USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 772 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 12 SER OG : rot 180:sc= -0.69 USER MOD Set 1.2: A 139 THR OG1 : rot 51:sc= 0.234 USER MOD Set 2.1: A 108 SER OG : rot 179:sc= 1.05 USER MOD Set 2.2: A 130 SER OG : rot -123:sc= 1.08 USER MOD Set 3.1: A 45 TYR OH : rot 180:sc= -1.64 USER MOD Set 3.2: A 61 GLN : amide:sc= -1.66 K(o=-3.3,f=-4.2) USER MOD Set 4.1: A 34 ASN : amide:sc= 0.461 K(o=0.56,f=-6!) USER MOD Set 4.2: A 35 SER OG : rot -61:sc= 0.0968 USER MOD Single : A 2 THR OG1 : rot 36:sc= 0.189 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 19:sc= -0.255 USER MOD Single : A 6 THR OG1 : rot 130:sc= -0.489 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.637 X(o=-0.64,f=-0.4) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 17 GLN : amide:sc= -0.165 K(o=-0.17,f=-0.79) USER MOD Single : A 18 MET CE :methyl 138:sc= -0.202 (180deg=-1.03) USER MOD Single : A 19 ASN : amide:sc= -1.06 K(o=-1.1,f=-0.2) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -155:sc= -0.257 (180deg=-1.44!) USER MOD Single : A 25 ASN : amide:sc= -1.64 K(o=-1.6,f=-2.8!) USER MOD Single : A 27 LYS NZ :NH3+ -108:sc= 1.08 (180deg=-0.0173) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.772 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 9:sc= -0.113 USER MOD Single : A 66 THR OG1 : rot 170:sc= -0.703 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 44:sc= 0.104 USER MOD Single : A 80 TYR OH : rot 15:sc= -0.783 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot -36:sc=0.000258 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.802 K(o=-0.8,f=-1.3) USER MOD Single : A 126 SER OG : rot 27:sc= 0.829 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N THR A 2 116.668 -20.932 7.574 1.00 0.00 N ATOM 14 CA THR A 2 117.273 -20.433 6.342 1.00 0.00 C ATOM 15 C THR A 2 117.404 -18.914 6.390 1.00 0.00 C ATOM 16 O THR A 2 116.513 -18.220 6.880 1.00 0.00 O ATOM 17 CB THR A 2 116.412 -20.833 5.142 1.00 0.00 C ATOM 18 OG1 THR A 2 116.202 -22.237 5.161 1.00 0.00 O ATOM 19 CG2 THR A 2 117.121 -20.440 3.845 1.00 0.00 C ATOM 0 HA THR A 2 118.266 -20.871 6.241 1.00 0.00 H new ATOM 0 HB THR A 2 115.452 -20.319 5.197 1.00 0.00 H new ATOM 0 HG1 THR A 2 116.114 -22.542 6.088 1.00 0.00 H new ATOM 0 HG21 THR A 2 116.505 -20.726 2.992 1.00 0.00 H new ATOM 0 HG22 THR A 2 117.282 -19.362 3.831 1.00 0.00 H new ATOM 0 HG23 THR A 2 118.082 -20.951 3.786 1.00 0.00 H new ATOM 27 N SER A 3 118.522 -18.402 5.880 1.00 0.00 N ATOM 28 CA SER A 3 118.767 -16.962 5.868 1.00 0.00 C ATOM 29 C SER A 3 119.040 -16.481 4.447 1.00 0.00 C ATOM 30 O SER A 3 119.712 -17.163 3.673 1.00 