USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 798 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 Single : A 1 GLY N :NH3+ -128:sc= 0.118 (180deg=0) USER MOD Single : A 2 SER OG : rot 41:sc= 1.11 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 9 GLN : amide:sc= -0.191 K(o=-0.19,f=-1.1) USER MOD Single : A 15 ASN : amide:sc= -0.0225 K(o=-0.022,f=-3.5!) USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 20 GLN : amide:sc= -0.299 K(o=-0.3,f=-1.1) USER MOD Single : A 33 SER OG : rot 34:sc= 0.0229 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.00578 USER MOD Single : A 38 LYS NZ :NH3+ 147:sc= -0.388 (180deg=-1.66!) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 45 GLN : amide:sc= -0.444 K(o=-0.44,f=-3.1!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 HIS : no HE2:sc= -2.42 K(o=-2.4,f=-8.7!) USER MOD Single : A 54 SER OG : rot 180:sc= 0.25 USER MOD Single : A 57 GLN : amide:sc= -1.25 K(o=-1.2,f=-2.3!) USER MOD Single : A 61 HIS : no HE2:sc= -0.26 K(o=-0.26,f=-1.2) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -0.015 X(o=-0.015,f=0) USER MOD Single : A 69 MET CE :methyl 145:sc=-0.00442 (180deg=-1.61) USER MOD Single : A 73 ASN : amide:sc= -0.621 K(o=-0.62,f=-3) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.0592 X(o=-0.059,f=-0.38) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot -130:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.364) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 41.421 -7.587 -4.831 1.00 0.00 N ATOM 2 CA GLY A 1 39.984 -7.506 -4.631 1.00 0.00 C ATOM 3 C GLY A 1 39.488 -8.656 -3.752 1.00 0.00 C ATOM 4 O GLY A 1 40.286 -9.357 -3.132 1.00 0.00 O ATOM 0 H1 GLY A 1 41.857 -6.675 -4.588 1.00 0.00 H new ATOM 0 H2 GLY A 1 41.815 -8.332 -4.222 1.00 0.00 H new ATOM 0 H3 GLY A 1 41.621 -7.812 -5.826 1.00 0.00 H new ATOM 0 HA2 GLY A 1 39.731 -6.553 -4.166 1.00 0.00 H new ATOM 0 HA3 GLY A 1 39.477 -7.535 -5.595 1.00 0.00 H new ATOM 8 N SER A 2 38.172 -8.813 -3.725 1.00 0.00 N ATOM 9 CA SER A 2 37.560 -9.865 -2.932 1.00 0.00 C ATOM 10 C SER A 2 36.080 -10.001 -3.296 1.00 0.00 C ATOM 11 O SER A 2 35.534 -9.164 -4.012 1.00 0.00 O ATOM 12 CB SER A 2 37.715 -9.587 -1.435 1.00 0.00 C ATOM 13 OG SER A 2 38.924 -10.132 -0.913 1.00 0.00 O ATOM 0 H SER A 2 37.513 -8.229 -4.240 1.00 0.00 H new ATOM 0 HA SER A 2 38.070 -10.802 -3.155 1.00 0.00 H new ATOM 0 HB2 SER A 2 37.698 -8.511 -1.263 1.00 0.00 H new ATOM 0 HB3 SER A 2 36.866 -10.009 -0.898 1.00 0.00 H new ATOM 0 HG SER A 2 39.651 -9.989 -1.554 1.00 0.00 H new ATOM 19 N SER A 3 35.474 -11.063 -2.786 1.00 0.00 N ATOM 20 CA SER A 3 34.068 -11.319 -3.048 1.00 0.00 C ATOM 21 C SER A 3 33.541 -12.383 -2.083 1.00 0.00 C ATOM 22 O SER A 3 34.315 -13.013 -1.365 1.00 0.00 O ATOM 23 CB SER A 3 33.850 -11.762 -4.496 1.00 0.00 C ATOM 24 OG SER A 3 34.180 -13.134 -4.691 1.00 0.00 O ATOM 0 H SER A 3 35.931 -11.756 -2.193 1.00 0.00 H new ATOM 0 HA SER A 3 33.517 -10.392 -2.893 1.00 0.00 H new ATOM 0 HB2 SER A 3 32.809 -11.597 -4.772 1.00 0.00 H new ATOM 0 HB3 SER A 3 34.457 -11.146 -5.159 1.00 0.00 H new ATOM 0 HG SER A 3 34.025 -13.378 -5.628 1.00 0.00 H new ATOM 30 N GLY A 4 32.226 -12.550 -2.097 1.00 0.00 N ATOM 31 CA GLY A 4 31.587 -13.527 -1.232 1.00 0.00 C ATOM 32 C GLY A 4 30.360 -14.140 -1.910 1.00 0.00 C ATOM 33 O GLY A 4 30.122 -13.911 -3.095 1.00 0.00 O ATOM 0 H GLY A 4 31.586 -12.025 -2.694 1.00 0.00 H new ATOM 0 HA2 GLY A 4 32.298 -14.314 -0.978 1.00 0.00 H new ATOM 0 HA3 GLY A 4 31.291 -13.052 -0.297 1.00 0.00 H new ATOM 37 N SER A 5 29.613 -14.907 -1.129 1.00 0.00 N ATOM 38 CA SER A 5 28.417 -15.555 -1.640 1.00 0.00 C ATOM 39 C SER A 5 27.496 -15.940 -0.481 1.00 0.00 C ATOM 40 O SER A 5 27.887 -15.854 0.683 1.00 0.00 O ATOM 41 CB SER A 5 28.771 -16.790 -2.470 1.00 0.00 C ATOM 42 OG SER A 5 29.329 -17.829 -1.670 1.00 0.00 O ATOM 0 H SER A 5 29.813 -15.094 -0.146 1.00 0.00 H new ATOM 0 HA SER A 5 27.898 -14.851 -2.290 1.00 0.00 H new ATOM 0 HB2 SER A 5 27.876 -17.159 -2.971 1.00 0.00 H new ATOM 0 HB3 SER A 5 29.480 -16.512 -3.249 1.00 0.00 H new ATOM 0 HG SER A 5 29.540 -18.600 -2.236 1.00 0.00 H new ATOM 48 N SER A 6 26.290 -16.358 -0.838 1.00 0.00 N ATOM 49 CA SER A 6 25.311 -16.757 0.157 1.00 0.00 C ATOM 50 C SER A 6 24.235 -17.633 -0.489 1.00 0.00 C ATOM 51 O SER A 6 24.063 -17.614 -1.706 1.00 0.00 O ATOM 52 CB SER A 6 24.673 -15.536 0.823 1.00 0.00 C ATOM 53 OG SER A 6 23.837 -14.813 -0.077 1.00 0.00 O ATOM 0 H SER A 6 25.969 -16.429 -1.804 1.00 0.00 H new ATOM 0 HA SER A 6 25.823 -17.332 0.929 1.00 0.00 H new ATOM 0 HB2 SER A 6 24.087 -15.858 1.684 1.00 0.00 H new ATOM 0 HB3 SER A 6 25.456 -14.877 1.199 1.00 0.00 H new ATOM 0 HG SER A 6 23.447 -14.042 0.386 1.00 0.00 H new ATOM 59 N GLY A 7 23.538 -18.379 0.356 1.00 0.00 N ATOM 60 CA GLY A 7 22.484 -19.259 -0.117 1.00 0.00 C ATOM 61 C GLY A 7 21.132 -18.866 0.481 1.00 0.00 C ATOM 62 O GLY A 7 21.074 -18.117 1.454 1.00 0.00 O ATOM 0 H GLY A 7 23.683 -18.392 1.366 1.00 0.00 H new ATOM 0 HA2 GLY A 7 22.431 -19.216 -1.205 1.00 0.00 H new ATOM 0 HA3 GLY A 7 22.718 -20.289 0.151 1.00 0.00 H new ATOM 66 N ASP A 8 20.077 -19.389 -0.128 1.00 0.00 N ATOM 67 CA ASP A 8 18.729 -19.102 0.332 1.00 0.00 C ATOM 68 C ASP A 8 17.728 -19.904 -0.502 1.00 0.00 C ATOM 69 O ASP A 8 16.865 -20.588 0.045 1.00 0.00 O ATOM 70 CB ASP A 8 18.397 -17.617 0.171 1.00 0.00 C ATOM 71 CG ASP A 8 18.129 -16.869 1.478 1.00 0.00 C ATOM 72 OD1 ASP A 8 17.902 -17.562 2.493 1.00 0.00 O ATOM 73 OD2 ASP A 8 18.159 -15.620 1.433 1.00 0.00 O ATOM 0 H ASP A 8 20.129 -20.010 -0.936 1.00 0.00 H new ATOM 0 HA ASP A 8 18.667 -19.373 1.386 1.00 0.00 H new ATOM 0 HB2 ASP A 8 19.223 -17.129 -0.346 1.00 0.00 H new ATOM 0 HB3 ASP A 8 17.520 -17.524 -0.470 1.00 0.00 H new ATOM 78 N GLN A 9 17.878 -19.793 -1.814 1.00 0.00 N ATOM 79 CA GLN A 9 16.998 -20.499 -2.730 1.00 0.00 C ATOM 80 C GLN A 9 15.545 -20.078 -2.501 1.00 0.00 C ATOM 81 O GLN A 9 15.218 -19.500 -1.466 1.00 0.00 O ATOM 82 CB GLN A 9 17.158 -22.014 -2.586 1.00 0.00 C ATOM 83 CG GLN A 9 18.591 -22.446 -2.906 1.00 0.00 C ATOM 84 CD GLN A 9 18.925 -22.190 -4.377 1.00 0.00 C ATOM 85 OE1 GLN A 9 18.064 -22.166 -5.241 1.00 0.00 O ATOM 86 NE2 GLN A 9 20.220 -22.000 -4.613 1.00 0.00 N ATOM 0 H GLN A 9 18.596 -19.225 -2.264 1.00 0.00 H new ATOM 0 HA GLN A 9 17.277 -20.232 -3.749 1.00 0.00 H new ATOM 0 HB2 GLN A 9 16.901 -22.316 -1.570 1.00 0.00 H new ATOM 0 HB3 GLN A 9 16.463 -22.522 -3.255 1.00 0.00 H new ATOM 0 HG2 GLN A 9 19.289 -21.901 -2.271 1.00 0.00 H new ATOM 0 HG3 GLN A 9 18.714 -23.505 -2.680 1.00 0.00 H new ATOM 0 HE21 GLN A 9 20.889 -22.033 -3.844 1.00 0.00 H new ATOM 0 HE22 GLN A 9 20.544 -21.821 -5.563 1.00 0.00 H new ATOM 95 N GLU A 10 14.712 -20.384 -3.485 1.00 0.00 N ATOM 96 CA GLU A 10 13.301 -20.044 -3.404 1.00 0.00 C ATOM 97 C GLU A 10 12.441 -21.275 -3.694 1.00 0.00 C ATOM 98 O GLU A 10 12.779 -22.084 -4.556 1.00 0.00 O ATOM 99 CB GLU A 10 12.958 -18.898 -4.358 1.00 0.00 C ATOM 100 CG GLU A 10 13.995 -17.778 -4.265 1.00 0.00 C ATOM 101 CD GLU A 10 13.335 -16.405 -4.412 1.00 0.00 C ATOM 102 OE1 GLU A 10 12.784 -16.154 -5.505 1.00 0.00 O ATOM 103 OE2 GLU A 10 13.397 -15.638 -3.427 1.00 0.00 O ATOM 0 H GLU A 10 14.987 -20.863 -4.342 1.00 0.00 H new ATOM 0 HA GLU A 10 13.086 -19.706 -2.390 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.913 -19.273 -5.381 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.970 -18.504 -4.119 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.513 -17.836 -3.308 1.00 0.00 H new ATOM 0 HG3 GLU A 10 14.747 -17.909 -5.043 1.00 0.00 H new ATOM 110 N VAL A 11 11.345 -21.379 -2.956 1.00 0.00 N ATOM 111 CA VAL A 11 10.434 -22.498 -3.124 1.00 0.00 C ATOM 112 C VAL A 11 8.993 -21.984 -3.105 1.00 0.00 C ATOM 113 O VAL A 11 8.211 -22.284 -4.007 1.00 0.00 O ATOM 114 CB VAL A 11 10.704 -23.557 -2.053 1.00 0.00 C ATOM 115 CG1 VAL A 11 9.622 -24.639 -2.067 1.00 0.00 C ATOM 116 CG2 VAL A 11 12.095 -24.170 -2.227 1.00 0.00 C ATOM 0 H VAL A 11 11.068 -20.707 -2.241 1.00 0.00 H new ATOM 0 HA VAL A 11 10.595 -22.980 -4.088 1.00 0.00 H new ATOM 0 HB VAL A 11 10.674 -23.066 -1.080 1.00 0.00 H new ATOM 0 HG11 VAL A 11 9.838 -25.379 -1.296 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.651 -24.185 -1.872 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.606 -25.125 -3.043 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.262 -24.919 -1.453 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.166 -24.639 -3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.850 -23.388 -2.144 1.00 0.00 H new ATOM 126 N ARG A 12 8.684 -21.219 -2.069 1.00 0.00 N ATOM 127 CA ARG A 12 7.351 -20.660 -1.921 1.00 0.00 C ATOM 128 C ARG A 12 7.334 -19.613 -0.805 1.00 0.00 C ATOM 129 O ARG A 12 6.706 -18.565 -0.943 1.00 0.00 O ATOM 130 CB ARG A 12 6.328 -21.752 -1.602 1.00 0.00 C ATOM 131 CG ARG A 12 6.849 -22.689 -0.510 1.00 0.00 C ATOM 132 CD ARG A 12 6.057 -22.512 0.787 1.00 0.00 C ATOM 133 NE ARG A 12 5.749 -23.835 1.376 1.00 0.00 N ATOM 134 CZ ARG A 12 4.790 -24.654 0.923 1.00 0.00 C ATOM 135 NH1 ARG A 12 4.040 -24.291 -0.127 1.00 0.00 N ATOM 136 NH2 ARG A 12 4.581 -25.835 1.519 1.00 0.00 N ATOM 0 H ARG A 12 9.335 -20.973 -1.323 1.00 0.00 H new ATOM 0 HA ARG A 12 7.082 -20.191 -2.867 1.00 0.00 H new ATOM 0 HB2 ARG A 12 5.392 -21.296 -1.279 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.109 -22.324 -2.503 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.775 -23.723 -0.847 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.904 -22.488 -0.326 1.00 0.00 H new ATOM 0 HD2 ARG A 12 6.631 -21.914 1.495 1.00 0.00 H new ATOM 0 HD3 ARG A 12 5.133 -21.969 0.588 1.00 0.00 H new ATOM 0 HE ARG A 12 6.301 -24.142 2.177 1.00 0.00 H new ATOM 0 HH11 ARG A 12 4.199 -23.392 -0.581 1.00 0.00 H new ATOM 0 HH12 ARG A 12 3.310 -24.914 -0.472 1.00 0.00 H new ATOM 0 HH21 ARG A 12 5.152 -26.111 2.318 1.00 0.00 H new ATOM 0 HH22 ARG A 12 3.851 -26.458 1.174 1.00 0.00 H new ATOM 150 N LEU A 13 8.032 -19.935 0.274 1.00 0.00 N ATOM 151 CA LEU A 13 8.105 -19.035 1.413 1.00 0.00 C ATOM 152 C LEU A 13 6.692 -18.753 1.926 1.00 0.00 C ATOM 153 O LEU A 13 6.045 -17.804 1.485 1.00 0.00 O ATOM 154 CB LEU A 13 8.891 -17.774 1.050 1.00 0.00 C ATOM 155 CG LEU A 13 10.098 -17.457 1.936 1.00 0.00 C ATOM 156 CD1 LEU A 13 11.311 -17.064 1.090 1.00 0.00 C ATOM 157 CD2 LEU A 13 9.750 -16.386 2.972 1.00 0.00 C ATOM 0 H LEU A 13 8.552 -20.806 0.384 1.00 0.00 H new ATOM 0 HA LEU A 13 8.654 -19.500 2.231 1.00 0.00 H new ATOM 0 HB2 LEU A 13 9.236 -17.869 0.020 1.00 0.00 H new ATOM 0 HB3 LEU A 13 8.210 -16.924 1.081 1.00 0.00 H new ATOM 0 HG LEU A 13 10.367 -18.360 2.484 1.00 0.00 H new ATOM 0 HD11 LEU A 13 12.155 -16.844 1.744 1.00 0.00 H new ATOM 0 HD12 LEU A 13 11.573 -17.887 0.425 1.00 0.00 H new ATOM 0 HD13 LEU A 13 11.071 -16.181 0.498 1.00 0.00 H new ATOM 0 HD21 LEU A 13 10.624 -16.179 3.589 1.00 0.00 H new ATOM 0 HD22 LEU A 13 9.441 -15.473 2.462 1.00 0.00 H new ATOM 0 HD23 LEU A 13 8.936 -16.742 3.604 1.00 0.00 H new ATOM 169 N GLU A 14 6.253 -19.594 2.851 1.00 0.00 N ATOM 170 CA GLU A 14 4.928 -19.447 3.429 1.00 0.00 C ATOM 171 C GLU A 14 5.016 -18.751 4.788 1.00 0.00 C ATOM 172 O GLU A 14 4.810 -19.379 5.826 1.00 0.00 O ATOM 173 CB GLU A 14 4.229 -20.803 3.551 1.00 0.00 C ATOM 174 CG GLU A 14 2.721 -20.627 3.738 1.00 0.00 C ATOM 175 CD GLU A 14 1.979 -21.937 3.463 1.00 0.00 C ATOM 176 OE1 GLU A 14 1.961 -22.782 4.383 1.00 0.00 O ATOM 177 OE2 GLU A 14 1.446 -22.062 2.340 1.00 0.00 O ATOM 0 H GLU A 14 6.792 -20.380 3.215 1.00 0.00 H new ATOM 0 HA GLU A 14 4.329 -18.826 2.763 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.421 -21.397 2.658 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.642 -21.354 4.396 1.00 0.00 H new ATOM 0 HG2 GLU A 14 2.513 -20.293 4.755 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.356 -19.850 3.067 1.00 0.00 H new ATOM 184 N ASN A 15 5.323 -17.463 4.739 1.00 0.00 N ATOM 185 CA ASN A 15 5.441 -16.675 5.954 1.00 0.00 C ATOM 186 C ASN A 15 5.139 -15.209 5.637 1.00 0.00 C ATOM 187 O ASN A 15 5.175 -14.800 4.478 1.00 0.00 O ATOM 188 CB ASN A 15 6.858 -16.753 6.526 1.00 0.00 C ATOM 189 CG ASN A 15 6.880 -16.331 7.996 1.00 0.00 C ATOM 190 OD1 ASN A 15 5.866 -16.298 8.675 1.00 0.00 O ATOM 191 ND2 ASN A 15 8.089 -16.011 8.449 1.00 0.00 N ATOM 0 H ASN A 15 5.494 -16.945 3.877 1.00 0.00 H new ATOM 0 HA ASN A 15 4.735 -17.073 6.684 1.00 0.00 H new ATOM 0 HB2 ASN A 15 7.237 -17.770 6.430 1.00 0.00 H new ATOM 0 HB3 ASN A 15 7.523 -16.110 5.949 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.209 -15.716 9.418 1.00 0.00 H new ATOM 0 HD22 ASN A 15 8.896 -16.060 7.827 1.00 0.00 H new ATOM 198 N ARG A 16 4.847 -14.457 6.689 1.00 0.00 N ATOM 199 CA ARG A 16 4.539 -13.045 6.537 1.00 0.00 C ATOM 200 C ARG A 16 5.508 -12.394 5.549 1.00 0.00 C ATOM 201 O ARG A 16 6.724 -12.479 5.718 1.00 0.00 O ATOM 202 CB ARG A 16 4.624 -12.316 7.880 1.00 0.00 C ATOM 203 CG ARG A 16 3.259 -12.276 8.569 1.00 0.00 C ATOM 204 CD ARG A 16 3.273 -13.093 9.862 1.00 0.00 C ATOM 205 NE ARG A 16 3.041 -12.206 11.024 1.00 0.00 N ATOM 206 CZ ARG A 16 4.005 -11.510 11.642 1.00 0.00 C ATOM 207 NH1 ARG A 16 5.272 -11.593 11.213 1.00 0.00 N ATOM 208 NH2 ARG A 16 3.702 -10.730 12.689 1.00 0.00 N ATOM 0 H ARG A 16 4.817 -14.799 7.649 1.00 0.00 H new ATOM 0 HA ARG A 16 3.520 -12.966 6.157 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.346 -12.817 8.525 1.00 0.00 H new ATOM 0 HB3 ARG A 16 4.987 -11.300 7.724 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.990 -11.243 8.790 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.496 -12.667 7.896 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.503 -13.864 9.823 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.230 -13.603 9.969 1.00 0.00 H new ATOM 0 HE ARG A 16 2.088 -12.119 11.376 1.00 0.00 H new ATOM 0 HH11 ARG A 16 5.503 -12.186 10.416 1.00 0.00 H new ATOM 0 HH12 ARG A 16 6.006 -11.063 11.684 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.738 -10.666 13.015 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.436 -10.200 13.159 1.00 0.00 H new ATOM 222 N ILE A 17 4.934 -11.758 4.538 1.00 0.00 N ATOM 223 CA ILE A 17 5.731 -11.092 3.522 1.00 0.00 C ATOM 224 C ILE A 17 5.727 -9.584 3.783 1.00 0.00 C ATOM 225 O ILE A 17 4.831 -9.069 4.451 1.00 0.00 O ATOM 226 CB ILE A 17 5.246 -11.476 2.123 1.00 0.00 C ATOM 227 CG1 ILE A 17 3.856 -10.897 1.847 1.00 0.00 C ATOM 228 CG2 ILE A 17 5.284 -12.992 1.926 1.00 0.00 C ATOM 229 CD1 ILE A 17 3.930 -9.390 1.595 1.00 0.00 C ATOM 0 H ILE A 17 3.926 -11.690 4.401 1.00 0.00 H new ATOM 0 HA ILE A 17 6.769 -11.422 3.575 1.00 0.00 H new ATOM 0 HB ILE A 17 5.928 -11.040 1.393 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.417 -11.393 0.981 1.00 0.00 H new ATOM 0 HG13 ILE A 17 3.200 -11.096 2.695 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.934 -13.237 0.923 1.00 0.00 H new ATOM 0 HG22 ILE A 17 6.306 -13.350 2.052 1.00 0.00 H new ATOM 0 HG23 ILE A 17 4.639 -13.471 2.663 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.929 -9.004 1.402 1.00 0.00 H new ATOM 0 HD12 ILE A 17 4.347 -8.895 2.472 1.00 0.00 H new ATOM 0 HD13 ILE A 17 4.567 -9.196 0.732 1.00 0.00 H new ATOM 241 N THR A 18 6.737 -8.920 3.243 1.00 0.00 N ATOM 242 CA THR A 18 6.861 -7.481 3.409 1.00 0.00 C ATOM 243 C THR A 18 7.282 -6.827 2.092 1.00 0.00 C ATOM 244 O THR A 18 7.842 -7.487 1.218 1.00 0.00 O ATOM 245 CB THR A 18 7.837 -7.220 4.557 1.00 0.00 C ATOM 246 OG1 THR A 18 7.404 -8.102 5.589 1.00 0.00 O ATOM 247 CG2 THR A 18 7.668 -5.826 5.164 1.00 0.00 C ATOM 0 H THR A 18 7.478 -9.351 2.690 1.00 0.00 H new ATOM 0 HA THR A 18 5.904 -7.029 3.668 1.00 0.00 H new ATOM 0 HB THR A 18 8.859 -7.338 4.197 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.984 -7.999 6.372 1.00 0.00 H new ATOM 0 HG21 THR A 18 8.385 -5.693 5.974 1.00 0.00 H new ATOM 0 HG22 THR A 18 7.843 -5.072 4.397 1.00 0.00 H new ATOM 0 HG23 THR A 18 6.656 -5.719 5.554 1.00 0.00 H new ATOM 255 N PHE A 19 6.998 -5.537 1.991 1.00 0.00 N ATOM 256 CA PHE A 19 7.340 -4.786 0.796 1.00 0.00 C ATOM 257 C PHE A 19 7.511 -3.299 1.112 1.00 0.00 C ATOM 258 O PHE A 19 7.111 -2.838 2.180 1.00 0.00 O ATOM 259 CB PHE A 19 6.181 -4.956 -0.188 1.00 0.00 C ATOM 260 CG PHE A 19 4.823 -4.526 0.371 1.00 0.00 C ATOM 261 CD1 PHE A 19 4.429 -3.227 0.278 1.00 0.00 C ATOM 262 CD2 PHE A 19 4.009 -5.442 0.962 1.00 0.00 C ATOM 263 CE1 PHE A 19 3.169 -2.828 0.797 1.00 0.00 C ATOM 264 CE2 PHE A 19 2.749 -5.043 1.481 1.00 0.00 C ATOM 265 CZ PHE A 19 2.356 -3.744 1.387 1.00 0.00 C ATOM 0 H PHE A 19 6.534 -4.993 2.718 1.00 0.00 H new ATOM 0 HA PHE A 19 8.280 -5.153 0.384 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.393 -4.377 -1.087 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.124 -6.002 -0.489 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.075 -2.499 -0.191 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.321 -6.473 1.036 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.857 -1.797 0.723 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.103 -5.770 1.950 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.398 -3.440 1.781 1.00 0.00 H new ATOM 275 N GLN A 20 8.105 -2.589 0.165 1.00 0.00 N ATOM 276 CA GLN A 20 8.334 -1.163 0.329 1.00 0.00 C ATOM 277 C GLN A 20 7.284 -0.365 -0.447 1.00 0.00 C ATOM 278 O GLN A 20 6.748 -0.843 -1.445 1.00 0.00 O ATOM 279 CB GLN A 20 9.749 -0.780 -0.109 1.00 0.00 C ATOM 280 CG GLN A 20 10.758 -1.036 1.012 1.00 0.00 C ATOM 281 CD GLN A 20 12.189 -0.804 0.524 1.00 0.00 C ATOM 282 OE1 GLN A 20 12.862 0.135 0.918 1.00 0.00 O ATOM 283 NE2 GLN A 20 12.616 -1.708 -0.353 1.00 0.00 N ATOM 0 H GLN A 20 8.435 -2.975 -0.720 1.00 0.00 H new ATOM 0 HA GLN A 20 8.239 -0.919 1.387 1.00 0.00 H new ATOM 0 HB2 GLN A 20 10.028 -1.354 -0.992 1.00 0.00 H new ATOM 0 HB3 GLN A 20 9.774 0.272 -0.392 1.00 0.00 H new ATOM 0 HG2 GLN A 20 10.546 -0.378 1.855 1.00 0.00 H new ATOM 0 HG3 GLN A 20 10.654 -2.059 1.373 1.00 0.00 H new ATOM 0 HE21 GLN A 20 12.001 -2.470 -0.641 1.00 0.00 H new ATOM 0 HE22 GLN A 20 13.558 -1.640 -0.738 1.00 0.00 H new ATOM 292 N LEU A 21 7.023 0.839 0.042 1.00 0.00 N ATOM 293 CA LEU A 21 6.047 1.709 -0.594 1.00 0.00 C ATOM 294 C LEU A 21 6.693 3.065 -0.886 1.00 0.00 C ATOM 295 O LEU A 21 7.473 3.571 -0.081 1.00 0.00 O ATOM 296 CB LEU A 21 4.779 1.803 0.257 1.00 0.00 C ATOM 297 CG LEU A 21 3.467 1.467 -0.455 1.00 0.00 C ATOM 298 CD1 LEU A 21 2.263 1.830 0.415 1.00 0.00 C ATOM 299 CD2 LEU A 21 3.403 2.135 -1.830 1.00 0.00 C ATOM 0 H LEU A 21 7.470 1.232 0.870 1.00 0.00 H new ATOM 0 HA LEU A 21 5.732 1.293 -1.551 1.00 0.00 H new ATOM 0 HB2 LEU A 21 4.888 1.134 1.111 1.00 0.00 H new ATOM 0 HB3 LEU A 21 4.705 2.816 0.653 1.00 0.00 H new ATOM 0 HG LEU A 21 3.433 0.390 -0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 21 1.343 1.581 -0.114 1.00 0.00 H new ATOM 0 HD12 LEU A 21 2.307 1.270 1.349 1.00 0.00 H new ATOM 0 HD13 LEU A 21 2.279 2.898 0.631 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.461 1.880 -2.315 1.00 0.00 H new ATOM 0 HD22 LEU A 21 3.470 3.217 -1.713 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.233 1.785 -2.444 1.00 0.00 H new ATOM 311 N GLU A 22 6.345 3.613 -2.041 1.00 0.00 N ATOM 312 CA GLU A 22 6.881 4.900 -2.450 1.00 0.00 C ATOM 313 C GLU A 22 5.883 6.016 -2.133 1.00 0.00 C ATOM 314 O GLU A 22 4.825 6.103 -2.755 1.00 0.00 O ATOM 315 CB GLU A 22 7.244 4.896 -3.936 1.00 0.00 C ATOM 316 CG GLU A 22 8.639 5.482 -4.161 1.00 0.00 C ATOM 317 CD GLU A 22 9.287 4.891 -5.415 1.00 0.00 C ATOM 318 OE1 GLU A 22 9.700 3.714 -5.339 1.00 0.00 O ATOM 319 OE2 GLU A 22 9.353 5.630 -6.421 1.00 0.00 O ATOM 0 H GLU A 22 5.698 3.189 -2.706 1.00 0.00 H new ATOM 0 HA GLU A 22 7.795 5.086 -1.887 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.208 3.877 -4.320 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.508 5.474 -4.495 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.571 6.565 -4.259 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.267 5.279 -3.293 1.00 0.00 H new ATOM 326 N LEU A 23 6.254 6.841 -1.165 1.00 0.00 N ATOM 327 CA LEU A 23 5.404 7.947 -0.758 1.00 0.00 C ATOM 328 C LEU A 23 5.607 9.121 -1.719 1.00 0.00 C ATOM 329 O LEU A 23 6.184 10.141 -1.345 1.00 0.00 O ATOM 330 CB LEU A 23 5.654 8.303 0.709 1.00 0.00 C ATOM 331 CG LEU A 23 4.773 7.586 1.733 1.00 0.00 C ATOM 332 CD1 LEU A 23 5.464 7.511 3.095 1.00 0.00 C ATOM 333 CD2 LEU A 23 3.394 8.242 1.825 1.00 0.00 C ATOM 0 H LEU A 23 7.132 6.766 -0.651 1.00 0.00 H new ATOM 0 HA LEU A 23 4.353 7.663 -0.819 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.697 8.087 0.942 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.516 9.377 0.830 1.00 0.00 H new ATOM 0 HG LEU A 23 4.620 6.562 1.393 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.816 6.996 3.804 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.402 6.964 2.998 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.668 8.519 3.456 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.788 7.713 2.560 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.506 9.283 2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.905 8.198 0.852 1.00 0.00 H new ATOM 345 N VAL A 24 5.122 8.937 -2.938 1.00 0.00 N ATOM 346 CA VAL A 24 5.242 9.968 -3.955 1.00 0.00 C ATOM 347 C VAL A 24 5.003 11.338 -3.317 1.00 0.00 C ATOM 348 O VAL A 24 5.929 12.135 -3.184 1.00 0.00 O ATOM 349 CB VAL A 24 4.289 9.673 -5.115 1.00 0.00 C ATOM 350 CG1 VAL A 24 4.483 10.677 -6.252 1.00 0.00 C ATOM 351 CG2 VAL A 24 4.462 8.237 -5.615 1.00 0.00 C ATOM 0 H VAL A 24 4.645 8.089 -3.245 1.00 0.00 H new ATOM 0 HA VAL A 24 6.248 9.976 -4.374 1.00 0.00 H new ATOM 0 HB VAL A 24 3.269 9.778 -4.746 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.794 10.445 -7.064 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.286 11.684 -5.885 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.508 10.618 -6.618 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.773 8.053 -6.439 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.486 8.092 -5.959 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.250 7.541 -4.803 1.00 0.00 H new ATOM 361 N GLY A 25 3.754 11.569 -2.940 1.00 0.00 N ATOM 362 CA GLY A 25 3.380 12.829 -2.320 1.00 0.00 C ATOM 363 C GLY A 25 4.418 13.257 -1.281 1.00 0.00 C ATOM 364 O GLY A 25 4.646 14.450 -1.082 1.00 0.00 O ATOM 0 H GLY A 25 2.988 10.905 -3.052 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.285 13.601 -3.084 1.00 0.00 H new ATOM 0 HA3 GLY A 25 2.404 12.729 -1.845 1.00 0.00 H new ATOM 368 N LEU A 26 5.020 12.262 -0.647 1.00 0.00 N ATOM 369 CA LEU A 26 6.029 12.521 0.366 1.00 0.00 C ATOM 370 C LEU A 26 7.416 12.250 -0.220 1.00 0.00 C ATOM 371 O LEU A 26 7.594 12.271 -1.437 1.00 0.00 O ATOM 372 CB LEU A 26 5.731 11.721 1.636 1.00 0.00 C ATOM 373 CG LEU A 26 5.570 12.536 2.920 1.00 0.00 C ATOM 374 CD1 LEU A 26 5.186 11.636 4.096 1.00 0.00 C ATOM 375 CD2 LEU A 26 6.829 13.354 3.212 1.00 0.00 C ATOM 0 H LEU A 26 4.828 11.274 -0.815 1.00 0.00 H new ATOM 0 HA LEU A 26 6.008 13.569 0.665 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.817 11.149 1.475 1.00 0.00 H new ATOM 0 HB3 LEU A 26 6.535 11.001 1.785 1.00 0.00 H new ATOM 0 HG LEU A 26 4.753 13.243 2.775 1.00 0.00 H new ATOM 0 HD11 LEU A 26 5.078 12.240 4.997 1.00 0.00 H new ATOM 0 HD12 LEU A 26 4.242 11.136 3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 26 5.964 10.889 4.252 1.00 0.00 H new ATOM 0 HD21 LEU A 26 6.688 13.924 4.130 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.680 12.683 3.329 1.00 0.00 H new ATOM 0 HD23 LEU A 26 7.018 14.039 2.385 1.00 0.00 H new ATOM 387 N GLU A 27 8.363 12.002 0.673 1.00 0.00 N ATOM 388 CA GLU A 27 9.728 11.728 0.259 1.00 0.00 C ATOM 389 C GLU A 27 10.398 10.767 1.243 1.00 0.00 C ATOM 390 O GLU A 27 11.262 11.171 2.020 