 1.00 0.00 C ATOM 0 H LEU A 78 12.428 11.810 -0.441 1.00 0.00 H new ATOM 0 HA LEU A 78 12.885 11.678 -3.283 1.00 0.00 H new ATOM 0 HB2 LEU A 78 12.154 13.657 -1.687 1.00 0.00 H new ATOM 0 HB3 LEU A 78 13.879 13.847 -1.443 1.00 0.00 H new ATOM 0 HG LEU A 78 13.156 15.386 -3.134 1.00 0.00 H new ATOM 0 HD11 LEU A 78 14.583 14.713 -5.027 1.00 0.00 H new ATOM 0 HD12 LEU A 78 15.360 14.376 -3.461 1.00 0.00 H new ATOM 0 HD13 LEU A 78 14.628 13.050 -4.395 1.00 0.00 H new ATOM 0 HD21 LEU A 78 12.128 14.636 -5.244 1.00 0.00 H new ATOM 0 HD22 LEU A 78 12.076 12.970 -4.621 1.00 0.00 H new ATOM 0 HD23 LEU A 78 11.111 14.243 -3.837 1.00 0.00 H new ATOM 1140 N GLY A 79 15.291 11.184 -3.500 1.00 0.00 N ATOM 1141 CA GLY A 79 16.694 10.836 -3.629 1.00 0.00 C ATOM 1142 C GLY A 79 16.907 9.346 -3.808 1.00 0.00 C ATOM 1143 O GLY A 79 17.788 8.922 -4.557 1.00 0.00 O ATOM 0 H GLY A 79 14.736 11.045 -4.344 1.00 0.00 H new ATOM 0 HA2 GLY A 79 17.120 11.366 -4.481 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.232 11.173 -2.743 1.00 0.00 H new ATOM 1147 N LEU A 80 16.099 8.547 -3.119 1.00 0.00 N ATOM 1148 CA LEU A 80 16.204 7.095 -3.204 1.00 0.00 C ATOM 1149 C LEU A 80 15.419 6.561 -4.397 1.00 0.00 C ATOM 1150 O LEU A 80 14.641 7.287 -5.018 1.00 0.00 O ATOM 1151 CB LEU A 80 15.694 6.450 -1.913 1.00 0.00 C ATOM 1152 CG LEU A 80 14.536 7.167 -1.218 1.00 0.00 C ATOM 1153 CD1 LEU A 80 13.714 6.183 -0.399 1.00 0.00 C ATOM 1154 CD2 LEU A 80 15.057 8.293 -0.337 1.00 0.00 C ATOM 0 H LEU A 80 15.364 8.881 -2.495 1.00 0.00 H new ATOM 0 HA LEU A 80 17.255 6.839 -3.340 1.00 0.00 H new ATOM 0 HB2 LEU A 80 15.381 5.431 -2.139 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.526 6.380 -1.212 1.00 0.00 H new ATOM 0 HG LEU A 80 13.891 7.600 -1.982 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.894 6.711 0.089 1.00 0.00 H new ATOM 0 HD12 LEU A 80 13.310 5.412 -1.055 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.348 5.720 0.357 1.00 0.00 H new ATOM 0 HD21 LEU A 80 14.219 8.792 0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 80 15.725 7.883 0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 80 15.601 9.012 -0.949 1.00 0.00 H new ATOM 1166 N THR A 81 15.624 5.286 -4.712 1.00 0.00 N ATOM 1167 CA THR A 81 14.935 4.654 -5.830 1.00 0.00 C ATOM 1168 C THR A 81 13.855 3.696 -5.340 1.00 0.00 C ATOM 1169 O THR A 81 13.868 3.269 -4.185 1.00 0.00 O ATOM 1170 CB THR A 81 15.918 3.883 -6.732 1.00 0.00 C ATOM 1171 OG1 THR A 81 16.603 2.884 -5.969 1.00 0.00 O ATOM 1172 CG2 THR A 81 16.929 4.829 -7.363 1.00 0.00 C ATOM 0 H THR A 81 16.262 4.670 -4.208 1.00 0.00 H new ATOM 0 HA THR A 81 14.472 5.453 -6.409 1.00 0.00 H new ATOM 0 HB THR A 81 15.347 3.404 -7.527 1.00 0.00 H new ATOM 0 HG1 THR A 81 17.224 2.398 -6.550 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.612 4.262 -7.995 1.00 0.00 H new ATOM 0 HG22 THR A 81 16.406 5.570 -7.967 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.494 5.333 -6.579 1.00 0.00 H new ATOM 1180 N HIS A 82 12.921 3.362 -6.225 1.00 0.00 N ATOM 1181 CA HIS A 82 11.833 2.453 -5.881 1.00 0.00 C ATOM 1182 C HIS A 82 12.297 1.409 -4.870 1.00 0.00 C ATOM 1183 O HIS A 82 11.710 1.264 -3.799 1.00 0.00 O ATOM 1184 CB HIS A 82 11.302 1.763 -7.138 1.00 0.00 C ATOM 1185 CG HIS A 82 9.904 1.246 -6.991 1.00 0.00 C ATOM 1186 ND1 HIS A 82 9.552 -0.060 -7.262 1.00 0.00 N ATOM 1187 CD2 HIS A 82 8.767 1.867 -6.599 1.00 0.00 