0.00 O ATOM 31 CB SER A 3 119.967 -16.633 6.758 1.00 0.00 C ATOM 32 OG SER A 3 120.122 -15.222 6.829 1.00 0.00 O ATOM 0 H SER A 3 119.271 -18.961 5.471 1.00 0.00 H new ATOM 0 HA SER A 3 117.881 -16.455 6.249 1.00 0.00 H new ATOM 0 HB2 SER A 3 119.819 -17.045 7.756 1.00 0.00 H new ATOM 0 HB3 SER A 3 120.870 -17.090 6.355 1.00 0.00 H new ATOM 0 HG SER A 3 120.889 -15.005 7.400 1.00 0.00 H new ATOM 38 N THR A 4 118.505 -15.309 4.113 1.00 0.00 N ATOM 39 CA THR A 4 118.698 -14.728 2.785 1.00 0.00 C ATOM 40 C THR A 4 119.173 -13.282 2.903 1.00 0.00 C ATOM 41 O THR A 4 118.618 -12.501 3.676 1.00 0.00 O ATOM 42 CB THR A 4 117.391 -14.762 1.990 1.00 0.00 C ATOM 43 OG1 THR A 4 116.433 -13.930 2.625 1.00 0.00 O ATOM 44 CG2 THR A 4 116.859 -16.197 1.914 1.00 0.00 C ATOM 0 H THR A 4 117.935 -14.743 4.742 1.00 0.00 H new ATOM 0 HA THR A 4 119.452 -15.318 2.264 1.00 0.00 H new ATOM 0 HB THR A 4 117.576 -14.401 0.979 1.00 0.00 H new ATOM 0 HG1 THR A 4 116.889 -13.309 3.230 1.00 0.00 H new ATOM 0 HG21 THR A 4 115.929 -16.211 1.346 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.595 -16.832 1.420 1.00 0.00 H new ATOM 0 HG23 THR A 4 116.675 -16.571 2.921 1.00 0.00 H new ATOM 52 N VAL A 5 120.201 -12.930 2.136 1.00 0.00 N ATOM 53 CA VAL A 5 120.731 -11.567 2.152 1.00 0.00 C ATOM 54 C VAL A 5 120.641 -10.977 0.752 1.00 0.00 C ATOM 55 O VAL A 5 121.033 -11.623 -0.219 1.00 0.00 O ATOM 56 CB VAL A 5 122.188 -11.571 2.624 1.00 0.00 C ATOM 57 CG1 VAL A 5 122.256 -12.090 4.061 1.00 0.00 C ATOM 58 CG2 VAL A 5 123.024 -12.479 1.718 1.00 0.00 C ATOM 0 H VAL A 5 120.682 -13.564 1.499 1.00 0.00 H new ATOM 0 HA VAL A 5 120.144 -10.961 2.842 1.00 0.00 H new ATOM 0 HB VAL A 5 122.582 -10.556 2.581 1.00 0.00 H new ATOM 0 HG11 VAL A 5 123.293 -12.093 4.398 1.00 0.00 H new ATOM 0 HG12 VAL A 5 121.666 -11.443 4.710 1.00 0.00 H new ATOM 0 HG13 VAL A 5 121.858 -13.104 4.101 1.00 0.00 H new ATOM 0 HG21 VAL A 5 124.060 -12.478 2.058 1.00 0.00 H new ATOM 0 HG22 VAL A 5 122.630 -13.494 1.757 1.00 0.00 H new ATOM 0 HG23 VAL A 5 122.979 -12.111 0.693 1.00 0.00 H new ATOM 68 N THR A 6 120.100 -9.766 0.645 1.00 0.00 N ATOM 69 CA THR A 6 119.894 -9.154 -0.667 1.00 0.00 C ATOM 70 C THR A 6 120.254 -7.674 -0.641 1.00 0.00 C ATOM 71 O THR A 6 120.450 -7.084 0.422 1.00 0.00 O ATOM 72 CB THR A 6 118.428 -9.281 -1.111 1.00 0.00 C ATOM 73 OG1 THR A 6 117.637 -8.398 -0.330 1.00 0.00 O ATOM 74 CG2 THR A 6 117.905 -10.713 -0.943 1.00 0.00 C ATOM 0 H THR A 6 119.800 -9.196 1.436 1.00 0.00 H new ATOM 0 HA THR A 6 120.541 -9.681 -1.368 1.00 0.00 H new ATOM 0 HB THR A 6 118.366 -9.026 -2.169 1.00 0.00 H new ATOM 0 HG1 THR A 6 117.070 -7.858 -0.920 1.00 0.00 H new