1.00 0.00 O ATOM 391 CB GLU A 27 10.531 13.023 0.125 1.00 0.00 C ATOM 392 CG GLU A 27 10.019 14.089 1.095 1.00 0.00 C ATOM 393 CD GLU A 27 10.887 15.348 1.036 1.00 0.00 C ATOM 394 OE1 GLU A 27 10.583 16.207 0.180 1.00 0.00 O ATOM 395 OE2 GLU A 27 11.835 15.422 1.847 1.00 0.00 O ATOM 0 H GLU A 27 8.212 11.985 1.682 1.00 0.00 H new ATOM 0 HA GLU A 27 9.701 11.253 -0.722 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.584 12.824 0.321 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.462 13.394 -0.898 1.00 0.00 H new ATOM 0 HG2 GLU A 27 8.987 14.343 0.851 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.018 13.691 2.110 1.00 0.00 H new ATOM 402 N ARG A 28 9.974 9.513 1.179 1.00 0.00 N ATOM 403 CA ARG A 28 10.522 8.492 2.055 1.00 0.00 C ATOM 404 C ARG A 28 9.892 7.132 1.743 1.00 0.00 C ATOM 405 O ARG A 28 8.673 7.021 1.626 1.00 0.00 O ATOM 406 CB ARG A 28 10.274 8.836 3.525 1.00 0.00 C ATOM 407 CG ARG A 28 8.820 8.565 3.914 1.00 0.00 C ATOM 408 CD ARG A 28 8.470 9.247 5.238 1.00 0.00 C ATOM 409 NE ARG A 28 8.583 8.278 6.351 1.00 0.00 N ATOM 410 CZ ARG A 28 8.398 8.590 7.641 1.00 0.00 C ATOM 411 NH1 ARG A 28 8.090 9.847 7.989 1.00 0.00 N ATOM 412 NH2 ARG A 28 8.521 7.645 8.584 1.00 0.00 N ATOM 0 H ARG A 28 9.257 9.181 0.534 1.00 0.00 H new ATOM 0 HA ARG A 28 11.597 8.447 1.881 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.939 8.247 4.157 1.00 0.00 H new ATOM 0 HB3 ARG A 28 10.512 9.885 3.702 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.156 8.926 3.128 1.00 0.00 H new ATOM 0 HG3 ARG A 28 8.657 7.491 4.000 1.00 0.00 H new ATOM 0 HD2 ARG A 28 9.138 10.091 5.410 1.00 0.00 H new ATOM 0 HD3 ARG A 28 7.457 9.647 5.194 1.00 0.00 H new ATOM 0 HE ARG A 28 8.816 7.312 6.122 1.00 0.00 H new ATOM 0 HH11 ARG A 28 7.996 10.566 7.272 1.00 0.00 H new ATOM 0 HH12 ARG A 28 7.949 10.084 8.971 1.00 0.00 H new ATOM 0 HH21 ARG A 28 8.755 6.688 8.320 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.380 7.883 9.566 1.00 0.00 H new ATOM 426 N VAL A 29 10.753 6.133 1.618 1.00 0.00 N ATOM 427 CA VAL A 29 10.296 4.785 1.323 1.00 0.00 C ATOM 428 C VAL A 29 9.824 4.116 2.615 1.00 0.00 C ATOM 429 O VAL A 29 10.607 3.937 3.547 1.00 0.00 O ATOM 430 CB VAL A 29 11.403 4.002 0.613 1.00 0.00 C ATOM 431 CG1 VAL A 29 10.988 2.545 0.393 1.00 0.00 C ATOM 432 CG2 VAL A 29 11.785 4.669 -0.709 1.00 0.00 C ATOM 0 H VAL A 29 11.764 6.229 1.715 1.00 0.00 H new ATOM 0 HA VAL A 29 9.445 4.810 0.642 1.00 0.00 H new ATOM 0 HB VAL A 29 12.283 4.007 1.256 1.00 0.00 H new ATOM 0 HG11 VAL A 29 11.792 2.010 -0.113 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.789 2.074 1.356 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.088 2.512 -0.220 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.573 4.093 -1.193 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.913 4.710 -1.361 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.142 5.681 -0.516 1.00 0.00 H new ATOM 442 N VAL A 30 8.547 3.765 2.630 1.00 0.00 N ATOM 443 CA VAL A 30 7.961 3.120 3.793 1.00 0.00 C ATOM 444 C VAL A 30 7.849 1.616 3.534 1.00 0.00 C ATOM 445 O VAL A 30 7.792 1.183 2.384 1.00 0.00 O ATOM 446 CB VAL A 30 6.618 3.770 4.131 1.00 0.00 C ATOM 447 CG1 VAL A 30 6.821 5.116 4.830 1.00 0.00 C ATOM 448 CG2 VAL A 30 5.754 3.928 2.878 1.00 0.00 C ATOM 0 H VAL A 30 7.901 3.915 1.855 1.00 0.00 H new ATOM 0 HA VAL A 30 8.600 3.253 4.666 1.00 0.00 H new ATOM 0 HB VAL A 30 6.091 3.110 4.820 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.851 5.557 5.059 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.379 4.966 5.754 1.00 0.00 H new ATOM 0 HG13 VAL A 30 7.378 5.786 4.175 1.00 0.00 H new ATOM 0 HG21 VAL A 30 4.805 4.392 3.146 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.274 4.556 2.155 1.00 0.00 H new ATOM 0 HG23 VAL A 30 5.567 2.948 2.439 1.00 0.00 H new ATOM 458 N ARG A 31 7.821 0.861 4.622 1.00 0.00 N ATOM 459 CA ARG A 31 7.717 -0.585 4.527 1.00 0.00 C ATOM 460 C ARG A 31 6.381 -1.060 5.102 1.00 0.00 C ATOM 461 O ARG A 31 5.831 -0.431 6.005 1.00 0.00 O ATOM 462 CB ARG A 31 8.860 -1.270 5.279 1.00 0.00 C ATOM 463 CG ARG A 31 9.026 -2.720 4.821 1.00 0.00 C ATOM 464 CD ARG A 31 9.746 -2.791 3.474 1.00 0.00 C ATOM 465 NE ARG A 31 11.127 -2.277 3.611 1.00 0.00 N ATOM 466 CZ ARG A 31 12.169 -3.018 4.010 1.00 0.00 C ATOM 467 NH1 ARG A 31 11.993 -4.311 4.315 1.00 0.00 N ATOM 468 NH2 ARG A 31 13.387 -2.467 4.106 1.00 0.00 N ATOM 0 H ARG A 31 7.869 1.224 5.574 1.00 0.00 H new ATOM 0 HA ARG A 31 7.779 -0.853 3.472 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.788 -0.724 5.113 1.00 0.00 H new ATOM 0 HB3 ARG A 31 8.662 -1.244 6.351 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.589 -3.279 5.568 1.00 0.00 H new ATOM 0 HG3 ARG A 31 8.048 -3.194 4.740 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.766 -3.821 3.117 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.204 -2.206 2.731 1.00 0.00 H new ATOM 0 HE ARG A 31 11.296 -1.296 3.387 1.00 0.00 H new ATOM 0 HH11 ARG A 31 11.066 -4.730 4.243 1.00 0.00 H new ATOM 0 HH12 ARG A 31 12.786 -4.876 4.619 1.00 0.00 H new ATOM 0 HH21 ARG A 31 13.521 -1.483 3.875 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.180 -3.032 4.410 1.00 0.00 H new ATOM 482 N ILE A 32 5.897 -2.165 4.555 1.00 0.00 N ATOM 483 CA ILE A 32 4.636 -2.731 5.002 1.00 0.00 C ATOM 484 C ILE A 32 4.807 -4.236 5.224 1.00 0.00 C ATOM 485 O ILE A 32 5.354 -4.934 4.372 1.00 0.00 O ATOM 486 CB ILE A 32 3.513 -2.378 4.024 1.00 0.00 C ATOM 487 CG1 ILE A 32 3.467 -0.871 3.765 1.00 0.00 C ATOM 488 CG2 ILE A 32 2.168 -2.917 4.516 1.00 0.00 C ATOM 489 CD1 ILE A 32 2.175 -0.478 3.046 1.00 0.00 C ATOM 0 H ILE A 32 6.356 -2.684 3.806 1.00 0.00 H new ATOM 0 HA ILE A 32 4.343 -2.298 5.958 1.00 0.00 H new ATOM 0 HB ILE A 32 3.724 -2.863 3.071 1.00 0.00 H new ATOM 0 HG12 ILE A 32 3.539 -0.333 4.710 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.327 -0.575 3.164 1.00 0.00 H new ATOM 0 HG21 ILE A 32 1.387 -2.652 3.803 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.223 -4.002 4.608 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.935 -2.481 5.488 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.167 0.598 2.874 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.118 -0.999 2.090 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.318 -0.753 3.661 1.00 0.00 H new ATOM 501 N SER A 33 4.330 -4.690 6.373 1.00 0.00 N ATOM 502 CA SER A 33 4.423 -6.099 6.718 1.00 0.00 C ATOM 503 C SER A 33 3.025 -6.674 6.950 1.00 0.00 C ATOM 504 O SER A 33 2.224 -6.094 7.682 1.00 0.00 O ATOM 505 CB SER A 33 5.295 -6.306 7.958 1.00 0.00 C ATOM 506 OG SER A 33 4.874 -5.492 9.049 1.00 0.00 O ATOM 0 H SER A 33 3.878 -4.107 7.078 1.00 0.00 H new ATOM 0 HA SER A 33 4.892 -6.625 5.886 1.00 0.00 H new ATOM 0 HB2 SER A 33 5.261 -7.355 8.254 1.00 0.00 H new ATOM 0 HB3 SER A 33 6.332 -6.077 7.714 1.00 0.00 H new ATOM 0 HG SER A 33 3.899 -5.396 9.028 1.00 0.00 H new ATOM 512 N ALA A 34 2.773 -7.809 6.313 1.00 0.00 N ATOM 513 CA ALA A 34 1.485 -8.469 6.441 1.00 0.00 C ATOM 514 C ALA A 34 1.540 -9.825 5.734 1.00 0.00 C ATOM 515 O ALA A 34 2.322 -10.013 4.804 1.00 0.00 O ATOM 516 CB ALA A 34 0.388 -7.563 5.879 1.00 0.00 C ATOM 0 H ALA A 34 3.439 -8.288 5.707 1.00 0.00 H new ATOM 0 HA ALA A 34 1.250 -8.652 7.490 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.578 -8.059 5.975 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.371 -6.625 6.434 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.588 -7.359 4.827 1.00 0.00 H new ATOM 522 N LYS A 35 0.699 -10.735 6.202 1.00 0.00 N ATOM 523 CA LYS A 35 0.641 -12.068 5.627 1.00 0.00 C ATOM 524 C LYS A 35 0.539 -11.957 4.104 1.00 0.00 C ATOM 525 O LYS A 35 0.013 -10.974 3.584 1.00 0.00 O ATOM 526 CB LYS A 35 -0.491 -12.878 6.262 1.00 0.00 C ATOM 527 CG LYS A 35 -1.730 -12.008 6.484 1.00 0.00 C ATOM 528 CD LYS A 35 -1.893 -11.653 7.963 1.00 0.00 C ATOM 529 CE LYS A 35 -2.096 -10.148 8.147 1.00 0.00 C ATOM 530 NZ LYS A 35 -1.590 -9.714 9.469 1.00 0.00 N ATOM 0 H LYS A 35 0.051 -10.575 6.974 1.00 0.00 H new ATOM 0 HA LYS A 35 1.556 -12.618 5.847 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -0.745 -13.721 5.619 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -0.157 -13.292 7.214 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -1.648 -11.095 5.894 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -2.617 -12.536 6.133 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.745 -12.192 8.378 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.011 -11.975 8.517 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.577 -9.606 7.357 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -3.155 -9.904 8.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.736 -8.690 9.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.104 -10.218 10.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.575 -9.929 9.540 1.00 0.00 H new ATOM 544 N PRO A 36 1.062 -13.006 3.415 1.00 0.00 N ATOM 545 CA PRO A 36 1.035 -13.036 1.962 1.00 0.00 C ATOM 546 C PRO A 36 -0.370 -13.354 1.447 1.00 0.00 C ATOM 547 O PRO A 36 -0.965 -12.557 0.722 1.00 0.00 O ATOM 548 CB PRO A 36 2.063 -14.085 1.571 1.00 0.00 C ATOM 549 CG PRO A 36 2.291 -14.929 2.814 1.00 0.00 C ATOM 550 CD PRO A 36 1.692 -14.187 3.998 1.00 0.00 C ATOM 0 HA PRO A 36 1.280 -12.072 1.516 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.702 -14.697 0.744 1.00 0.00 H new ATOM 0 HB3 PRO A 36 2.991 -13.618 1.240 1.00 0.00 H new ATOM 0 HG2 PRO A 36 1.825 -15.908 2.702 1.00 0.00 H new ATOM 0 HG3 PRO A 36 3.356 -15.099 2.970 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.965 -14.804 4.525 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.459 -13.910 4.721 1.00 0.00 H new ATOM 558 N THR A 37 -0.861 -14.520 1.841 1.00 0.00 N ATOM 559 CA THR A 37 -2.185 -14.953 1.429 1.00 0.00 C ATOM 560 C THR A 37 -3.149 -13.766 1.398 1.00 0.00 C ATOM 561 O THR A 37 -3.848 -13.554 0.408 1.00 0.00 O ATOM 562 CB THR A 37 -2.630 -16.074 2.370 1.00 0.00 C ATOM 563 OG1 THR A 37 -2.236 -15.620 3.662 1.00 0.00 O ATOM 564 CG2 THR A 37 -1.830 -17.362 2.168 1.00 0.00 C ATOM 0 H THR A 37 -0.365 -15.178 2.442 1.00 0.00 H new ATOM 0 HA THR A 37 -2.174 -15.348 0.413 1.00 0.00 H new ATOM 0 HB THR A 37 -3.690 -16.277 2.215 1.00 0.00 H new ATOM 0 HG1 THR A 37 -2.488 -16.287 4.334 1.00 0.00 H new ATOM 0 HG21 THR A 37 -2.187 -18.124 2.861 1.00 0.00 H new ATOM 0 HG22 THR A 37 -1.959 -17.713 1.144 1.00 0.00 H new ATOM 0 HG23 THR A 37 -0.774 -17.167 2.355 1.00 0.00 H new ATOM 572 N LYS A 38 -3.156 -13.022 2.494 1.00 0.00 N ATOM 573 CA LYS A 38 -4.023 -11.861 2.606 1.00 0.00 C ATOM 574 C LYS A 38 -3.949 -11.049 1.312 1.00 0.00 C ATOM 575 O LYS A 38 -3.014 -11.207 0.528 1.00 0.00 O ATOM 576 CB LYS A 38 -3.680 -11.055 3.859 1.00 0.00 C ATOM 577 CG LYS A 38 -4.909 -10.884 4.755 1.00 0.00 C ATOM 578 CD LYS A 38 -4.883 -9.531 5.470 1.00 0.00 C ATOM 579 CE LYS A 38 -5.577 -9.617 6.831 1.00 0.00 C ATOM 580 NZ LYS A 38 -7.041 -9.743 6.659 1.00 0.00 N ATOM 0 H LYS A 38 -2.575 -13.201 3.313 1.00 0.00 H new ATOM 0 HA LYS A 38 -5.061 -12.171 2.730 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.888 -11.558 4.414 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -3.296 -10.076 3.572 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.815 -10.965 4.155 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.942 -11.688 5.491 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -3.851 -9.206 5.604 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.376 -8.780 4.853 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -5.195 -10.473 7.387 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.349 -8.728 7.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.432 -10.327 7.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -7.476 -8.799 6.