C ATOM 1188 CE1 HIS A 82 8.259 -0.219 -7.043 1.00 0.00 C ATOM 1189 NE2 HIS A 82 7.759 0.935 -6.639 1.00 0.00 N ATOM 0 H HIS A 82 12.896 3.707 -7.185 1.00 0.00 H new ATOM 0 HA HIS A 82 11.031 3.038 -5.430 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.335 2.466 -7.970 1.00 0.00 H new ATOM 0 HB3 HIS A 82 11.962 0.934 -7.394 1.00 0.00 H new ATOM 0 HD1 HIS A 82 10.190 -0.789 -7.581 1.00 0.00 H new ATOM 0 HD2 HIS A 82 8.670 2.903 -6.309 1.00 0.00 H new ATOM 0 HE1 HIS A 82 7.705 -1.137 -7.172 1.00 0.00 H new ATOM 1198 N GLY A 83 13.354 0.682 -5.220 1.00 0.00 N ATOM 1199 CA GLY A 83 13.877 -0.341 -4.332 1.00 0.00 C ATOM 1200 C GLY A 83 14.147 0.186 -2.937 1.00 0.00 C ATOM 1201 O GLY A 83 13.760 -0.435 -1.947 1.00 0.00 O ATOM 0 H GLY A 83 13.857 0.783 -6.102 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.167 -1.166 -4.274 1.00 0.00 H new ATOM 0 HA3 GLY A 83 14.800 -0.744 -4.750 1.00 0.00 H new ATOM 1205 N GLU A 84 14.813 1.334 -2.857 1.00 0.00 N ATOM 1206 CA GLU A 84 15.136 1.941 -1.571 1.00 0.00 C ATOM 1207 C GLU A 84 13.869 2.394 -0.851 1.00 0.00 C ATOM 1208 O GLU A 84 13.666 2.085 0.323 1.00 0.00 O ATOM 1209 CB GLU A 84 16.078 3.131 -1.767 1.00 0.00 C ATOM 1210 CG GLU A 84 17.549 2.751 -1.750 1.00 0.00 C ATOM 1211 CD GLU A 84 18.118 2.681 -0.346 1.00 0.00 C ATOM 1212 OE1 GLU A 84 17.591 3.380 0.544 1.00 0.00 O ATOM 1213 OE2 GLU A 84 19.091 1.926 -0.138 1.00 0.00 O ATOM 0 H GLU A 84 15.139 1.862 -3.667 1.00 0.00 H new ATOM 0 HA GLU A 84 15.634 1.190 -0.957 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.847 3.614 -2.716 1.00 0.00 H new ATOM 0 HB3 GLU A 84 15.892 3.864 -0.982 1.00 0.00 H new ATOM 0 HG2 GLU A 84 17.676 1.785 -2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 84 18.115 3.479 -2.331 1.00 0.00 H new ATOM 1220 N ALA A 85 13.021 3.129 -1.563 1.00 0.00 N ATOM 1221 CA ALA A 85 11.775 3.624 -0.992 1.00 0.00 C ATOM 1222 C ALA A 85 10.998 2.502 -0.313 1.00 0.00 C ATOM 1223 O ALA A 85 10.571 2.634 0.834 1.00 0.00 O ATOM 1224 CB ALA A 85 10.924 4.280 -2.071 1.00 0.00 C ATOM 0 H ALA A 85 13.174 3.395 -2.536 1.00 0.00 H new ATOM 0 HA ALA A 85 12.022 4.369 -0.235 1.00 0.00 H new ATOM 0 HB1 ALA A 85 9.996 4.645 -1.631 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.471 5.115 -2.509 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.694 3.550 -2.847 1.00 0.00 H new ATOM 1230 N VAL A 86 10.817 1.396 -1.029 1.00 0.00 N ATOM 1231 CA VAL A 86 10.092 0.249 -0.495 1.00 0.00 C ATOM 1232 C VAL A 86 10.713 -0.234 0.811 1.00 0.00 C ATOM 1233 O VAL A 86 10.044 -0.297 1.842 1.00 0.00 O ATOM 1234 CB VAL A 86 10.066 -0.917 -1.501 1.00 0.00 C ATOM 1235 CG1 VAL A 86 9.448 -2.154 -0.868 1.00 0.00 C ATOM 1236 CG2 VAL A 86 9.310 -0.517 -2.759 1.00 0.00 C ATOM 0 H VAL A 86 11.163 1.270 -1.980 1.00 0.00 H new ATOM 0 HA VAL A 86 9.070 0.580 -0.308 1.00 0.00 H new ATOM 0 HB VAL A 86 11.092 -1.156 -1.782 1.00 0.00 H new ATOM 0 HG11 VAL A 86 9.438 -2.968 -1.593 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.035 -2.450 0.001 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.427 -1.932 -0.557 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.301 -1.352 -3.459 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.286 -0.251 -2.499 1.00 0.00 H new ATOM 0 HG23 VAL A 86 9.801 0.339 -3.222 1.00 0.00 H new ATOM 1246 N GLN A 87 11.997 -0.574 0.759 1.00 0.00 N ATOM 1247 CA GLN A 87 12.708 -1.053 1.938 1.00 0.00 C