ATOM 0 HG21 THR A 6 116.866 -10.761 -1.268 1.00 0.00 H new ATOM 0 HG22 THR A 6 118.506 -11.393 -1.547 1.00 0.00 H new ATOM 0 HG23 THR A 6 117.972 -11.004 0.105 1.00 0.00 H new ATOM 82 N GLY A 7 120.336 -7.086 -1.827 1.00 0.00 N ATOM 83 CA GLY A 7 120.438 -5.639 -1.952 1.00 0.00 C ATOM 84 C GLY A 7 119.869 -5.202 -3.294 1.00 0.00 C ATOM 85 O GLY A 7 119.917 -5.966 -4.259 1.00 0.00 O ATOM 0 H GLY A 7 120.334 -7.588 -2.715 1.00 0.00 H new ATOM 0 HA2 GLY A 7 119.895 -5.154 -1.140 1.00 0.00 H new ATOM 0 HA3 GLY A 7 121.480 -5.329 -1.869 1.00 0.00 H new ATOM 89 N GLY A 8 119.333 -3.986 -3.356 1.00 0.00 N ATOM 90 CA GLY A 8 118.781 -3.488 -4.611 1.00 0.00 C ATOM 91 C GLY A 8 118.750 -1.966 -4.652 1.00 0.00 C ATOM 92 O GLY A 8 118.935 -1.298 -3.635 1.00 0.00 O ATOM 0 H GLY A 8 119.270 -3.340 -2.570 1.00 0.00 H new ATOM 0 HA2 GLY A 8 119.377 -3.862 -5.444 1.00 0.00 H new ATOM 0 HA3 GLY A 8 117.771 -3.876 -4.743 1.00 0.00 H new ATOM 96 N TYR A 9 118.467 -1.442 -5.841 1.00 0.00 N ATOM 97 CA TYR A 9 118.423 -0.002 -6.069 1.00 0.00 C ATOM 98 C TYR A 9 117.072 0.401 -6.653 1.00 0.00 C ATOM 99 O TYR A 9 116.457 -0.372 -7.392 1.00 0.00 O ATOM 100 CB TYR A 9 119.557 0.413 -7.012 1.00 0.00 C ATOM 101 CG TYR A 9 119.405 -0.103 -8.425 1.00 0.00 C ATOM 102 CD1 TYR A 9 119.947 -1.344 -8.781 1.00 0.00 C ATOM 103 CD2 TYR A 9 118.720 0.661 -9.379 1.00 0.00 C ATOM 104 CE1 TYR A 9 119.806 -1.821 -10.090 1.00 0.00 C ATOM 105 CE2 TYR A 9 118.580 0.184 -10.687 1.00 0.00 C ATOM 106 CZ TYR A 9 119.121 -1.057 -11.043 1.00 0.00 C ATOM 107 OH TYR A 9 118.982 -1.526 -12.333 1.00 0.00 O ATOM 0 H TYR A 9 118.263 -2.001 -6.670 1.00 0.00 H new ATOM 0 HA TYR A 9 118.553 0.510 -5.116 1.00 0.00 H new ATOM 0 HB2 TYR A 9 119.613 1.501 -7.038 1.00 0.00 H new ATOM 0 HB3 TYR A 9 120.503 0.054 -6.605 1.00 0.00 H new ATOM 0 HD1 TYR A 9 120.474 -1.934 -8.046 1.00 0.00 H new ATOM 0 HD2 TYR A 9 118.300 1.618 -9.105 1.00 0.00 H new ATOM 0 HE1 TYR A 9 120.225 -2.778 -10.364 1.00 0.00 H new ATOM 0 HE2 TYR A 9 118.054 0.774 -11.423 1.00 0.00 H new ATOM 0 HH TYR A 9 118.480 -0.874 -12.866 1.00 0.00 H new ATOM 117 N ALA A 10 116.587 1.576 -6.261 1.00 0.00 N ATOM 118 CA ALA A 10 115.315 2.079 -6.769 1.00 0.00 C ATOM 119 C ALA A 10 115.391 3.574 -7.065 1.00 0.00 C ATOM 120 O ALA A 10 116.097 4.316 -6.383 1.00 0.00 O ATOM 121 CB ALA A 10 114.213 1.825 -5.740 1.00 0.00 C ATOM 0 H ALA A 10 117.053 2.194 -5.597 1.00 0.00 H new ATOM 0 HA ALA A 10 115.090 1.553 -7.697 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.264 2.202 -6.122 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.129 0.754 -5.553 1.00 0.00 H new ATOM 0 HB3 ALA A 10 114.459 2.338 -4.810 1.00 0.00 H