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.246 -10.191 5.743 1.00 0.00 H new ATOM 594 N ARG A 39 -4.946 -10.195 1.128 1.00 0.00 N ATOM 595 CA ARG A 39 -5.005 -9.357 -0.057 1.00 0.00 C ATOM 596 C ARG A 39 -4.221 -8.063 0.168 1.00 0.00 C ATOM 597 O ARG A 39 -3.662 -7.851 1.243 1.00 0.00 O ATOM 598 CB ARG A 39 -6.451 -9.013 -0.417 1.00 0.00 C ATOM 599 CG ARG A 39 -7.231 -10.268 -0.815 1.00 0.00 C ATOM 600 CD ARG A 39 -8.655 -9.914 -1.250 1.00 0.00 C ATOM 601 NE ARG A 39 -9.504 -9.681 -0.060 1.00 0.00 N ATOM 602 CZ ARG A 39 -10.825 -9.466 -0.111 1.00 0.00 C ATOM 603 NH1 ARG A 39 -11.457 -9.453 -1.293 1.00 0.00 N ATOM 604 NH2 ARG A 39 -11.516 -9.265 1.020 1.00 0.00 N ATOM 0 H ARG A 39 -5.719 -10.066 1.780 1.00 0.00 H new ATOM 0 HA ARG A 39 -4.561 -9.916 -0.881 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -6.937 -8.533 0.433 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.464 -8.297 -1.238 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.715 -10.779 -1.628 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -7.265 -10.961 0.026 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -8.642 -9.023 -1.878 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -9.072 -10.722 -1.852 1.00 0.00 H new ATOM 0 HE ARG A 39 -9.055 -9.684 0.856 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -10.932 -9.607 -2.154 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -12.463 -9.289 -1.332 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -11.036 -9.276 1.920 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -12.522 -9.101 0.981 1.00 0.00 H new ATOM 618 N LEU A 40 -4.204 -7.232 -0.864 1.00 0.00 N ATOM 619 CA LEU A 40 -3.497 -5.964 -0.792 1.00 0.00 C ATOM 620 C LEU A 40 -4.350 -4.953 -0.022 1.00 0.00 C ATOM 621 O LEU A 40 -3.818 -4.047 0.618 1.00 0.00 O ATOM 622 CB LEU A 40 -3.099 -5.493 -2.192 1.00 0.00 C ATOM 623 CG LEU A 40 -1.597 -5.441 -2.480 1.00 0.00 C ATOM 624 CD1 LEU A 40 -1.332 -5.207 -3.968 1.00 0.00 C ATOM 625 CD2 LEU A 40 -0.906 -4.396 -1.603 1.00 0.00 C ATOM 0 H LEU A 40 -4.668 -7.412 -1.754 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.563 -6.079 -0.242 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.566 -6.153 -2.923 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.514 -4.498 -2.351 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.167 -6.410 -2.225 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.257 -5.174 -4.145 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.771 -6.019 -4.548 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.779 -4.261 -4.273 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.160 -4.380 -1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.334 -3.413 -1.802 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.051 -4.649 -0.553 1.00 0.00 H new ATOM 637 N GLN A 41 -5.658 -5.142 -0.109 1.00 0.00 N ATOM 638 CA GLN A 41 -6.589 -4.258 0.571 1.00 0.00 C ATOM 639 C GLN A 41 -6.762 -4.690 2.029 1.00 0.00 C ATOM 640 O GLN A 41 -6.946 -3.852 2.911 1.00 0.00 O ATOM 641 CB GLN A 41 -7.936 -4.219 -0.152 1.00 0.00 C ATOM 642 CG GLN A 41 -8.734 -5.499 0.103 1.00 0.00 C ATOM 643 CD GLN A 41 -9.854 -5.662 -0.927 1.00 0.00 C ATOM 644 OE1 GLN A 41 -9.748 -6.413 -1.883 1.00 0.00 O ATOM 645 NE2 GLN A 41 -10.929 -4.920 -0.678 1.00 0.00 N ATOM 0 H GLN A 41 -6.096 -5.895 -0.640 1.00 0.00 H new ATOM 0 HA GLN A 41 -6.177 -3.249 0.557 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -8.509 -3.356 0.186 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.774 -4.095 -1.223 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.068 -6.361 0.061 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.159 -5.473 1.106 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.951 -4.313 0.141 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.732 -4.958 -1.306 1.00 0.00 H new ATOM 654 N GLU A 42 -6.697 -5.997 2.237 1.00 0.00 N ATOM 655 CA GLU A 42 -6.844 -6.550 3.573 1.00 0.00 C ATOM 656 C GLU A 42 -5.558 -6.346 4.377 1.00 0.00 C ATOM 657 O GLU A 42 -5.590 -6.300 5.605 1.00 0.00 O ATOM 658 CB GLU A 42 -7.224 -8.030 3.514 1.00 0.00 C ATOM 659 CG GLU A 42 -8.542 -8.228 2.763 1.00 0.00 C ATOM 660 CD GLU A 42 -9.679 -7.456 3.435 1.00 0.00 C ATOM 661 OE1 GLU A 42 -10.087 -7.890 4.534 1.00 0.00 O ATOM 662 OE2 GLU A 42 -10.113 -6.448 2.836 1.00 0.00 O ATOM 0 H GLU A 42 -6.545 -6.689 1.503 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.652 -6.020 4.077 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.432 -8.593 3.020 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.314 -8.427 4.525 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.431 -7.893 1.732 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -8.789 -9.289 2.729 1.00 0.00 H new ATOM 669 N ALA A 43 -4.456 -6.228 3.650 1.00 0.00 N ATOM 670 CA ALA A 43 -3.162 -6.029 4.280 1.00 0.00 C ATOM 671 C ALA A 43 -2.936 -4.534 4.511 1.00 0.00 C ATOM 672 O ALA A 43 -2.160 -4.147 5.384 1.00 0.00 O ATOM 673 CB ALA A 43 -2.070 -6.657 3.412 1.00 0.00 C ATOM 0 H ALA A 43 -4.433 -6.266 2.631 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.129 -6.521 5.252 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.099 -6.508 3.884 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -2.261 -7.725 3.303 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -2.071 -6.186 2.429 1.00 0.00 H new ATOM 679 N LEU A 44 -3.627 -3.733 3.712 1.00 0.00 N ATOM 680 CA LEU A 44 -3.511 -2.289 3.819 1.00 0.00 C ATOM 681 C LEU A 44 -4.627 -1.757 4.720 1.00 0.00 C ATOM 682 O LEU A 44 -4.546 -0.635 5.218 1.00 0.00 O ATOM 683 CB LEU A 44 -3.486 -1.650 2.429 1.00 0.00 C ATOM 684 CG LEU A 44 -2.232 -1.913 1.592 1.00 0.00 C ATOM 685 CD1 LEU A 44 -1.333 -0.676 1.548 1.00 0.00 C ATOM 686 CD2 LEU A 44 -1.485 -3.148 2.098 1.00 0.00 C ATOM 0 H LEU A 44 -4.269 -4.057 2.988 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.565 -2.016 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -4.352 -2.006 1.871 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.602 -0.572 2.544 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.542 -2.122 0.568 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.449 -0.890 0.947 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.880 0.156 1.105 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.028 -0.412 2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.598 -3.313 1.486 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.187 -2.993 3.135 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -2.137 -4.019 2.034 1.00 0.00 H new ATOM 698 N GLN A 45 -5.642 -2.588 4.903 1.00 0.00 N ATOM 699 CA GLN A 45 -6.773 -2.215 5.736 1.00 0.00 C ATOM 700 C GLN A 45 -6.288 -1.738 7.107 1.00 0.00 C ATOM 701 O GLN A 45 -6.689 -0.673 7.575 1.00 0.00 O ATOM 702 CB GLN A 45 -7.757 -3.378 5.877 1.00 0.00 C ATOM 703 CG GLN A 45 -8.994 -3.159 5.003 1.00 0.00 C ATOM 704 CD GLN A 45 -10.247 -2.979 5.862 1.00 0.00 C ATOM 705 OE1 GLN A 45 -10.202 -2.984 7.081 1.00 0.00 O ATOM 706 NE2 GLN A 45 -11.366 -2.821 5.160 1.00 0.00 N ATOM 0 H GLN A 45 -5.705 -3.518 4.489 1.00 0.00 H new ATOM 0 HA GLN A 45 -7.300 -1.393 5.252 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.267 -4.310 5.593 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.058 -3.480 6.920 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.849 -2.279 4.376 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -9.126 -4.009 4.334 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -11.334 -2.827 4.141 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -12.256 -2.694 5.641 1.00 0.00 H new ATOM 715 N PRO A 46 -5.410 -2.570 7.728 1.00 0.00 N ATOM 716 CA PRO A 46 -4.867 -2.244 9.035 1.00 0.00 C ATOM 717 C PRO A 46 -3.806 -1.147 8.930 1.00 0.00 C ATOM 718 O PRO A 46 -3.272 -0.695 9.942 1.00 0.00 O ATOM 719 CB PRO A 46 -4.314 -3.555 9.570 1.00 0.00 C ATOM 720 CG PRO A 46 -4.150 -4.462 8.361 1.00 0.00 C ATOM 721 CD PRO A 46 -4.913 -3.839 7.204 1.00 0.00 C ATOM 0 HA PRO A 46 -5.618 -1.838 9.713 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.360 -3.400 10.074 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -4.992 -3.996 10.300 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.096 -4.573 8.107 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.532 -5.459 8.577 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.266 -3.685 6.340 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.732 -4.481 6.878 1.00 0.00 H new ATOM 729 N ILE A 47 -3.531 -0.750 7.696 1.00 0.00 N ATOM 730 CA ILE A 47 -2.543 0.286 7.445 1.00 0.00 C ATOM 731 C ILE A 47 -3.257 1.616 7.198 1.00 0.00 C ATOM 732 O ILE A 47 -2.841 2.653 7.713 1.00 0.00 O ATOM 733 CB ILE A 47 -1.608 -0.130 6.308 1.00 0.00 C ATOM 734 CG1 ILE A 47 -0.811 -1.382 6.683 1.00 0.00 C ATOM 735 CG2 ILE A 47 -0.696 1.028 5.897 1.00 0.00 C ATOM 736 CD1 ILE A 47 -0.196 -1.242 8.077 1.00 0.00 C ATOM 0 H ILE A 47 -3.975 -1.127 6.859 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.905 0.423 8.318 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.217 -0.384 5.441 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -1.463 -2.255 6.655 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -0.023 -1.549 5.949 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -0.041 0.706 5.087 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -1.304 1.868 5.560 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.092 1.336 6.751 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.365 -2.145 8.320 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.474 -0.383 8.094 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.988 -1.099 8.812 1.00 0.00 H new ATOM 748 N LEU A 48 -4.320 1.544 6.411 1.00 0.00 N ATOM 749 CA LEU A 48 -5.096 2.730 6.090 1.00 0.00 C ATOM 750 C LEU A 48 -5.870 3.179 7.330 1.00 0.00 C ATOM 751 O LEU A 48 -6.044 4.375 7.559 1.00 0.00 O ATOM 752 CB LEU A 48 -5.983 2.475 4.870 1.00 0.00 C ATOM 753 CG LEU A 48 -5.278 1.916 3.632 1.00 0.00 C ATOM 754 CD1 LEU A 48 -6.271 1.207 2.709 1.00 0.00 C ATOM 755 CD2 LEU A 48 -4.500 3.012 2.902 1.00 0.00 C ATOM 0 H LEU A 48 -4.663 0.682 5.986 1.00 0.00 H new ATOM 0 HA LEU A 48 -4.437 3.552 5.810 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -6.772 1.781 5.158 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.467 3.412 4.596 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.553 1.170 3.959 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.744 0.819 1.837 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -6.741 0.383 3.245 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -7.036 1.913 2.386 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.009 2.588 2.026 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -5.187 3.798 2.588 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.749 3.433 3.571 1.00 0.00 H new ATOM 767 N ALA A 49 -6.315 2.196 8.099 1.00 0.00 N ATOM 768 CA ALA A 49 -7.067 2.475 9.311 1.00 0.00 C ATOM 769 C ALA A 49 -6.134 3.092 10.354 1.00 0.00 C ATOM 770 O ALA A 49 -6.583 3.807 11.249 1.00 0.00 O ATOM 771 CB ALA A 49 -7.728 1.188 9.809 1.00 0.00 C ATOM 0 H ALA A 49 -6.169 1.205 7.906 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.862 3.194 9.113 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -8.292 1.397 10.718 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -8.403 0.806 9.043 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -6.961 0.443 10.021 1.00 0.00 H new ATOM 777 N LYS A 50 -4.851 2.794 10.205 1.00 0.00 N ATOM 778 CA LYS A 50 -3.851 3.311 11.123 1.00 0.00 C ATOM 779 C LYS A 50 -3.227 4.577 10.531 1.00 0.00 C ATOM 780 O LYS A 50 -2.581 5.345 11.242 1.00 0.00 O ATOM 781 CB LYS A 50 -2.829 2.226 11.468 1.00 0.00 C ATOM 782 CG LYS A 50 -2.246 2.446 12.866 1.00 0.00 C ATOM 783 CD LYS A 50 -0.749 2.131 12.892 1.00 0.00 C ATOM 784 CE LYS A 50 0.029 3.226 13.624 1.00 0.00 C ATOM 785 NZ LYS A 50 0.903 3.959 12.681 1.00 0.00 N ATOM 0 H LYS A 50 -4.482 2.201 9.462 1.00 0.00 H new ATOM 0 HA LYS A 50 -4.313 3.595 12.069 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -3.303 1.246 11.418 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -2.026 2.230 10.731 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.409 3.479 13.173 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.767 1.813 13.585 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -0.584 1.172 13.384 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -0.376 2.035 11.872 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -0.666 3.919 14.099 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.631 2.784 14.