ATOM 1248 C GLN A 87 12.535 -0.089 3.107 1.00 0.00 C ATOM 1249 O GLN A 87 12.671 -0.474 4.269 1.00 0.00 O ATOM 1250 CB GLN A 87 14.195 -1.232 1.626 1.00 0.00 C ATOM 1251 CG GLN A 87 14.473 -2.311 0.592 1.00 0.00 C ATOM 1252 CD GLN A 87 13.601 -3.537 0.779 1.00 0.00 C ATOM 1253 OE1 GLN A 87 13.988 -4.493 1.451 1.00 0.00 O ATOM 1254 NE2 GLN A 87 12.414 -3.515 0.183 1.00 0.00 N ATOM 0 H GLN A 87 12.566 -0.527 -0.086 1.00 0.00 H new ATOM 0 HA GLN A 87 12.284 -2.017 2.219 1.00 0.00 H new ATOM 0 HB2 GLN A 87 14.600 -0.285 1.269 1.00 0.00 H new ATOM 0 HB3 GLN A 87 14.724 -1.478 2.547 1.00 0.00 H new ATOM 0 HG2 GLN A 87 14.311 -1.903 -0.406 1.00 0.00 H new ATOM 0 HG3 GLN A 87 15.521 -2.603 0.650 1.00 0.00 H new ATOM 0 HE21 GLN A 87 12.133 -2.702 -0.365 1.00 0.00 H new ATOM 0 HE22 GLN A 87 11.783 -4.311 0.273 1.00 0.00 H new ATOM 1263 N LEU A 88 12.235 1.167 2.792 1.00 0.00 N ATOM 1264 CA LEU A 88 12.043 2.187 3.817 1.00 0.00 C ATOM 1265 C LEU A 88 10.684 2.032 4.492 1.00 0.00 C ATOM 1266 O LEU A 88 10.507 2.415 5.650 1.00 0.00 O ATOM 1267 CB LEU A 88 12.163 3.583 3.202 1.00 0.00 C ATOM 1268 CG LEU A 88 12.722 4.673 4.118 1.00 0.00 C ATOM 1269 CD1 LEU A 88 12.829 5.994 3.371 1.00 0.00 C ATOM 1270 CD2 LEU A 88 11.852 4.827 5.357 1.00 0.00 C ATOM 0 H LEU A 88 12.120 1.503 1.836 1.00 0.00 H new ATOM 0 HA LEU A 88 12.819 2.060 4.572 1.00 0.00 H new ATOM 0 HB2 LEU A 88 12.799 3.516 2.319 1.00 0.00 H new ATOM 0 HB3 LEU A 88 11.176 3.894 2.860 1.00 0.00 H new ATOM 0 HG LEU A 88 13.722 4.377 4.436 1.00 0.00 H new ATOM 0 HD11 LEU A 88 13.228 6.758 4.038 1.00 0.00 H new ATOM 0 HD12 LEU A 88 13.494 5.875 2.516 1.00 0.00 H new ATOM 0 HD13 LEU A 88 11.841 6.296 3.023 1.00 0.00 H new ATOM 0 HD21 LEU A 88 12.265 5.607 5.997 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.840 5.100 5.059 1.00 0.00 H new ATOM 0 HD23 LEU A 88 11.827 3.884 5.904 1.00 0.00 H new ATOM 1282 N LEU A 89 9.728 1.468 3.763 1.00 0.00 N ATOM 1283 CA LEU A 89 8.384 1.259 4.292 1.00 0.00 C ATOM 1284 C LEU A 89 8.318 -0.019 5.122 1.00 0.00 C ATOM 1285 O LEU A 89 7.473 -0.153 6.007 1.00 0.00 O ATOM 1286 CB LEU A 89 7.370 1.192 3.150 1.00 0.00 C ATOM 1287 CG LEU A 89 7.093 -0.199 2.579 1.00 0.00 C ATOM 1288 CD1 LEU A 89 6.116 -0.956 3.467 1.00 0.00 C ATOM 1289 CD2 LEU A 89 6.556 -0.096 1.159 1.00 0.00 C ATOM 0 H LEU A 89 9.858 1.147 2.804 1.00 0.00 H new ATOM 0 HA LEU A 89 8.139 2.102 4.938 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.428 1.612 3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.722 1.832 2.341 1.00 0.00 H new ATOM 0 HG LEU A 89 8.032 -0.753 2.552 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.931 -1.944 3.045 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.539 -1.062 4.466 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.177 -0.405 3.527 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.365 -1.096 0.769 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.628 0.476 1.161 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.290 0.405 0.528 1.00 0.00 H new ATOM 1301 N ARG A 90 9.217 -0.954 4.832 1.00 0.00 N ATOM 1302 CA ARG A 90 9.262 -2.221 5.552 1.00 0.00 C ATOM 1303 C ARG A 90 10.317 -2.183 6.654 1.00 0.00 C ATOM 1304 O ARG A 90 10.465 -3.137 7.418 1.00 0.00 O ATOM 1305 CB ARG A 90 9.557 -3.370 4.587 1.00 0.00 C ATOM 1306 CG ARG A 90 10.759 -3.120 3.692 1.00 0.00 C ATOM 1307 CD ARG A 90 11.347 -4.422 3.170 1.00 0.00 C