new ATOM 127 N GLN A 11 114.648 4.003 -8.081 1.00 0.00 N ATOM 128 CA GLN A 11 114.535 5.421 -8.412 1.00 0.00 C ATOM 129 C GLN A 11 113.062 5.818 -8.452 1.00 0.00 C ATOM 130 O GLN A 11 112.228 5.058 -8.943 1.00 0.00 O ATOM 131 CB GLN A 11 115.182 5.699 -9.773 1.00 0.00 C ATOM 132 CG GLN A 11 116.641 5.228 -9.779 1.00 0.00 C ATOM 133 CD GLN A 11 117.447 5.933 -8.690 1.00 0.00 C ATOM 134 OE1 GLN A 11 117.397 7.158 -8.575 1.00 0.00 O ATOM 135 NE2 GLN A 11 118.189 5.229 -7.880 1.00 0.00 N ATOM 0 H GLN A 11 114.113 3.386 -8.692 1.00 0.00 H new ATOM 0 HA GLN A 11 115.050 6.007 -7.651 1.00 0.00 H new ATOM 0 HB2 GLN A 11 114.625 5.188 -10.558 1.00 0.00 H new ATOM 0 HB3 GLN A 11 115.137 6.766 -9.993 1.00 0.00 H new ATOM 0 HG2 GLN A 11 116.680 4.150 -9.625 1.00 0.00 H new ATOM 0 HG3 GLN A 11 117.087 5.427 -10.753 1.00 0.00 H new ATOM 0 HE21 GLN A 11 118.229 4.214 -7.977 1.00 0.00 H new ATOM 0 HE22 GLN A 11 118.729 5.693 -7.150 1.00 0.00 H new ATOM 144 N SER A 12 112.736 7.004 -7.939 1.00 0.00 N ATOM 145 CA SER A 12 111.339 7.429 -7.856 1.00 0.00 C ATOM 146 C SER A 12 111.126 8.741 -8.601 1.00 0.00 C ATOM 147 O SER A 12 111.953 9.649 -8.519 1.00 0.00 O ATOM 148 CB SER A 12 110.944 7.612 -6.391 1.00 0.00 C ATOM 149 OG SER A 12 111.186 6.401 -5.687 1.00 0.00 O ATOM 0 H SER A 12 113.410 7.680 -7.579 1.00 0.00 H new ATOM 0 HA SER A 12 110.718 6.660 -8.316 1.00 0.00 H new ATOM 0 HB2 SER A 12 111.517 8.426 -5.946 1.00 0.00 H new ATOM 0 HB3 SER A 12 109.891 7.886 -6.317 1.00 0.00 H new ATOM 0 HG SER A 12 110.936 6.514 -4.746 1.00 0.00 H new ATOM 155 N ASP A 13 109.998 8.831 -9.301 1.00 0.00 N ATOM 156 CA ASP A 13 109.625 10.049 -10.014 1.00 0.00 C ATOM 157 C ASP A 13 108.267 10.527 -9.515 1.00 0.00 C ATOM 158 O ASP A 13 107.368 9.720 -9.286 1.00 0.00 O ATOM 159 CB ASP A 13 109.575 9.789 -11.524 1.00 0.00 C ATOM 160 CG ASP A 13 108.503 8.756 -11.871 1.00 0.00 C ATOM 161 OD1 ASP A 13 108.192 7.933 -11.025 1.00 0.00 O ATOM 162 OD2 ASP A 13 108.007 8.803 -12.985 1.00 0.00 O ATOM 0 H ASP A 13 109.324 8.071 -9.390 1.00 0.00 H new ATOM 0 HA ASP A 13 110.372 10.820 -9.825 1.00 0.00 H new ATOM 0 HB2 ASP A 13 109.369 10.721 -12.050 1.00 0.00 H new ATOM 0 HB3 ASP A 13 110.548 9.437 -11.868 1.00 0.00 H new ATOM 167 N ALA A 14 108.126 11.837 -9.340 1.00 0.00 N ATOM 168 CA ALA A 14 106.912 12.402 -8.773 1.00 0.00 C ATOM 169 C ALA A 14 106.100 13.103 -9.855 1.00 0.00 C ATOM 170 O ALA A 14 106.476 14.165 -10.350 1.00 0.00 O ATOM 171 CB ALA A 14 107.273 13.393 -7.664 1.00 0.00 C ATOM 0 H ALA A 14 108.839 12.525 -9.583 1.00 0.00 H new ATOM 0 HA ALA A 14 106.310 11.597 -8.353 1.00 0.00 H new ATOM 0 HB1 ALA A 14 106.361 13.814 -7.241 1.00 0.00 H