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 1.424 4.699 13.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 1.578 3.297 12.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 0.322 4.397 11.938 1.00 0.00 H new ATOM 799 N HIS A 51 -3.443 4.755 9.236 1.00 0.00 N ATOM 800 CA HIS A 51 -2.911 5.914 8.541 1.00 0.00 C ATOM 801 C HIS A 51 -4.054 6.862 8.173 1.00 0.00 C ATOM 802 O HIS A 51 -3.846 7.844 7.463 1.00 0.00 O ATOM 803 CB HIS A 51 -2.081 5.487 7.329 1.00 0.00 C ATOM 804 CG HIS A 51 -0.740 4.888 7.682 1.00 0.00 C ATOM 805 ND1 HIS A 51 -0.499 3.526 7.661 1.00 0.00 N ATOM 806 CD2 HIS A 51 0.427 5.481 8.065 1.00 0.00 C ATOM 807 CE1 HIS A 51 0.761 3.319 8.017 1.00 0.00 C ATOM 808 NE2 HIS A 51 1.333 4.532 8.267 1.00 0.00 N ATOM 0 H HIS A 51 -3.979 4.115 8.650 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.233 6.457 9.199 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -2.651 4.760 6.749 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -1.923 6.353 6.687 1.00 0.00 H new ATOM 0 HD1 HIS A 51 -1.176 2.804 7.414 1.00 0.00 H new ATOM 0 HD2 HIS A 51 0.587 6.542 8.184 1.00 0.00 H new ATOM 0 HE1 HIS A 51 1.249 2.359 8.095 1.00 0.00 H new ATOM 816 N GLY A 52 -5.236 6.533 8.672 1.00 0.00 N ATOM 817 CA GLY A 52 -6.413 7.343 8.405 1.00 0.00 C ATOM 818 C GLY A 52 -6.664 7.465 6.900 1.00 0.00 C ATOM 819 O GLY A 52 -7.230 8.455 6.440 1.00 0.00 O ATOM 0 H GLY A 52 -5.404 5.717 9.260 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -7.283 6.897 8.888 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.282 8.335 8.837 1.00 0.00 H new ATOM 823 N LEU A 53 -6.230 6.444 6.176 1.00 0.00 N ATOM 824 CA LEU A 53 -6.400 6.425 4.733 1.00 0.00 C ATOM 825 C LEU A 53 -7.587 5.527 4.375 1.00 0.00 C ATOM 826 O LEU A 53 -8.333 5.099 5.255 1.00 0.00 O ATOM 827 CB LEU A 53 -5.095 6.022 4.044 1.00 0.00 C ATOM 828 CG LEU A 53 -3.880 6.902 4.344 1.00 0.00 C ATOM 829 CD1 LEU A 53 -2.589 6.235 3.865 1.00 0.00 C ATOM 830 CD2 LEU A 53 -4.056 8.301 3.750 1.00 0.00 C ATOM 0 H LEU A 53 -5.761 5.624 6.561 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.632 7.424 4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.857 4.998 4.331 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -5.261 6.021 2.967 1.00 0.00 H new ATOM 0 HG LEU A 53 -3.801 7.019 5.425 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.740 6.881 4.090 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.463 5.279 4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.643 6.069 2.789 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.178 8.906 3.978 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.174 8.225 2.669 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.941 8.770 4.179 1.00 0.00 H new ATOM 842 N SER A 54 -7.724 5.268 3.083 1.00 0.00 N ATOM 843 CA SER A 54 -8.806 4.429 2.599 1.00 0.00 C ATOM 844 C SER A 54 -8.372 3.695 1.329 1.00 0.00 C ATOM 845 O SER A 54 -7.470 4.147 0.624 1.00 0.00 O ATOM 846 CB SER A 54 -10.066 5.255 2.330 1.00 0.00 C ATOM 847 OG SER A 54 -10.610 4.994 1.039 1.00 0.00 O ATOM 0 H SER A 54 -7.103 5.625 2.357 1.00 0.00 H new ATOM 0 HA SER A 54 -9.042 3.697 3.371 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.814 5.033 3.091 1.00 0.00 H new ATOM 0 HB3 SER A 54 -9.829 6.316 2.416 1.00 0.00 H new ATOM 0 HG SER A 54 -11.414 5.539 0.906 1.00 0.00 H new ATOM 853 N LEU A 55 -9.033 2.575 1.075 1.00 0.00 N ATOM 854 CA LEU A 55 -8.726 1.775 -0.098 1.00 0.00 C ATOM 855 C LEU A 55 -9.215 2.505 -1.351 1.00 0.00 C ATOM 856 O LEU A 55 -8.641 2.349 -2.428 1.00 0.00 O ATOM 857 CB LEU A 55 -9.296 0.363 0.052 1.00 0.00 C ATOM 858 CG LEU A 55 -8.741 -0.464 1.214 1.00 0.00 C ATOM 859 CD1 LEU A 55 -9.767 -1.492 1.694 1.00 0.00 C ATOM 860 CD2 LEU A 55 -7.410 -1.116 0.836 1.00 0.00 C ATOM 0 H LEU A 55 -9.780 2.203 1.662 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.648 1.650 -0.202 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.377 0.439 0.170 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.114 -0.181 -0.875 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.544 0.209 2.049 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.348 -2.066 2.520 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -10.667 -0.978 2.030 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.018 -2.165 0.875 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.037 -1.698 1.679 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.557 -1.773 -0.021 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.686 -0.343 0.580 1.00 0.00 H new ATOM 872 N ASP A 56 -10.269 3.286 -1.168 1.00 0.00 N ATOM 873 CA ASP A 56 -10.841 4.041 -2.270 1.00 0.00 C ATOM 874 C ASP A 56 -10.243 5.449 -2.283 1.00 0.00 C ATOM 875 O ASP A 56 -10.685 6.308 -3.045 1.00 0.00 O ATOM 876 CB ASP A 56 -12.358 4.173 -2.118 1.00 0.00 C ATOM 877 CG ASP A 56 -13.140 4.202 -3.433 1.00 0.00 C ATOM 878 OD1 ASP A 56 -12.477 4.117 -4.489 1.00 0.00 O ATOM 879 OD2 ASP A 56 -14.383 4.308 -3.352 1.00 0.00 O ATOM 0 H ASP A 56 -10.742 3.413 -0.273 1.00 0.00 H new ATOM 0 HA ASP A 56 -10.616 3.510 -3.195 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -12.721 3.341 -1.515 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.574 5.086 -1.564 1.00 0.00 H new ATOM 884 N GLN A 57 -9.247 5.642 -1.431 1.00 0.00 N ATOM 885 CA GLN A 57 -8.583 6.931 -1.336 1.00 0.00 C ATOM 886 C GLN A 57 -7.198 6.865 -1.983 1.00 0.00 C ATOM 887 O GLN A 57 -6.918 7.592 -2.934 1.00 0.00 O ATOM 888 CB GLN A 57 -8.486 7.391 0.120 1.00 0.00 C ATOM 889 CG GLN A 57 -9.742 8.160 0.537 1.00 0.00 C ATOM 890 CD GLN A 57 -9.805 9.523 -0.154 1.00 0.00 C ATOM 891 OE1 GLN A 57 -10.205 9.650 -1.300 1.00 0.00 O ATOM 892 NE2 GLN A 57 -9.388 10.534 0.604 1.00 0.00 N ATOM 0 H GLN A 57 -8.884 4.927 -0.800 1.00 0.00 H new ATOM 0 HA GLN A 57 -9.180 7.666 -1.877 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -8.352 6.526 0.770 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.608 8.025 0.247 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -10.629 7.579 0.285 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.747 8.296 1.618 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -9.066 10.359 1.556 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -9.391 11.484 0.233 1.00 0.00 H new ATOM 901 N VAL A 58 -6.369 5.985 -1.441 1.00 0.00 N ATOM 902 CA VAL A 58 -5.020 5.814 -1.954 1.00 0.00 C ATOM 903 C VAL A 58 -5.050 4.857 -3.147 1.00 0.00 C ATOM 904 O VAL A 58 -5.798 3.881 -3.146 1.00 0.00 O ATOM 905 CB VAL A 58 -4.090 5.344 -0.834 1.00 0.00 C ATOM 906 CG1 VAL A 58 -4.240 6.224 0.409 1.00 0.00 C ATOM 907 CG2 VAL A 58 -4.337 3.872 -0.498 1.00 0.00 C ATOM 0 H VAL A 58 -6.605 5.383 -0.652 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.624 6.765 -2.310 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.064 5.439 -1.189 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -3.568 5.868 1.190 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.990 7.255 0.157 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.269 6.177 0.766 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -3.663 3.563 0.301 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.369 3.741 -0.173 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.155 3.261 -1.382 1.00 0.00 H new ATOM 917 N VAL A 59 -4.227 5.170 -4.138 1.00 0.00 N ATOM 918 CA VAL A 59 -4.150 4.350 -5.335 1.00 0.00 C ATOM 919 C VAL A 59 -2.816 3.602 -5.350 1.00 0.00 C ATOM 920 O VAL A 59 -1.753 4.222 -5.355 1.00 0.00 O ATOM 921 CB VAL A 59 -4.365 5.217 -6.577 1.00 0.00 C ATOM 922 CG1 VAL A 59 -4.118 4.413 -7.855 1.00 0.00 C ATOM 923 CG2 VAL A 59 -5.764 5.835 -6.580 1.00 0.00 C ATOM 0 H VAL A 59 -3.608 5.981 -4.136 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.942 3.601 -5.338 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.640 6.031 -6.547 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -4.277 5.052 -8.723 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -3.093 4.043 -7.860 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.808 3.570 -7.893 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.890 6.446 -7.474 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.512 5.042 -6.574 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.889 6.458 -5.694 1.00 0.00 H new ATOM 933 N LEU A 60 -2.914 2.281 -5.358 1.00 0.00 N ATOM 934 CA LEU A 60 -1.728 1.442 -5.373 1.00 0.00 C ATOM 935 C LEU A 60 -1.326 1.160 -6.822 1.00 0.00 C ATOM 936 O LEU A 60 -2.181 0.898 -7.667 1.00 0.00 O ATOM 937 CB LEU A 60 -1.954 0.179 -4.541 1.00 0.00 C ATOM 938 CG LEU A 60 -0.715 -0.410 -3.864 1.00 0.00 C ATOM 939 CD1 LEU A 60 0.418 -0.610 -4.873 1.00 0.00 C ATOM 940 CD2 LEU A 60 -0.279 0.449 -2.675 1.00 0.00 C ATOM 0 H LEU A 60 -3.797 1.771 -5.354 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.891 1.959 -4.904 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.692 0.403 -3.771 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.388 -0.584 -5.187 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.975 -1.393 -3.472 1.00 0.00 H new ATOM 0 HD11 LEU A 60 1.287 -1.030 -4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.091 -1.293 -5.657 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.685 0.350 -5.316 1.00 0.00 H new ATOM 0 HD21 LEU A 60 0.604 0.008 -2.212 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.043 1.456 -3.020 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -1.087 0.496 -1.945 1.00 0.00 H new ATOM 952 N HIS A 61 -0.025 1.224 -7.065 1.00 0.00 N ATOM 953 CA HIS A 61 0.500 0.979 -8.398 1.00 0.00 C ATOM 954 C HIS A 61 2.029 1.026 -8.363 1.00 0.00 C ATOM 955 O HIS A 61 2.612 1.901 -7.726 1.00 0.00 O ATOM 956 CB HIS A 61 -0.101 1.959 -9.407 1.00 0.00 C ATOM 957 CG HIS A 61 0.649 3.265 -9.516 1.00 0.00 C ATOM 958 ND1 HIS A 61 1.615 3.497 -10.480 1.00 0.00 N ATOM 959 CD2 HIS A 61 0.563 4.406 -8.773 1.00 0.00 C ATOM 960 CE1 HIS A 61 2.083 4.725 -10.314 1.00 0.00 C ATOM 961 NE2 HIS A 61 1.431 5.287 -9.256 1.00 0.00 N ATOM 0 H HIS A 61 0.681 1.442 -6.362 1.00 0.00 H new ATOM 0 HA HIS A 61 0.209 -0.017 -8.731 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -0.128 1.484 -10.388 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -1.133 2.167 -9.125 1.00 0.00 H new ATOM 0 HD1 HIS A 61 1.915 2.835 -11.196 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -0.099 4.566 -7.934 1.00 0.00 H new ATOM 0 HE1 HIS A 61 2.847 5.199 -10.912 1.00 0.00 H new ATOM 969 N ARG A 62 2.634 0.072 -9.057 1.00 0.00 N ATOM 970 CA ARG A 62 4.083 -0.006 -9.114 1.00 0.00 C ATOM 971 C ARG A 62 4.652 1.203 -9.860 1.00 0.00 C ATOM 972 O ARG A 62 3.918 1.918 -10.541 1.00 0.00 O ATOM 973 CB ARG A 62 4.539 -1.288 -9.814 1.00 0.00 C ATOM 974 CG ARG A 62 5.010 -2.330 -8.797 1.00 0.00 C ATOM 975 CD ARG A 62 5.515 -3.592 -9.499 1.00 0.00 C ATOM 976 NE ARG A 62 4.538 -4.690 -9.331 1.00 0.00 N ATOM 977 CZ ARG A 62 4.453 -5.752 -10.144 1.00 0.00 C ATOM 978 NH1 ARG A 62 5.287 -5.865 -11.187 1.00 0.00 N ATOM 979 NH2 ARG A 62 3.534 -6.700 -9.914 1.00 0.00 N ATOM 0 H ARG A 62 2.147 -0.653 -9.584 1.00 0.00 H new ATOM 0 HA ARG A 62 4.454 -0.013 -8.089 1.00 0.00 H new ATOM 0 HB2 ARG A 62 3.719 -1.696 -10.404 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.348 -1.060 -10.508 1.00 0.00 H new ATOM 0 HG2 ARG A 62 5.805 -1.909 -8.181 1.00 0.00 H new ATOM 0 HG3 ARG A 62 