ATOM 1308 NE ARG A 90 12.190 -5.080 4.165 1.00 0.00 N ATOM 1309 CZ ARG A 90 12.939 -6.145 3.904 1.00 0.00 C ATOM 1310 NH1 ARG A 90 12.950 -6.670 2.687 1.00 0.00 N ATOM 1311 NH2 ARG A 90 13.679 -6.687 4.863 1.00 0.00 N ATOM 0 H ARG A 90 9.924 -0.858 4.103 1.00 0.00 H new ATOM 0 HA ARG A 90 8.287 -2.384 6.012 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.725 -4.281 5.161 1.00 0.00 H new ATOM 0 HB3 ARG A 90 8.680 -3.544 3.963 1.00 0.00 H new ATOM 0 HG2 ARG A 90 10.464 -2.491 2.852 1.00 0.00 H new ATOM 0 HG3 ARG A 90 11.520 -2.573 4.248 1.00 0.00 H new ATOM 0 HD2 ARG A 90 10.539 -5.093 2.878 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.934 -4.221 2.274 1.00 0.00 H new ATOM 0 HE ARG A 90 12.204 -4.701 5.112 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.382 -6.256 1.948 1.00 0.00 H new ATOM 0 HH12 ARG A 90 13.526 -7.488 2.490 1.00 0.00 H new ATOM 0 HH21 ARG A 90 13.672 -6.286 5.801 1.00 0.00 H new ATOM 0 HH22 ARG A 90 14.254 -7.505 4.662 1.00 0.00 H new ATOM 1325 N SER A 91 11.048 -1.076 6.729 1.00 0.00 N ATOM 1326 CA SER A 91 12.092 -0.915 7.734 1.00 0.00 C ATOM 1327 C SER A 91 11.529 -0.297 9.009 1.00 0.00 C ATOM 1328 O SER A 91 12.236 0.392 9.745 1.00 0.00 O ATOM 1329 CB SER A 91 13.225 -0.044 7.188 1.00 0.00 C ATOM 1330 OG SER A 91 14.297 0.036 8.111 1.00 0.00 O ATOM 0 H SER A 91 10.937 -0.277 6.105 1.00 0.00 H new ATOM 0 HA SER A 91 12.486 -1.903 7.974 1.00 0.00 H new ATOM 0 HB2 SER A 91 13.583 -0.457 6.245 1.00 0.00 H new ATOM 0 HB3 SER A 91 12.849 0.957 6.975 1.00 0.00 H new ATOM 0 HG SER A 91 13.940 0.111 9.021 1.00 0.00 H new ATOM 1336 N VAL A 92 10.248 -0.547 9.265 1.00 0.00 N ATOM 1337 CA VAL A 92 9.588 -0.016 10.451 1.00 0.00 C ATOM 1338 C VAL A 92 9.291 -1.123 11.457 1.00 0.00 C ATOM 1339 O VAL A 92 9.032 -2.265 11.080 1.00 0.00 O ATOM 1340 CB VAL A 92 8.273 0.699 10.089 1.00 0.00 C ATOM 1341 CG1 VAL A 92 7.394 -0.200 9.233 1.00 0.00 C ATOM 1342 CG2 VAL A 92 7.538 1.133 11.349 1.00 0.00 C ATOM 0 H VAL A 92 9.647 -1.114 8.666 1.00 0.00 H new ATOM 0 HA VAL A 92 10.273 0.704 10.899 1.00 0.00 H new ATOM 0 HB VAL A 92 8.513 1.591 9.510 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.469 0.322 8.987 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.921 -0.456 8.314 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.160 -1.111 9.783 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.611 1.637 11.074 1.00 0.00 H new ATOM 0 HG22 VAL A 92 7.309 0.257 11.957 1.00 0.00 H new ATOM 0 HG23 VAL A 92 8.167 1.816 11.920 1.00 0.00 H new ATOM 1352 N GLY A 93 9.332 -0.776 12.740 1.00 0.00 N ATOM 1353 CA GLY A 93 9.065 -1.752 13.781 1.00 0.00 C ATOM 1354 C GLY A 93 7.644 -2.277 13.733 1.00 0.00 C ATOM 1355 O GLY A 93 7.332 -3.172 12.948 1.00 0.00 O ATOM 0 H GLY A 93 9.545 0.163 13.077 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.760 -2.585 13.680 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.249 -1.299 14.755 1.00 0.00 H new ATOM 1359 N ASP A 94 6.780 -1.720 14.575 1.00 0.00 N ATOM 1360 CA ASP A 94 5.384 -2.138 14.626 1.00 0.00 C ATOM 1361 C ASP A 94 4.465 -1.027 14.128 1.00 0.00 C ATOM 1362 O ASP A 94 3.276 -1.246 13.898 1.00 0.00 O ATOM 1363 CB ASP A 94 5.000 -2.534 16.053 1.00 0.00 C ATOM 1364 CG ASP A 94 6.128 -3.236 16.782 1.00 0.00 C ATOM 1365 OD1 ASP A 94 6.974 -3.860 16.107 1.00 0.00 O ATOM 1366 OD2 ASP A 94 6.165 -3.162 18.028 1.00 0.00 O ATOM 0 H ASP A 94 7.022 -0.978 