new ATOM 0 HB2 ALA A 14 107.830 12.877 -6.882 1.00 0.00 H new ATOM 0 HB3 ALA A 14 107.885 14.194 -8.077 1.00 0.00 H new ATOM 177 N GLN A 15 104.991 12.481 -10.219 1.00 0.00 N ATOM 178 CA GLN A 15 104.072 13.061 -11.191 1.00 0.00 C ATOM 179 C GLN A 15 103.181 14.098 -10.514 1.00 0.00 C ATOM 180 O GLN A 15 102.456 13.787 -9.565 1.00 0.00 O ATOM 181 CB GLN A 15 103.208 11.966 -11.817 1.00 0.00 C ATOM 182 CG GLN A 15 102.344 12.565 -12.928 1.00 0.00 C ATOM 183 CD GLN A 15 101.350 11.527 -13.436 1.00 0.00 C ATOM 184 OE1 GLN A 15 100.574 10.975 -12.654 1.00 0.00 O ATOM 185 NE2 GLN A 15 101.325 11.224 -14.705 1.00 0.00 N ATOM 0 H GLN A 15 104.703 11.572 -9.857 1.00 0.00 H new ATOM 0 HA GLN A 15 104.652 13.547 -11.975 1.00 0.00 H new ATOM 0 HB2 GLN A 15 103.841 11.176 -12.221 1.00 0.00 H new ATOM 0 HB3 GLN A 15 102.575 11.509 -11.056 1.00 0.00 H new ATOM 0 HG2 GLN A 15 101.810 13.438 -12.553 1.00 0.00 H new ATOM 0 HG3 GLN A 15 102.977 12.906 -13.748 1.00 0.00 H new ATOM 0 HE21 GLN A 15 101.968 11.682 -15.351 1.00 0.00 H new ATOM 0 HE22 GLN A 15 100.663 10.530 -15.051 1.00 0.00 H new ATOM 194 N GLY A 16 103.247 15.319 -11.032 1.00 0.00 N ATOM 195 CA GLY A 16 102.532 16.458 -10.456 1.00 0.00 C ATOM 196 C GLY A 16 103.325 17.154 -9.339 1.00 0.00 C ATOM 197 O GLY A 16 102.987 18.270 -8.944 1.00 0.00 O ATOM 0 H GLY A 16 103.795 15.550 -11.861 1.00 0.00 H new ATOM 0 HA2 GLY A 16 102.312 17.179 -11.243 1.00 0.00 H new ATOM 0 HA3 GLY A 16 101.576 16.118 -10.059 1.00 0.00 H new ATOM 201 N GLN A 17 104.374 16.506 -8.829 1.00 0.00 N ATOM 202 CA GLN A 17 105.289 17.134 -7.882 1.00 0.00 C ATOM 203 C GLN A 17 106.683 17.226 -8.500 1.00 0.00 C ATOM 204 O GLN A 17 107.082 16.343 -9.259 1.00 0.00 O ATOM 205 CB GLN A 17 105.336 16.321 -6.587 1.00 0.00 C ATOM 206 CG GLN A 17 106.167 17.060 -5.535 1.00 0.00 C ATOM 207 CD GLN A 17 105.421 18.301 -5.057 1.00 0.00 C ATOM 208 OE1 GLN A 17 104.218 18.243 -4.801 1.00 0.00 O ATOM 209 NE2 GLN A 17 106.066 19.427 -4.924 1.00 0.00 N ATOM 0 H GLN A 17 104.609 15.541 -9.060 1.00 0.00 H new ATOM 0 HA GLN A 17 104.937 18.139 -7.651 1.00 0.00 H new ATOM 0 HB2 GLN A 17 104.325 16.157 -6.214 1.00 0.00 H new ATOM 0 HB3 GLN A 17 105.768 15.339 -6.780 1.00 0.00 H new ATOM 0 HG2 GLN A 17 106.370 16.400 -4.691 1.00 0.00 H new ATOM 0 HG3 GLN A 17 107.131 17.345 -5.956 1.00 0.00 H new ATOM 0 HE21 GLN A 17 107.063 19.472 -5.137 1.00 0.00 H new ATOM 0 HE22 GLN A 17 105.574 20.262 -4.607 1.00 0.00 H new ATOM 218 N MET A 18 107.414 18.292 -8.191 1.00 0.00 N ATOM 219 CA MET A 18 108.790 18.414 -8.664 1.00 0.00 C ATOM 220 C MET A 18 109.741 17.733 -7.684 1.00 0.00 C ATOM 221 O MET A 18 110.117 18.320 -6.669 1.00 