4.189 -2.586 -8.127 1.00 0.00 H new ATOM 0 HD2 ARG A 62 5.670 -3.391 -10.559 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.480 -3.886 -9.086 1.00 0.00 H new ATOM 0 HE ARG A 62 3.888 -4.635 -8.547 1.00 0.00 H new ATOM 0 HH11 ARG A 62 5.986 -5.143 -11.362 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.223 -6.673 -11.806 1.00 0.00 H new ATOM 0 HH21 ARG A 62 2.899 -6.613 -9.120 1.00 0.00 H new ATOM 0 HH22 ARG A 62 3.469 -7.508 -10.533 1.00 0.00 H new ATOM 993 N PRO A 63 5.988 1.400 -9.702 1.00 0.00 N ATOM 994 CA PRO A 63 6.663 2.510 -10.353 1.00 0.00 C ATOM 995 C PRO A 63 6.844 2.241 -11.848 1.00 0.00 C ATOM 996 O PRO A 63 7.674 1.422 -12.240 1.00 0.00 O ATOM 997 CB PRO A 63 7.982 2.657 -9.612 1.00 0.00 C ATOM 998 CG PRO A 63 8.201 1.339 -8.886 1.00 0.00 C ATOM 999 CD PRO A 63 6.889 0.573 -8.904 1.00 0.00 C ATOM 0 HA PRO A 63 6.090 3.436 -10.307 1.00 0.00 H new ATOM 0 HB2 PRO A 63 8.798 2.862 -10.305 1.00 0.00 H new ATOM 0 HB3 PRO A 63 7.944 3.489 -8.909 1.00 0.00 H new ATOM 0 HG2 PRO A 63 8.987 0.761 -9.373 1.00 0.00 H new ATOM 0 HG3 PRO A 63 8.525 1.517 -7.861 1.00 0.00 H new ATOM 0 HD2 PRO A 63 7.014 -0.416 -9.345 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.503 0.426 -7.896 1.00 0.00 H new ATOM 1007 N GLY A 64 6.053 2.947 -12.643 1.00 0.00 N ATOM 1008 CA GLY A 64 6.115 2.795 -14.087 1.00 0.00 C ATOM 1009 C GLY A 64 4.739 2.452 -14.662 1.00 0.00 C ATOM 1010 O GLY A 64 4.361 2.956 -15.719 1.00 0.00 O ATOM 0 H GLY A 64 5.366 3.626 -12.315 1.00 0.00 H new ATOM 0 HA2 GLY A 64 6.482 3.717 -14.538 1.00 0.00 H new ATOM 0 HA3 GLY A 64 6.826 2.010 -14.343 1.00 0.00 H new ATOM 1014 N GLU A 65 4.028 1.598 -13.941 1.00 0.00 N ATOM 1015 CA GLU A 65 2.702 1.183 -14.367 1.00 0.00 C ATOM 1016 C GLU A 65 1.752 2.382 -14.390 1.00 0.00 C ATOM 1017 O GLU A 65 1.820 3.249 -13.520 1.00 0.00 O ATOM 1018 CB GLU A 65 2.160 0.071 -13.465 1.00 0.00 C ATOM 1019 CG GLU A 65 3.055 -1.168 -13.525 1.00 0.00 C ATOM 1020 CD GLU A 65 3.178 -1.687 -14.960 1.00 0.00 C ATOM 1021 OE1 GLU A 65 2.115 -1.982 -15.549 1.00 0.00 O ATOM 1022 OE2 GLU A 65 4.330 -1.777 -15.434 1.00 0.00 O ATOM 0 H GLU A 65 4.345 1.182 -13.065 1.00 0.00 H new ATOM 0 HA GLU A 65 2.775 0.783 -15.378 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.097 0.429 -12.438 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.148 -0.192 -13.773 1.00 0.00 H new ATOM 0 HG2 GLU A 65 4.044 -0.926 -13.136 1.00 0.00 H new ATOM 0 HG3 GLU A 65 2.644 -1.949 -12.886 1.00 0.00 H new ATOM 1029 N LYS A 66 0.888 2.392 -15.394 1.00 0.00 N ATOM 1030 CA LYS A 66 -0.075 3.471 -15.542 1.00 0.00 C ATOM 1031 C LYS A 66 -1.411 3.043 -14.932 1.00 0.00 C ATOM 1032 O LYS A 66 -2.230 3.886 -14.569 1.00 0.00 O ATOM 1033 CB LYS A 66 -0.177 3.900 -17.007 1.00 0.00 C ATOM 1034 CG LYS A 66 -0.864 2.822 -17.848 1.00 0.00 C ATOM 1035 CD LYS A 66 -2.195 3.328 -18.407 1.00 0.00 C ATOM 1036 CE LYS A 66 -2.327 2.996 -19.895 1.00 0.00 C ATOM 1037 NZ LYS A 66 -3.421 3.782 -20.507 1.00 0.00 N ATOM 0 H LYS A 66 0.834 1.671 -16.113 1.00 0.00 H new ATOM 0 HA LYS A 66 0.256 4.355 -14.997 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -0.736 4.833 -17.078 1.00 0.00 H new ATOM 0 HB3 LYS A 66 0.820 4.095 -17.403 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -0.211 2.524 -18.668 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.035 1.935 -17.239 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.020 2.877 -17.856 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.267 4.406 -18.264 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -1.388 3.210 -20.406 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.523 1.931 -20.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -3.497 3.544 -21.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -4.318 3.558 -20.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -3.219 4.797 -20.405 1.00 0.00 H new ATOM 1051 N GLN A 67 -1.590 1.734 -14.837 1.00 0.00 N ATOM 1052 CA GLN A 67 -2.812 1.184 -14.277 1.00 0.00 C ATOM 1053 C GLN A 67 -2.612 0.840 -12.799 1.00 0.00 C ATOM 1054 O GLN A 67 -1.548 0.362 -12.408 1.00 0.00 O ATOM 1055 CB GLN A 67 -3.275 -0.042 -15.067 1.00 0.00 C ATOM 1056 CG GLN A 67 -4.799 -0.175 -15.029 1.00 0.00 C ATOM 1057 CD GLN A 67 -5.309 -0.971 -16.232 1.00 0.00 C ATOM 1058 OE1 GLN A 67 -4.807 -2.032 -16.565 1.00 0.00 O ATOM 1059 NE2 GLN A 67 -6.332 -0.401 -16.863 1.00 0.00 N ATOM 0 H GLN A 67 -0.908 1.038 -15.139 1.00 0.00 H new ATOM 0 HA GLN A 67 -3.594 1.940 -14.351 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -2.939 0.039 -16.101 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -2.817 -0.940 -14.653 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -5.102 -0.670 -14.106 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -5.254 0.815 -15.024 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -6.704 0.489 -16.531 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -6.744 -0.854 -17.679 1.00 0.00 H new ATOM 1068 N PRO A 68 -3.678 1.105 -11.998 1.00 0.00 N ATOM 1069 CA PRO A 68 -3.629 0.829 -10.572 1.00 0.00 C ATOM 1070 C PRO A 68 -3.752 -0.672 -10.299 1.00 0.00 C ATOM 1071 O PRO A 68 -4.692 -1.316 -10.763 1.00 0.00 O ATOM 1072 CB PRO A 68 -4.770 1.636 -9.975 1.00 0.00 C ATOM 1073 CG PRO A 68 -5.699 1.964 -11.133 1.00 0.00 C ATOM 1074 CD PRO A 68 -4.954 1.671 -12.425 1.00 0.00 C ATOM 0 HA PRO A 68 -2.678 1.114 -10.121 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.291 1.066 -9.206 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -4.399 2.545 -9.502 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -6.609 1.367 -11.073 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -6.001 3.011 -11.095 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.508 0.971 -13.051 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -4.808 2.578 -13.012 1.00 0.00 H new ATOM 1082 N MET A 69 -2.789 -1.185 -9.548 1.00 0.00 N ATOM 1083 CA MET A 69 -2.778 -2.598 -9.208 1.00 0.00 C ATOM 1084 C MET A 69 -4.001 -2.969 -8.367 1.00 0.00 C ATOM 1085 O MET A 69 -4.405 -2.213 -7.485 1.00 0.00 O ATOM 1086 CB MET A 69 -1.503 -2.926 -8.429 1.00 0.00 C ATOM 1087 CG MET A 69 -0.285 -2.951 -9.354 1.00 0.00 C ATOM 1088 SD MET A 69 1.206 -2.696 -8.408 1.00 0.00 S ATOM 1089 CE MET A 69 1.108 -4.087 -7.294 1.00 0.00 C ATOM 0 H MET A 69 -2.011 -0.648 -9.165 1.00 0.00 H new ATOM 0 HA MET A 69 -2.808 -3.175 -10.132 1.00 0.00 H new ATOM 0 HB2 MET A 69 -1.352 -2.185 -7.644 1.00 0.00 H new ATOM 0 HB3 MET A 69 -1.611 -3.893 -7.939 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.235 -3.906 -9.877 1.00 0.00 H new ATOM 0 HG3 MET A 69 -0.380 -2.176 -10.115 1.00 0.00 H new ATOM 0 HE1 MET A 69 2.111 -4.462 -7.091 1.00 0.00 H new ATOM 0 HE2 MET A 69 0.643 -3.773 -6.360 1.00 0.00 H new ATOM 0 HE3 MET A 69 0.510 -4.877 -7.750 1.00 0.00 H new ATOM 1099 N ASP A 70 -4.556 -4.134 -8.669 1.00 0.00 N ATOM 1100 CA ASP A 70 -5.724 -4.615 -7.952 1.00 0.00 C ATOM 1101 C ASP A 70 -5.303 -5.091 -6.560 1.00 0.00 C ATOM 1102 O ASP A 70 -4.441 -5.959 -6.432 1.00 0.00 O ATOM 1103 CB ASP A 70 -6.370 -5.795 -8.680 1.00 0.00 C ATOM 1104 CG ASP A 70 -7.765 -5.521 -9.246 1.00 0.00 C ATOM 1105 OD1 ASP A 70 -8.106 -4.324 -9.359 1.00 0.00 O ATOM 1106 OD2 ASP A 70 -8.459 -6.515 -9.552 1.00 0.00 O ATOM 0 H ASP A 70 -4.218 -4.759 -9.401 1.00 0.00 H new ATOM 0 HA ASP A 70 -6.440 -3.796 -7.887 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -5.716 -6.100 -9.497 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -6.433 -6.637 -7.991 1.00 0.00 H new ATOM 1111 N LEU A 71 -5.930 -4.502 -5.553 1.00 0.00 N ATOM 1112 CA LEU A 71 -5.631 -4.855 -4.176 1.00 0.00 C ATOM 1113 C LEU A 71 -6.128 -6.276 -3.899 1.00 0.00 C ATOM 1114 O LEU A 71 -5.607 -6.958 -3.018 1.00 0.00 O ATOM 1115 CB LEU A 71 -6.201 -3.807 -3.218 1.00 0.00 C ATOM 1116 CG LEU A 71 -5.930 -2.346 -3.584 1.00 0.00 C ATOM 1117 CD1 LEU A 71 -7.141 -1.467 -3.263 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -4.657 -1.838 -2.906 1.00 0.00 C ATOM 0 H LEU A 71 -6.644 -3.782 -5.663 1.00 0.00 H new ATOM 0 HA LEU A 71 -4.554 -4.855 -4.008 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.280 -3.951 -3.154 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.795 -3.993 -2.224 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.766 -2.288 -4.660 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.922 -0.434 -3.532 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.004 -1.815 -3.831 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.360 -1.525 -2.197 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.488 -0.797 -3.183 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.766 -1.912 -1.824 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.808 -2.442 -3.227 1.00 0.00 H new ATOM 1130 N GLU A 72 -7.129 -6.679 -4.667 1.00 0.00 N ATOM 1131 CA GLU A 72 -7.701 -8.006 -4.516 1.00 0.00 C ATOM 1132 C GLU A 72 -6.603 -9.069 -4.582 1.00 0.00 C ATOM 1133 O GLU A 72 -6.787 -10.188 -4.106 1.00 0.00 O ATOM 1134 CB GLU A 72 -8.778 -8.263 -5.572 1.00 0.00 C ATOM 1135 CG GLU A 72 -8.160 -8.376 -6.968 1.00 0.00 C ATOM 1136 CD GLU A 72 -8.880 -9.437 -7.802 1.00 0.00 C ATOM 1137 OE1 GLU A 72 -8.547 -10.627 -7.615 1.00 0.00 O ATOM 1138 OE2 GLU A 72 -9.747 -9.034 -8.607 1.00 0.00 O ATOM 0 H GLU A 72 -7.559 -6.110 -5.396 1.00 0.00 H new ATOM 0 HA GLU A 72 -8.177 -8.065 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -9.316 -9.181 -5.333 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.507 -7.453 -5.558 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.215 -7.412 -7.473 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.104 -8.631 -6.882 1.00 0.00 H new ATOM 1145 N ASN A 73 -5.484 -8.681 -5.176 1.00 0.00 N ATOM 1146 CA ASN A 73 -4.356 -9.587 -5.311 1.00 0.00 C ATOM 1147 C ASN A 73 -3.649 -9.718 -3.961 1.00 0.00 C ATOM 1148 O ASN A 73 -3.681 -8.797 -3.147 1.00 0.00 O ATOM 1149 CB ASN A 73 -3.341 -9.056 -6.326 1.00 0.00 C ATOM 1150 CG ASN A 73 -3.999 -8.822 -7.688 1.00 0.00 C ATOM 1151 OD1 ASN A 73 -5.127 -9.216 -7.937 1.00 0.00 O ATOM 1152 ND2 ASN A 73 -3.234 -8.162 -8.552 1.00 0.00 N ATOM 0 H ASN A 73 -5.334 -7.752 -5.569 1.00 0.00 H new ATOM 0 HA ASN A 73 -4.736 -10.550 -5.651 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -2.910 -8.124 -5.961 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -2.521 -9.766 -6.431 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.582 -7.957 -9.488 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.299 -7.861 -8.278 1.00 0.00 H new ATOM 1159 N PRO A 74 -3.010 -10.902 -3.760 1.00 0.00 N ATOM 1160 CA PRO A 74 -2.296 -11.166 -2.522 1.00 0.00 C ATOM 1161 C PRO A 74 -0.970 -10.404 -2.480 1.00 0.00 C ATOM 1162 O PRO A 74 -0.299 -10.263 -3.502 1.00 0.00 O ATOM 1163 CB PRO A 74 -2.115 -12.675 -2.487 1.00 0.00 C ATOM 1164 CG PRO A 74 -2.318 -13.153 -3.915 1.00 0.00 C ATOM 1165 CD PRO A 74 -2.951 -12.016 -4.702 1.00 0.00 C ATOM 0 HA PRO A 74 -2.839 -10.822 -1.642 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.122 -12.941 -2.124 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.836 -13.139 -1.814 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.366 -13.441 -4.360 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -2.959 -14.034 -3.935 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.356 -11.762 -5.579 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.945 -12.286 -5.059 1.00 0.00 H new ATOM 1173 N VAL A 75 -0.632 -9.933 -1.289 1.00 0.00 N ATOM 1174 CA VAL A 75 0.601 -9.188 -1.101 1.00 0.00 C ATOM 1175 C VAL A 75 1.792 -10.089 -1.438 1.00 0.00 C ATOM 1176 O VAL A 75 2.908 -9.606 -1.622 1.00 0.00 O ATOM 1177 CB VAL A 75 0.661 -8.625 0.320 1.00 0.00 C ATOM 1178 CG1 VAL A 75 -0.340 -7.483 0.500 1.00 0.00 C ATOM 1179 CG2 VAL A 75 0.429 -9.727 1.356 1.00 0.00 C ATOM 0 H VAL A 75 -1.191 -10.053 -0.444 1.00 0.00 H new ATOM 0 HA VAL A 75 0.638 -8.333 -1.776 1.00 0.00 H new ATOM 0 HB VAL A 75 