15.231 1.00 0.00 H new ATOM 0 HA ASP A 94 5.265 -3.003 13.973 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.711 -1.642 16.609 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.128 -3.187 16.023 1.00 0.00 H new ATOM 1371 N THR A 95 5.025 0.168 13.965 1.00 0.00 N ATOM 1372 CA THR A 95 4.256 1.315 13.497 1.00 0.00 C ATOM 1373 C THR A 95 5.150 2.319 12.779 1.00 0.00 C ATOM 1374 O THR A 95 6.257 2.616 13.231 1.00 0.00 O ATOM 1375 CB THR A 95 3.539 2.023 14.661 1.00 0.00 C ATOM 1376 OG1 THR A 95 2.929 1.055 15.523 1.00 0.00 O ATOM 1377 CG2 THR A 95 2.481 2.984 14.141 1.00 0.00 C ATOM 0 H THR A 95 6.008 0.367 14.150 1.00 0.00 H new ATOM 0 HA THR A 95 3.510 0.933 12.800 1.00 0.00 H new ATOM 0 HB THR A 95 4.280 2.592 15.222 1.00 0.00 H new ATOM 0 HG1 THR A 95 2.476 1.514 16.261 1.00 0.00 H new ATOM 0 HG21 THR A 95 1.988 3.472 14.982 1.00 0.00 H new ATOM 0 HG22 THR A 95 2.952 3.737 13.510 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.743 2.432 13.558 1.00 0.00 H new ATOM 1385 N LEU A 96 4.663 2.842 11.658 1.00 0.00 N ATOM 1386 CA LEU A 96 5.418 3.815 10.877 1.00 0.00 C ATOM 1387 C LEU A 96 4.638 5.118 10.730 1.00 0.00 C ATOM 1388 O LEU A 96 3.455 5.187 11.063 1.00 0.00 O ATOM 1389 CB LEU A 96 5.747 3.246 9.496 1.00 0.00 C ATOM 1390 CG LEU A 96 4.739 3.552 8.387 1.00 0.00 C ATOM 1391 CD1 LEU A 96 5.343 3.260 7.022 1.00 0.00 C ATOM 1392 CD2 LEU A 96 3.462 2.750 8.590 1.00 0.00 C ATOM 0 H LEU A 96 3.749 2.608 11.270 1.00 0.00 H new ATOM 0 HA LEU A 96 6.347 4.026 11.406 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.721 3.628 9.190 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.843 2.164 9.584 1.00 0.00 H new ATOM 0 HG LEU A 96 4.489 4.612 8.432 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.612 3.483 6.245 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.228 3.879 6.876 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.623 2.208 6.965 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.757 2.981 7.792 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.694 1.685 8.572 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.019 3.009 9.552 1.00 0.00 H new ATOM 1404 N THR A 97 5.309 6.150 10.228 1.00 0.00 N ATOM 1405 CA THR A 97 4.680 7.450 10.036 1.00 0.00 C ATOM 1406 C THR A 97 4.654 7.836 8.561 1.00 0.00 C ATOM 1407 O THR A 97 5.627 8.377 8.034 1.00 0.00 O ATOM 1408 CB THR A 97 5.409 8.550 10.830 1.00 0.00 C ATOM 1409 OG1 THR A 97 5.913 8.015 12.059 1.00 0.00 O ATOM 1410 CG2 THR A 97 4.475 9.715 11.124 1.00 0.00 C ATOM 0 H THR A 97 6.289 6.110 9.947 1.00 0.00 H new ATOM 0 HA THR A 97 3.658 7.364 10.404 1.00 0.00 H new ATOM 0 HB THR A 97 6.239 8.914 10.225 1.00 0.00 H new ATOM 0 HG1 THR A 97 6.377 8.720 12.557 1.00 0.00 H new ATOM 0 HG21 THR A 97 5.012 10.479 11.686 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.116 10.139 10.186 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.627 9.362 11.711 1.00 0.00 H new ATOM 1418 N VAL A 98 3.536 7.556 7.900 1.00 0.00 N ATOM 1419 CA VAL A 98 3.384 7.876 6.486 1.00 0.00 C ATOM 1420 C VAL A 98 2.758 9.253 6.298 1.00 0.00 C ATOM 1421 O VAL A 98 1.718 9.560 6.883 1.00 0.00 O ATOM 1422 CB VAL A 98 2.516 6.828 5.764 1.00 0.00 C ATOM 1423 CG1 VAL A 98 2.943 5.421 6.153 1.00 0.00 C ATOM 1424 CG2 VAL A 98 1.043 7.051 6.072 1.00 0.00 C ATOM 0 H VAL A 98 2.722 7.108 8.321 1.00 0.00 H new ATOM 0 HA VAL A 98 4.384 7.872 6.052 1.00 0.00 H new ATOM 0 HB VAL A 98 2.660 6.942 4.690 1.00 0.00 H new ATOM 0 HG11 VAL A 98 2.319 4.694 5.633 1.00 0.00 H new ATOM 0 HG12 VAL A 98 3.986 5.268 5.876 1.00 0.00 H new ATOM 0 HG13 VAL A 98 2.831 5.291 7.229 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.445 6.301 5.553 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.879 6.966 7.146 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.748 8.045 5.737 1.00 0.00 H new ATOM 1434 N LEU A 99 3.398 10.081 5.479 1.00 0.00 N ATOM 1435 CA LEU A 99 2.904 11.427 5.213 1.00 0.00 C ATOM 1436 C LEU A 99 2.096 11.465 3.920 1.00 0.00 C ATOM 1437 O LEU A 99 1.919 12.524 3.317 1.00 0.00 O ATOM 1438 CB LEU A 99 4.072 12.412 5.127 1.00 0.00 C ATOM 1439 CG LEU A 99 3.700 13.895 5.122 1.00 0.00 C ATOM 1440 CD1 LEU A 99 2.844 14.235 6.333 1.00 0.00 C ATOM 1441 CD2 LEU A 99 4.952 14.759 5.093 1.00 0.00 C ATOM 0 H LEU A 99 4.260 9.843 4.988 1.00 0.00 H new ATOM 0 HA LEU A 99 2.251 11.717 6.036 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.739 12.228 5.969 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.637 12.197 4.220 1.00 0.00 H new ATOM 0 HG LEU A 99 3.120 14.101 4.223 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.589 15.295 6.312 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.930 13.641 6.311 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.399 14.013 7.245 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.668 15.811 5.090 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.559 14.550 5.974 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.527 14.536 4.195 1.00 0.00 H new ATOM 1453 N VAL A 100 1.605 10.303 3.500 1.00 0.00 N ATOM 1454 CA VAL A 100 0.813 10.204 2.280 1.00 0.00 C ATOM 1455 C VAL A 100 -0.300 11.246 2.262 1.00 0.00 C ATOM 1456 O VAL A 100 -0.473 12.002 3.219 1.00 0.00 O ATOM 1457 CB VAL A 100 0.191 8.803 2.128 1.00 0.00 C ATOM 1458 CG1 VAL A 100 1.274 7.734 2.137 1.00 0.00 C ATOM 1459 CG2 VAL A 100 -0.829 8.550 3.228 1.00 0.00 C ATOM 0 H VAL A 100 1.742 9.417 3.987 1.00 0.00 H new ATOM 0 HA VAL A 100 1.491 10.386 1.446 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.325 8.756 1.169 1.00 0.00 H new ATOM 0 HG11 VAL A 100 0.816 6.751 2.029 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.963 7.907 1.310 1.00 0.00 H new ATOM 0 HG13 VAL A 100 1.821 7.778 3.079 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.258 7.556 3.105 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.340 8.616 4.200 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.621 9.297 3.169 1.00 0.00 H new ATOM 1469 N CYS A 101 -1.052 11.281 1.168 1.00 0.00 N ATOM 1470 CA CYS A 101 -2.149 12.231 1.023 1.00 0.00 C ATOM 1471 C CYS A 101 -3.007 11.891 -0.191 1.00 0.00 C ATOM 1472 O CYS A 101 -2.507 11.380 -1.193 1.00 0.00 O ATOM 1473 CB CYS A 101 -1.605 13.655 0.896 1.00 0.00 C ATOM 1474 SG CYS A 101 -1.146 14.122 -0.789 1.00 0.00 S ATOM 0 H CYS A 101 -0.922 10.662 0.368 1.00 0.00 H new ATOM 0 HA CYS A 101 -2.773 12.166 1.915 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -2.357 14.354 1.263 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -0.732 13.758 1.541 1.00 0.00 H new ATOM 0 HG CYS A 101 -1.362 13.122 -1.591 1.00 0.00 H new ATOM 1480 N ASP A 102 -4.301 12.177 -0.094 1.00 0.00 N ATOM 1481 CA ASP A 102 -5.229 11.901 -1.184 1.00 0.00 C ATOM 1482 C ASP A 102 -4.624 12.299 -2.527 1.00 0.00 C ATOM 1483 O ASP A 102 -4.399 13.479 -2.792 1.00 