1.661 -8.221 0.479 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.277 -7.101 1.519 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.109 -6.682 -0.203 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.349 -7.851 0.312 1.00 0.00 H new ATOM 0 HG21 VAL A 75 0.477 -9.300 2.358 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.553 -10.174 1.198 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.197 -10.493 1.251 1.00 0.00 H new ATOM 1189 N SER A 76 1.513 -11.382 -1.509 1.00 0.00 N ATOM 1190 CA SER A 76 2.547 -12.355 -1.821 1.00 0.00 C ATOM 1191 C SER A 76 3.168 -12.039 -3.183 1.00 0.00 C ATOM 1192 O SER A 76 4.341 -12.326 -3.415 1.00 0.00 O ATOM 1193 CB SER A 76 1.985 -13.778 -1.810 1.00 0.00 C ATOM 1194 OG SER A 76 3.006 -14.753 -1.615 1.00 0.00 O ATOM 0 H SER A 76 0.586 -11.779 -1.356 1.00 0.00 H new ATOM 0 HA SER A 76 3.319 -12.293 -1.054 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.241 -13.868 -1.018 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.473 -13.973 -2.752 1.00 0.00 H new ATOM 0 HG SER A 76 2.607 -15.648 -1.613 1.00 0.00 H new ATOM 1200 N SER A 77 2.354 -11.453 -4.047 1.00 0.00 N ATOM 1201 CA SER A 77 2.809 -11.095 -5.380 1.00 0.00 C ATOM 1202 C SER A 77 3.541 -9.753 -5.340 1.00 0.00 C ATOM 1203 O SER A 77 4.458 -9.518 -6.126 1.00 0.00 O ATOM 1204 CB SER A 77 1.638 -11.032 -6.364 1.00 0.00 C ATOM 1205 OG SER A 77 1.693 -12.082 -7.326 1.00 0.00 O ATOM 0 H SER A 77 1.381 -11.217 -3.851 1.00 0.00 H new ATOM 0 HA SER A 77 3.497 -11.867 -5.725 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.699 -11.093 -5.814 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.646 -10.070 -6.876 1.00 0.00 H new ATOM 0 HG SER A 77 0.928 -12.009 -7.935 1.00 0.00 H new ATOM 1211 N VAL A 78 3.110 -8.906 -4.417 1.00 0.00 N ATOM 1212 CA VAL A 78 3.713 -7.593 -4.265 1.00 0.00 C ATOM 1213 C VAL A 78 4.749 -7.641 -3.140 1.00 0.00 C ATOM 1214 O VAL A 78 4.845 -6.711 -2.340 1.00 0.00 O ATOM 1215 CB VAL A 78 2.626 -6.542 -4.032 1.00 0.00 C ATOM 1216 CG1 VAL A 78 1.473 -6.718 -5.022 1.00 0.00 C ATOM 1217 CG2 VAL A 78 2.122 -6.584 -2.589 1.00 0.00 C ATOM 0 H VAL A 78 2.350 -9.104 -3.766 1.00 0.00 H new ATOM 0 HA VAL A 78 4.235 -7.304 -5.177 1.00 0.00 H new ATOM 0 HB VAL A 78 3.067 -5.560 -4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.714 -5.959 -4.835 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.848 -6.613 -6.040 1.00 0.00 H new ATOM 0 HG13 VAL A 78 1.034 -7.708 -4.897 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.350 -5.827 -2.451 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.706 -7.569 -2.377 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.950 -6.386 -1.908 1.00 0.00 H new ATOM 1227 N ALA A 79 5.499 -8.733 -3.115 1.00 0.00 N ATOM 1228 CA ALA A 79 6.525 -8.913 -2.102 1.00 0.00 C ATOM 1229 C ALA A 79 7.863 -9.205 -2.784 1.00 0.00 C ATOM 1230 O ALA A 79 8.461 -10.257 -2.561 1.00 0.00 O ATOM 1231 CB ALA A 79 6.104 -10.028 -1.143 1.00 0.00 C ATOM 0 H ALA A 79 5.417 -9.502 -3.780 1.00 0.00 H new ATOM 0 HA ALA A 79 6.647 -8.004 -1.513 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.873 -10.164 -0.383 1.00 0.00 H new ATOM 0 HB2 ALA A 79 5.163 -9.759 -0.663 1.00 0.00 H new ATOM 0 HB3 ALA A 79 5.975 -10.957 -1.699 1.00 0.00 H new ATOM 1237 N SER A 80 8.295 -8.255 -3.600 1.00 0.00 N ATOM 1238 CA SER A 80 9.551 -8.397 -4.316 1.00 0.00 C ATOM 1239 C SER A 80 10.081 -7.020 -4.721 1.00 0.00 C ATOM 1240 O SER A 80 11.182 -6.635 -4.331 1.00 0.00 O ATOM 1241 CB SER A 80 9.385 -9.285 -5.550 1.00 0.00 C ATOM 1242 OG SER A 80 10.501 -10.150 -5.740 1.00 0.00 O ATOM 0 H SER A 80 7.797 -7.383 -3.781 1.00 0.00 H new ATOM 0 HA SER A 80 10.270 -8.876 -3.652 1.00 0.00 H new ATOM 0 HB2 SER A 80 8.478 -9.881 -5.448 1.00 0.00 H new ATOM 0 HB3 SER A 80 9.258 -8.659 -6.433 1.00 0.00 H new ATOM 0 HG SER A 80 10.355 -10.702 -6.537 1.00 0.00 H new ATOM 1248 N GLN A 81 9.272 -6.315 -5.498 1.00 0.00 N ATOM 1249 CA GLN A 81 9.646 -4.989 -5.960 1.00 0.00 C ATOM 1250 C GLN A 81 8.996 -3.918 -5.082 1.00 0.00 C ATOM 1251 O GLN A 81 8.185 -4.232 -4.212 1.00 0.00 O ATOM 1252 CB GLN A 81 9.270 -4.794 -7.430 1.00 0.00 C ATOM 1253 CG GLN A 81 10.116 -5.691 -8.336 1.00 0.00 C ATOM 1254 CD GLN A 81 10.336 -5.038 -9.703 1.00 0.00 C ATOM 1255 OE1 GLN A 81 10.675 -3.871 -9.815 1.00 0.00 O ATOM 1256 NE2 GLN A 81 10.126 -5.854 -10.732 1.00 0.00 N ATOM 0 H GLN A 81 8.359 -6.637 -5.819 1.00 0.00 H new ATOM 0 HA GLN A 81 10.728 -4.890 -5.879 1.00 0.00 H new ATOM 0 HB2 GLN A 81 8.213 -5.021 -7.572 1.00 0.00 H new ATOM 0 HB3 GLN A 81 9.412 -3.750 -7.710 1.00 0.00 H new ATOM 0 HG2 GLN A 81 11.078 -5.887 -7.863 1.00 0.00 H new ATOM 0 HG3 GLN A 81 9.622 -6.654 -8.464 1.00 0.00 H new ATOM 0 HE21 GLN A 81 9.844 -6.820 -10.567 1.00 0.00 H new ATOM 0 HE22 GLN A 81 10.247 -5.514 -11.686 1.00 0.00 H new ATOM 1265 N THR A 82 9.377 -2.675 -5.340 1.00 0.00 N ATOM 1266 CA THR A 82 8.841 -1.556 -4.583 1.00 0.00 C ATOM 1267 C THR A 82 7.576 -1.017 -5.253 1.00 0.00 C ATOM 1268 O THR A 82 7.511 -0.918 -6.477 1.00 0.00 O ATOM 1269 CB THR A 82 9.947 -0.509 -4.441 1.00 0.00 C ATOM 1270 OG1 THR A 82 10.799 -1.039 -3.430 1.00 0.00 O ATOM 1271 CG2 THR A 82 9.437 0.805 -3.848 1.00 0.00 C ATOM 0 H THR A 82 10.050 -2.418 -6.062 1.00 0.00 H new ATOM 0 HA THR A 82 8.535 -1.864 -3.583 1.00 0.00 H new ATOM 0 HB THR A 82 10.392 -0.317 -5.417 1.00 0.00 H new ATOM 0 HG1 THR A 82 11.545 -0.423 -3.275 1.00 0.00 H new ATOM 0 HG21 THR A 82 10.262 1.513 -3.769 1.00 0.00 H new ATOM 0 HG22 THR A 82 8.664 1.220 -4.494 1.00 0.00 H new ATOM 0 HG23 THR A 82 9.021 0.620 -2.857 1.00 0.00 H new ATOM 1279 N LEU A 83 6.601 -0.681 -4.420 1.00 0.00 N ATOM 1280 CA LEU A 83 5.341 -0.154 -4.916 1.00 0.00 C ATOM 1281 C LEU A 83 5.336 1.368 -4.767 1.00 0.00 C ATOM 1282 O LEU A 83 6.207 1.934 -4.107 1.00 0.00 O ATOM 1283 CB LEU A 83 4.163 -0.844 -4.226 1.00 0.00 C ATOM 1284 CG LEU A 83 4.314 -2.347 -3.985 1.00 0.00 C ATOM 1285 CD1 LEU A 83 3.260 -2.852 -2.997 1.00 0.00 C ATOM 1286 CD2 LEU A 83 4.279 -3.121 -5.304 1.00 0.00 C ATOM 0 H LEU A 83 6.659 -0.764 -3.405 1.00 0.00 H new ATOM 0 HA LEU A 83 5.229 -0.371 -5.978 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.994 -0.357 -3.265 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.269 -0.681 -4.827 1.00 0.00 H new ATOM 0 HG LEU A 83 5.290 -2.524 -3.534 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.389 -3.923 -2.843 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.374 -2.332 -2.046 1.00 0.00 H new ATOM 0 HD13 LEU A 83 2.265 -2.661 -3.398 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.388 -4.187 -5.103 1.00 0.00 H new ATOM 0 HD22 LEU A 83 3.328 -2.942 -5.806 1.00 0.00 H new ATOM 0 HD23 LEU A 83 5.096 -2.787 -5.944 1.00 0.00 H new ATOM 1298 N VAL A 84 4.345 1.989 -5.390 1.00 0.00 N ATOM 1299 CA VAL A 84 4.215 3.435 -5.334 1.00 0.00 C ATOM 1300 C VAL A 84 2.795 3.799 -4.898 1.00 0.00 C ATOM 1301 O VAL A 84 1.823 3.390 -5.532 1.00 0.00 O ATOM 1302 CB VAL A 84 4.602 4.048 -6.682 1.00 0.00 C ATOM 1303 CG1 VAL A 84 4.401 5.564 -6.673 1.00 0.00 C ATOM 1304 CG2 VAL A 84 6.041 3.687 -7.055 1.00 0.00 C ATOM 0 H VAL A 84 3.624 1.517 -5.936 1.00 0.00 H new ATOM 0 HA VAL A 84 4.899 3.851 -4.594 1.00 0.00 H new ATOM 0 HB VAL A 84 3.944 3.628 -7.443 1.00 0.00 H new ATOM 0 HG11 VAL A 84 4.683 5.974 -7.643 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.354 5.791 -6.474 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.023 6.009 -5.896 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.291 4.135 -8.017 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.721 4.065 -6.291 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.138 2.603 -7.123 1.00 0.00 H new ATOM 1314 N LEU A 85 2.719 4.563 -3.818 1.00 0.00 N ATOM 1315 CA LEU A 85 1.433 4.986 -3.289 1.00 0.00 C ATOM 1316 C LEU A 85 1.090 6.370 -3.843 1.00 0.00 C ATOM 1317 O LEU A 85 1.960 7.234 -3.950 1.00 0.00 O ATOM 1318 CB LEU A 85 1.434 4.918 -1.761 1.00 0.00 C ATOM 1319 CG LEU A 85 0.059 4.914 -1.089 1.00 0.00 C ATOM 1320 CD1 LEU A 85 -0.617 6.281 -1.215 1.00 0.00 C ATOM 1321 CD2 LEU A 85 -0.818 3.788 -1.641 1.00 0.00 C ATOM 0 H LEU A 85 3.527 4.900 -3.295 1.00 0.00 H new ATOM 0 HA LEU A 85 0.645 4.307 -3.614 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.967 4.017 -1.457 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.000 5.768 -1.380 1.00 0.00 H new ATOM 0 HG LEU A 85 0.199 4.721 -0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.592 6.251 -0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.003 7.039 -0.737 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.744 6.528 -2.269 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.789 3.808 -1.147 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.954 3.925 -2.714 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.336 2.828 -1.456 1.00 0.00 H new ATOM 1333 N ASP A 86 -0.180 6.539 -4.181 1.00 0.00 N ATOM 1334 CA ASP A 86 -0.649 7.804 -4.721 1.00 0.00 C ATOM 1335 C ASP A 86 -1.834 8.300 -3.889 1.00 0.00 C ATOM 1336 O ASP A 86 -2.976 7.921 -4.142 1.00 0.00 O ATOM 1337 CB ASP A 86 -1.121 7.644 -6.167 1.00 0.00 C ATOM 1338 CG ASP A 86 -0.570 8.683 -7.146 1.00 0.00 C ATOM 1339 OD1 ASP A 86 0.195 9.554 -6.678 1.00 0.00 O ATOM 1340 OD2 ASP A 86 -0.926 8.582 -8.340 1.00 0.00 O ATOM 0 H ASP A 86 -0.899 5.821 -4.091 1.00 0.00 H new ATOM 0 HA ASP A 86 0.178 8.513 -4.688 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.839 6.651 -6.518 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -2.210 7.691 -6.185 1.00 0.00 H new ATOM 1345 N THR A 87 -1.520 9.142 -2.915 1.00 0.00 N ATOM 1346 CA THR A 87 -2.544 9.694 -2.045 1.00 0.00 C ATOM 1347 C THR A 87 -3.469 10.624 -2.834 1.00 0.00 C ATOM 1348 O THR A 87 -3.088 11.142 -3.882 1.00 0.00 O ATOM 1349 CB THR A 87 -1.846 10.384 -0.872 1.00 0.00 C ATOM 1350 OG1 THR A 87 -1.259 11.546 -1.452 1.00 0.00 O ATOM 1351 CG2 THR A 87 -0.651 9.585 -0.349 1.00 0.00 C ATOM 0 H THR A 87 -0.571 9.455 -2.709 1.00 0.00 H new ATOM 0 HA THR A 87 -3.187 8.911 -1.644 1.00 0.00 H new ATOM 0 HB THR A 87 -2.561 10.538 -0.064 1.00 0.00 H new ATOM 0 HG1 THR A 87 -0.317 11.602 -1.189 1.00 0.00 H new ATOM 0 HG21 THR A 87 -0.192 10.119 0.483 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.989 8.606 -0.009 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.080 9.460 -1.147 1.00 0.00 H new ATOM 1359 N PRO A 88 -4.699 10.811 -2.285 1.00 0.00 N ATOM 1360 CA PRO A 88 -5.682 11.669 -2.925 1.00 0.00 C ATOM 1361 C PRO A 88 -5.331 13.145 -2.729 1.00 0.00 C ATOM 1362 O PRO A 88 -4.554 13.490 -1.840 1.00 0.00 O ATOM 1363 CB PRO A 88 -7.010 11.285 -2.294 1.00 0.00 C ATOM 1364 CG PRO A 88 -6.665 10.562 -1.003 1.00 0.00 C ATOM 1365 CD PRO A 88 -5.186 10.213 -1.045 1.00 0.00 C ATOM 0 HA PRO A 88 -5.717 11.535 -4.006 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -7.618 12.168 -2.097 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -7.587 10.643 -2.959 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -6.884 11.193 -0.142 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -7.267 9.660 -0.898 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.660 10.614 -0.179 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -5.033 9.134 -1.039 1.00 0.00 H new ATOM 1373 N PRO A 89 -5.938 14.000 -3.596 1.00 0.00 N ATOM 1374 CA PRO A 89 -5.698 15.431 -3.527 1.00 0.00 C ATOM 1375 C PRO A 89 -6.437 16.055 -2.341 1.00 0.00 C ATOM 1376 O PRO A 89 -7.249 16.961 -2.518 1.00 0.00 O ATOM 1377 CB PRO A 89 -6.163 15.974 -4.868 1.00 0.00 C ATOM 1378 CG PRO A 89 -7.071 14.906 -5.457 1.00 0.00 C ATOM 1379 CD PRO A 89 -6.864 13.628 -4.661 1.00 0.00 C ATOM 0 HA PRO A 89 -4.649 15.673 -3.357 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -6.697 16.916 -4.744 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -5.316 16.172 -5.524 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -8.113 15.222 -5.408 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -6.836 14.743 -6.509 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.805 13.257 -4.255 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -6.452 12.835 -5.285 1.00 0.00 H new ATOM 1387 N ASP A 90 -6.130 15.543 -1.158 1.00 0.00 N ATOM 1388 CA ASP A 90 -6.755 16.038 0.057 1.00 0.00 C ATOM 1389 C ASP A 90 -5.904 15.636 1.263 1.00 0.00 C ATOM 1390 O ASP A 90 -5.544 16.480 2.083 1.00 0.00 O ATOM 1391 CB ASP A 90 -8.150 15.440 0.241 1.00 0.00 C ATOM 1392 CG ASP A 90 -9.255 16.455 0.541 1.00 0.00 C ATOM 1393 OD1 ASP A 90 -8.913 17.515 1.109 1.00 0.00 O ATOM 1394 OD2 ASP A 90 -10.417 16.149 0.195 1.00 0.00 O ATOM 0 H ASP A 90 -5.457 14.790 -1.015 1.00 0.00 H new ATOM 0 HA ASP A 90 -6.836 17.122 -0.022 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -8.416 14.893 -0.663 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -8.113 14.715 1.054 1.00 0.00 H new ATOM 1399 N ALA A 91 -5.608 14.347 1.334 1.00 0.00 N ATOM 1400 CA ALA A 91 -4.807 13.822 2.427 1.00 0.00 C ATOM 1401 C ALA A 91 -3.344 14.217 2.216 1.00 0.00 C ATOM 1402 O ALA A 91 -2.481 13.354 2.057 1.00 0.00 O ATOM 1403 CB ALA A 91 -4.995 12.306 2.516 1.00 0.00 C ATOM 0 H ALA A 91 -5.908 13.650 0.652 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.129 14.246 3.378 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -4.394 11.912 3.336 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.046 12.080 2.695 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -4.679 11.845 1.580 1.00 0.00 H new ATOM 1409 N LYS A 92 -3.109 15.521 2.222 1.00 0.00 N ATOM 1410 CA LYS A 92 -1.765 16.040 2.034 1.00 0.00 C ATOM 1411 C LYS A 92 -1.621 17.359 2.795 1.00 0.00 C ATOM 1412 O LYS A 92 -2.589 17.857 3.369 1.00 0.00 O ATOM 1413 CB LYS A 92 -1.438 16.152 0.543 1.00 0.00 C ATOM 1414 CG LYS A 92 -0.267 15.242 0.169 1.00 0.00 C ATOM 1415 CD LYS A 92 -0.463 14.641 -1.224 1.00 0.00 C ATOM 1416 CE LYS A 92 -0.077 15.643 -2.314 1.00 0.00 C ATOM 1417 NZ LYS A 92 1.362 15.527 -2.638 1.00 0.00 N ATOM 0 H LYS A 92 -3.827 16.234 2.354 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.029 15.351 2.448 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -2.315 15.883 -0.046 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.193 17.185 0.297 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.663 15.810 0.196 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.174 14.443 0.904 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.142 13.740 -1.323 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.503 14.342 -1.352 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.673 15.464 -3.209 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -0.300 16.656 -1.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 1.708 16.434 -3.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 1.893 15.281 -1.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 1.498 14.784 -3.353 1.00 0.00 H new ATOM 1431 N MET A 93 -0.406 17.887 2.776 1.00 0.00 N ATOM 1432 CA MET A 93 -0.123 19.139 3.458 1.00 0.00 C ATOM 1433 C MET A 93 -1.189 20.190 3.140 1.00 0.00 C ATOM 1434 O MET A 93 -1.854 20.697 4.041 1.00 0.00 O ATOM 1435 CB MET A 93 1.250 19.656 3.027 1.00 0.00 C ATOM 1436 CG MET A 93 1.921 20.440 4.157 1.00 0.00 C ATOM 1437 SD MET A 93 3.583 20.888 3.686 1.00 0.00 S ATOM 1438 CE MET A 93 3.471 22.665 3.806 1.00 0.00 C ATOM 0 H MET A 93 0.394 17.471 2.299 1.00 0.00 H new ATOM 0 HA MET A 93 -0.130 18.956 4.532 1.00 0.00 H new ATOM 0 HB2 MET A 93 1.883 18.818 2.736 1.00 0.00 H new ATOM 0 HB3 MET A 93 1.143 20.295 2.150 1.00 0.00 H new ATOM 0 HG2 MET A 93 1.344 21.337 4.381 1.00 0.00 H new ATOM 0 HG3 MET A 93 1.941 19.839 5.066 1.00 0.00 H new ATOM 0 HE1 MET A 93 4.431 23.109 3.543 1.00 0.00 H new ATOM 0 HE2 MET A 93 2.704 23.028 3.122 1.00 0.00 H new ATOM 0 HE3 MET A 93 3.209 22.945 4.826 1.00 0.00 H new ATOM 1448 N SER A 94 -1.317 20.485 1.854 1.00 0.00 N ATOM 1449 CA SER A 94 -2.289 21.467 1.405 1.00 0.00 C ATOM 1450 C SER A 94 -1.885 22.862 1.885 1.00 0.00 C ATOM 1451 O SER A 94 -1.197 23.000 2.896 1.00 0.00 O ATOM 1452 CB SER A 94 -3.693 21.120 1.906 1.00 0.00 C ATOM 1453 OG SER A 94 -4.704 21.545 0.996 1.00 0.00 O ATOM 0 H SER A 94 -0.764 20.061 1.109 1.00 0.00 H new ATOM 0 HA SER A 94 -2.307 21.456 0.315 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.769 20.043 2.055 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.858 21.589 2.876 1.00 0.00 H new ATOM 0 HG SER A 94 -5.585 21.304 1.350 1.00 0.00 H new ATOM 1459 N GLU A 95 -2.330 23.862 1.139 1.00 0.00 N ATOM 1460 CA GLU A 95 -2.023 25.242 1.475 1.00 0.00 C ATOM 1461 C GLU A 95 -3.125 26.171 0.963 1.00 0.00 C ATOM 1462 O GLU A 95 -3.674 25.953 -0.116 1.00 0.00 O ATOM 1463 CB GLU A 95 -0.658 25.651 0.918 1.00 0.00 C ATOM 1464 CG GLU A 95 0.006 26.702 1.811 1.00 0.00 C ATOM 1465 CD GLU A 95 1.218 27.325 1.116 1.00 0.00 C ATOM 1466 OE1 GLU A 95 2.065 26.539 0.639 1.00 0.00 O ATOM 1467 OE2 GLU A 95 1.271 28.573 1.077 1.00 0.00 O ATOM 0 H GLU A 95 -2.901 23.744 0.302 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.977 25.330 2.560 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -0.015 24.774 0.842 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -0.777 26.048 -0.090 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.715 27.481 2.060 1.00 0.00 H new ATOM 0 HG3 GLU A 95 0.317 26.243 2.750 1.00 0.00 H new ATOM 1474 N ALA A 96 -3.416 27.188 1.762 1.00 0.00 N ATOM 1475 CA ALA A 96 -4.443 28.151 1.403 1.00 0.00 C ATOM 1476 C ALA A 96 -4.321 28.490 -0.084 1.00 0.00 C ATOM 1477 O ALA A 96 -3.223 28.479 -0.639 1.00 0.00 O ATOM 1478 CB ALA A 96 -4.317 29.387 2.295 1.00 0.00 C ATOM 0 H ALA A 96 -2.958 27.366 2.656 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.436 27.732 1.565 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -5.087 30.110 2.026 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.440 29.097 3.338 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.334 29.837 2.157 1.00 0.00 H new ATOM 1484 N ARG A 97 -5.463 28.784 -0.687 1.00 0.00 N ATOM 1485 CA ARG A 97 -5.498 29.125 -2.099 1.00 0.00 C ATOM 1486 C ARG A 97 -6.935 29.407 -2.542 1.00 0.00 C ATOM 1487 O ARG A 97 -7.884 28.910 -1.937 1.00 0.00 O ATOM 1488 CB ARG A 97 -4.921 27.995 -2.954 1.00 0.00 C ATOM 1489 CG ARG A 97 -4.301 28.543 -4.241 1.00 0.00 C ATOM 1490 CD ARG A 97 -3.670 27.420 -5.067 1.00 0.00 C ATOM 1491 NE ARG A 97 -4.292 27.368 -6.408 1.00 0.00 N ATOM 1492 CZ ARG A 97 -3.727 26.788 -7.476 1.00 0.00 C ATOM 1493 NH1 ARG A 97 -2.524 26.209 -7.366 1.00 0.00 N ATOM 1494 NH2 ARG A 97 -4.365 26.789 -8.655 1.00 0.00 N ATOM 0 H ARG A 97 -6.372 28.793 -0.223 1.00 0.00 H new ATOM 0 HA ARG A 97 -4.889 30.018 -2.239 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -4.166 27.453 -2.385 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -5.708 27.282 -3.200 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -5.066 29.048 -4.831 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -3.544 29.288 -3.996 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -2.597 27.585 -5.161 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -3.802 26.465 -4.558 1.00 0.00 H new ATOM 0 HE ARG A 97 -5.208 27.801 -6.527 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -2.038 26.209 -6.469 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -2.094 25.768 -8.179 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -5.280 27.231 -8.739 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -3.935 26.348 -9.468 1.00 0.00 H new ATOM 1508 N SER A 98 -7.051 30.204 -3.594 1.00 0.00 N ATOM 1509 CA SER A 98 -8.356 30.558 -4.124 1.00 0.00 C ATOM 1510 C SER A 98 -8.726 29.619 -5.274 1.00 0.00 C ATOM 1511 O SER A 98 -9.771 28.970 -5.238 1.00 0.00 O ATOM 1512 CB SER A 98 -8.382 32.013 -4.598 1.00 0.00 C ATOM 1513 OG SER A 98 -9.578 32.681 -4.206 1.00 0.00 O ATOM 0 H SER A 98 -6.262 30.615 -4.093 1.00 0.00 H new ATOM 0 HA SER A 98 -9.090 30.451 -3.325 1.00 0.00 H new ATOM 0 HB2 SER A 98 -7.521 32.542 -4.190 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.290 32.042 -5.684 1.00 0.00 H new ATOM 0 HG SER A 98 -9.555 33.607 -4.526 1.00 0.00 H new ATOM 1519 N SER A 99 -7.849 29.575 -6.266 1.00 0.00 N ATOM 1520 CA SER A 99 -8.071 28.726 -7.424 1.00 0.00 C ATOM 1521 C SER A 99 -9.128 29.350 -8.336 1.00 0.00 C ATOM 1522 O SER A 99 -8.853 29.650 -9.497 1.00 0.00 O ATOM 1523 CB SER A 99 -8.498 27.319 -7.001 1.00 0.00 C ATOM 1524 OG SER A 99 -7.989 26.320 -7.880 1.00 0.00 O ATOM 0 H SER A 99 -6.983 30.114 -6.292 1.00 0.00 H new ATOM 0 HA SER A 99 -7.132 28.642 -7.972 1.00 0.00 H new ATOM 0 HB2 SER A 99 -8.147 27.123 -5.988 1.00 0.00 H new ATOM 0 HB3 SER A 99 -9.586 27.262 -6.978 1.00 0.00 H new ATOM 0 HG SER A 99 -8.282 25.436 -7.575 1.00 0.00 H new ATOM 1530 N GLY A 100 -10.316 29.528 -7.777 1.00 0.00 N ATOM 1531 CA GLY A 100 -11.416 30.111 -8.526 1.00 0.00 C ATOM 1532 C GLY A 100 -12.003 29.101 -9.514 1.00 0.00 C ATOM 1533 O GLY A 100 -11.479 28.925 -10.612 1.00 0.00 O ATOM 0 H GLY A 100 -10.541 29.279 -6.814 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -12.192 30.445 -7.838 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -11.067 30.992 -9.065 1.00 0.00 H new ATOM 1537 N PRO A 101 -13.113 28.447 -9.076 1.00 0.00 N ATOM 1538 CA PRO A 101 -13.777 27.460 -9.910 1.00 0.00 C ATOM 1539 C PRO A 101 -14.573 28.133 -11.029 1.00 0.00 C ATOM 1540 O PRO A 101 -14.650 29.359 -11.090 1.00 0.00 O ATOM 1541 CB PRO A 101 -14.651 26.663 -8.955 1.00 0.00 C ATOM 1542 CG PRO A 101 -14.801 27.524 -7.711 1.00 0.00 C ATOM 1543 CD PRO A 101 -13.762 28.630 -7.781 1.00 0.00 C ATOM 0 HA PRO A 101 -13.075 26.806 -10.427 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -15.622 26.448 -9.401 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -14.192 25.704 -8.714 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -15.805 27.946 -7.658 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -14.660 26.924 -6.812 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -14.225 29.614 -7.706 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -13.045 28.552 -6.964 1.00 0.00 H new ATOM 1551 N SER A 102 -15.146 27.301 -11.887 1.00 0.00 N ATOM 1552 CA SER A 102 -15.933 27.801 -13.001 1.00 0.00 C ATOM 1553 C SER A 102 -15.032 28.546 -13.987 1.00 0.00 C ATOM 1554 O SER A 102 -13.885 28.860 -13.670 1.00 0.00 O ATOM 1555 CB SER A 102 -17.058 28.717 -12.514 1.00 0.00 C ATOM 1556 OG SER A 102 -18.304 28.031 -12.423 1.00 0.00 O ATOM 0 H SER A 102 -15.081 26.285 -11.833 1.00 0.00 H new ATOM 0 HA SER A 102 -16.388 26.949 -13.507 1.00 0.00 H new ATOM 0 HB2 SER A 102 -16.796 29.125 -11.537 1.00 0.00 H new ATOM 0 HB3 SER A 102 -17.158 29.562 -13.195 1.00 0.00 H new ATOM 0 HG SER A 102 -18.996 28.649 -12.107 1.00 0.00 H new ATOM 1562 N SER A 103 -15.583 28.808 -15.163 1.00 0.00 N ATOM 1563 CA SER A 103 -14.843 29.510 -16.197 1.00 0.00 C ATOM 1564 C SER A 103 -15.758 29.802 -17.389 1.00 0.00 C ATOM 1565 O SER A 103 -16.018 28.920 -18.206 1.00 0.00 O ATOM 1566 CB SER A 103 -13.625 28.702 -16.649 1.00 0.00 C ATOM 1567 OG SER A 103 -13.123 29.149 -17.905 1.00 0.00 O ATOM 0 H SER A 103 -16.534 28.546 -15.423 1.00 0.00 H new ATOM 0 HA SER A 103 -14.486 30.452 -15.781 1.00 0.00 H new ATOM 0 HB2 SER A 103 -12.840 28.779 -15.897 1.00 0.00 H new ATOM 0 HB3 SER A 103 -13.895 27.649 -16.721 1.00 0.00 H new ATOM 0 HG SER A 103 -12.345 28.609 -18.157 1.00 0.00 H new ATOM 1573 N GLY A 104 -16.220 31.042 -17.450 1.00 0.00 N ATOM 1574 CA GLY A 104 -17.100 31.461 -18.527 1.00 0.00 C ATOM 1575 C GLY A 104 -18.437 31.963 -17.980 1.00 0.00 C ATOM 1576 O GLY A 104 -19.494 31.642 -18.522 1.00 0.00 O ATOM 0 H GLY A 104 -16.001 31.770 -16.770 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -16.621 32.250 -19.106 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -17.272 30.626 -19.207 1.00 0.00 H new TER 1580 GLY A 104