0.00 O ATOM 1484 CB ASP A 102 -6.545 12.647 -0.963 1.00 0.00 C ATOM 1485 CG ASP A 102 -6.865 12.833 0.508 1.00 0.00 C ATOM 1486 OD1 ASP A 102 -7.064 11.816 1.204 1.00 0.00 O ATOM 1487 OD2 ASP A 102 -6.918 13.996 0.961 1.00 0.00 O ATOM 0 H ASP A 102 -4.731 12.600 0.729 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.426 10.829 -1.198 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.492 13.622 -1.447 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.356 12.098 -1.442 1.00 0.00 H new ATOM 1492 N GLY A 103 -4.362 11.305 -3.370 1.00 0.00 N ATOM 1493 CA GLY A 103 -3.784 11.572 -4.674 1.00 0.00 C ATOM 1494 C GLY A 103 -4.832 11.666 -5.765 1.00 0.00 C ATOM 1495 O GLY A 103 -4.776 12.554 -6.616 1.00 0.00 O ATOM 0 H GLY A 103 -4.540 10.320 -3.173 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.221 12.504 -4.634 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -3.075 10.782 -4.922 1.00 0.00 H new ATOM 1499 N PHE A 104 -5.791 10.746 -5.742 1.00 0.00 N ATOM 1500 CA PHE A 104 -6.856 10.727 -6.738 1.00 0.00 C ATOM 1501 C PHE A 104 -8.082 9.988 -6.210 1.00 0.00 C ATOM 1502 O PHE A 104 -7.992 8.833 -5.795 1.00 0.00 O ATOM 1503 CB PHE A 104 -6.365 10.066 -8.028 1.00 0.00 C ATOM 1504 CG PHE A 104 -4.892 10.241 -8.268 1.00 0.00 C ATOM 1505 CD1 PHE A 104 -3.970 9.445 -7.607 1.00 0.00 C ATOM 1506 CD2 PHE A 104 -4.430 11.201 -9.153 1.00 0.00 C ATOM 1507 CE1 PHE A 104 -2.615 9.603 -7.826 1.00 0.00 C ATOM 1508 CE2 PHE A 104 -3.076 11.363 -9.376 1.00 0.00 C ATOM 1509 CZ PHE A 104 -2.167 10.564 -8.711 1.00 0.00 C ATOM 0 H PHE A 104 -5.852 10.004 -5.045 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.139 11.758 -6.950 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.595 9.001 -7.992 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -6.915 10.482 -8.872 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -4.315 8.693 -6.913 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -5.136 11.830 -9.675 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -1.907 8.975 -7.306 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -2.729 12.114 -10.070 1.00 0.00 H new ATOM 0 HZ PHE A 104 -1.108 10.690 -8.883 1.00 0.00 H new ATOM 1519 N GLU A 105 -9.227 10.664 -6.228 1.00 0.00 N ATOM 1520 CA GLU A 105 -10.470 10.072 -5.750 1.00 0.00 C ATOM 1521 C GLU A 105 -10.554 8.597 -6.133 1.00 0.00 C ATOM 1522 O GLU A 105 -10.874 7.746 -5.303 1.00 0.00 O ATOM 1523 CB GLU A 105 -11.673 10.827 -6.320 1.00 0.00 C ATOM 1524 CG GLU A 105 -12.035 12.076 -5.535 1.00 0.00 C ATOM 1525 CD GLU A 105 -12.864 13.054 -6.344 1.00 0.00 C ATOM 1526 OE1 GLU A 105 -12.596 13.199 -7.555 1.00 0.00 O ATOM 1527 OE2 GLU A 105 -13.781 13.674 -5.766 1.00 0.00 O ATOM 0 H GLU A 105 -9.319 11.621 -6.568 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.483 10.148 -4.663 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -11.461 11.106 -7.352 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -12.534 10.159 -6.341 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -12.588 11.790 -4.640 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.122 12.569 -5.202 1.00 0.00 H new ATOM 1534 N SER A 106 -10.264 8.303 -7.396 1.00 0.00 N ATOM 1535 CA SER A 106 -10.310 6.932 -7.892 1.00 0.00 C ATOM 1536 C SER A 106 -11.627 6.262 -7.515 1.00 0.00 C ATOM 1537 O SER A 106 -11.653 5.100 -7.112 1.00 0.00 O ATOM 1538 CB SER A 106 -9.136 6.125 -7.333 1.00 0.00 C ATOM 1539 OG SER A 106 -7.994 6.243 -8.164 1.00 0.00 O ATOM 0 H SER A 106 -9.995 8.995 -8.095 1.00 0.00 H new ATOM 0 HA SER A 106 -10.236 6.963 -8.979 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.896 6.474 -6.329 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.420 5.076 -7.247 1.00 0.00 H new ATOM 0 HG SER A 106 -7.258 5.720 -7.784 1.00 0.00 H new ATOM 1545 N GLY A 107 -12.722 7.005 -7.649 1.00 0.00 N ATOM 1546 CA GLY A 107 -14.029 6.468 -7.318 1.00 0.00 C ATOM 1547 C GLY A 107 -14.803 6.029 -8.545 1.00 0.00 C ATOM 1548 O GLY A 107 -14.677 6.609 -9.624 1.00 0.00 O ATOM 0 H GLY A 107 -12.727 7.969 -7.981 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -13.910 5.619 -6.645 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -14.603 7.223 -6.781 1.00 0.00 H new ATOM 1552 N PRO A 108 -15.624 4.981 -8.388 1.00 0.00 N ATOM 1553 CA PRO A 108 -16.437 4.441 -9.482 1.00 0.00 C ATOM 1554 C PRO A 108 -17.562 5.386 -9.889 1.00 0.00 C ATOM 1555 O PRO A 108 -17.754 6.437 -9.278 1.00 0.00 O ATOM 1556 CB PRO A 108 -17.010 3.149 -8.894 1.00 0.00 C ATOM 1557 CG PRO A 108 -17.016 3.373 -7.421 1.00 0.00 C ATOM 1558 CD PRO A 108 -15.823 4.242 -7.130 1.00 0.00 C ATOM 0 HA PRO A 108 -15.851 4.290 -10.389 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -18.015 2.955 -9.269 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -16.398 2.287 -9.161 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -17.939 3.858 -7.104 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -16.951 2.428 -6.882 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -16.011 4.915 -6.294 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -14.947 3.648 -6.870 1.00 0.00 H new ATOM 1566 N SER A 109 -18.303 5.005 -10.925 1.00 0.00 N ATOM 1567 CA SER A 109 -19.407 5.821 -11.416 1.00 0.00 C ATOM 1568 C SER A 109 -20.699 5.011 -11.469 1.00 0.00 C ATOM 1569 O SER A 109 -20.700 3.849 -11.873 1.00 0.00 O ATOM 1570 CB SER A 109 -19.082 6.374 -12.805 1.00 0.00 C ATOM 1571 OG SER A 109 -20.236 6.923 -13.418 1.00 0.00 O ATOM 0 H SER A 109 -18.159 4.137 -11.440 1.00 0.00 H new ATOM 0 HA SER A 109 -19.547 6.652 -10.725 1.00 0.00 H new ATOM 0 HB2 SER A 109 -18.310 7.140 -12.724 1.00 0.00 H new ATOM 0 HB3 SER A 109 -18.677 5.579 -13.431 1.00 0.00 H new ATOM 0 HG SER A 109 -20.002 7.271 -14.304 1.00 0.00 H new ATOM 1577 N SER A 110 -21.798 5.635 -11.056 1.00 0.00 N ATOM 1578 CA SER A 110 -23.097 4.973 -11.051 1.00 0.00 C ATOM 1579 C SER A 110 -23.383 4.329 -12.405 1.00 0.00 C ATOM 1580 O SER A 110 -22.964 4.833 -13.446 1.00 0.00 O ATOM 1581 CB SER A 110 -24.202 5.973 -10.705 1.00 0.00 C ATOM 1582 OG SER A 110 -24.365 6.930 -11.737 1.00 0.00 O ATOM 0 H SER A 110 -21.814 6.598 -10.721 1.00 0.00 H new ATOM 0 HA SER A 110 -23.076 4.190 -10.293 1.00 0.00 H new ATOM 0 HB2 SER A 110 -25.140 5.442 -10.546 1.00 0.00 H new ATOM 0 HB3 SER A 110 -23.959 6.479 -9.771 1.00 0.00 H new ATOM 0 HG SER A 110 -25.078 7.556 -11.493 1.00 0.00 H new ATOM 1588 N GLY A 111 -24.101 3.210 -12.381 1.00 0.00 N ATOM 1589 CA GLY A 111 -24.432 2.515 -13.611 1.00 0.00 C ATOM 1590 C GLY A 111 -23.207 1.958 -14.310 1.00 0.00 C ATOM 1591 O GLY A 111 -22.969 0.751 -14.291 1.00 0.00 O ATOM 0 H GLY A 111 -24.459 2.773 -11.532 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -25.122 1.701 -13.390 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -24.950 3.199 -14.283 1.00 0.00 H new TER 1595 GLY A 111