0.00 O ATOM 222 CB MET A 18 109.168 19.890 -8.807 1.00 0.00 C ATOM 223 CG MET A 18 108.273 20.548 -9.859 1.00 0.00 C ATOM 224 SD MET A 18 108.866 22.225 -10.192 1.00 0.00 S ATOM 225 CE MET A 18 110.353 21.760 -11.113 1.00 0.00 C ATOM 0 H MET A 18 107.084 19.073 -7.624 1.00 0.00 H new ATOM 0 HA MET A 18 108.870 17.929 -9.637 1.00 0.00 H new ATOM 0 HB2 MET A 18 109.056 20.399 -7.850 1.00 0.00 H new ATOM 0 HB3 MET A 18 110.215 19.982 -9.096 1.00 0.00 H new ATOM 0 HG2 MET A 18 108.279 19.960 -10.777 1.00 0.00 H new ATOM 0 HG3 MET A 18 107.242 20.579 -9.507 1.00 0.00 H new ATOM 0 HE1 MET A 18 110.466 22.415 -11.977 1.00 0.00 H new ATOM 0 HE2 MET A 18 111.226 21.857 -10.468 1.00 0.00 H new ATOM 0 HE3 MET A 18 110.264 20.727 -11.450 1.00 0.00 H new ATOM 235 N ASN A 19 110.128 16.495 -7.990 1.00 0.00 N ATOM 236 CA ASN A 19 111.005 15.747 -7.094 1.00 0.00 C ATOM 237 C ASN A 19 111.490 14.446 -7.730 1.00 0.00 C ATOM 238 O ASN A 19 110.723 13.721 -8.365 1.00 0.00 O ATOM 239 CB ASN A 19 110.262 15.429 -5.795 1.00 0.00 C ATOM 240 CG ASN A 19 111.251 14.972 -4.727 1.00 0.00 C ATOM 241 OD1 ASN A 19 112.153 15.722 -4.355 1.00 0.00 O ATOM 242 ND2 ASN A 19 111.133 13.781 -4.209 1.00 0.00 N ATOM 0 H ASN A 19 109.853 15.997 -8.837 1.00 0.00 H new ATOM 0 HA ASN A 19 111.877 16.368 -6.889 1.00 0.00 H new ATOM 0 HB2 ASN A 19 109.723 16.311 -5.450 1.00 0.00 H new ATOM 0 HB3 ASN A 19 109.520 14.651 -5.972 1.00 0.00 H new ATOM 0 HD21 ASN A 19 111.789 13.469 -3.493 1.00 0.00 H new ATOM 0 HD22 ASN A 19 110.384 13.162 -4.519 1.00 0.00 H new ATOM 249 N LYS A 20 112.778 14.164 -7.548 1.00 0.00 N ATOM 250 CA LYS A 20 113.373 12.911 -8.004 1.00 0.00 C ATOM 251 C LYS A 20 114.259 12.347 -6.897 1.00 0.00 C ATOM 252 O LYS A 20 115.046 13.084 -6.303 1.00 0.00 O ATOM 253 CB LYS A 20 114.207 13.152 -9.263 1.00 0.00 C ATOM 254 CG LYS A 20 114.729 11.815 -9.796 1.00 0.00 C ATOM 255 CD LYS A 20 115.482 12.049 -11.109 1.00 0.00 C ATOM 256 CE LYS A 20 116.767 12.829 -10.829 1.00 0.00 C ATOM 257 NZ LYS A 20 117.638 12.802 -12.038 1.00 0.00 N ATOM 0 H LYS A 20 113.434 14.792 -7.084 1.00 0.00 H new ATOM 0 HA LYS A 20 112.582 12.199 -8.240 1.00 0.00 H new ATOM 0 HB2 LYS A 20 113.602 13.647 -10.023 1.00 0.00 H new ATOM 0 HB3 LYS A 20 115.041 13.816 -9.037 1.00 0.00 H new ATOM 0 HG2 LYS A 20 115.389 11.352 -9.063 1.00 0.00 H new ATOM 0 HG3 LYS A 20 113.899 11.127 -9.958 1.00 0.00 H new ATOM 0 HD2 LYS A 20 115.719 11.095 -11.580 1.00 0.00 H new ATOM 0 HD3 LYS A 20 114.854 12.602 -11.807 1.00 0.00 H new ATOM 0 HE2 LYS A 20 116.529 13.859 -10.562 1.00 0.00 H new ATOM 0 HE3 LYS A 20 117.292 12.393 -9.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 118.512 13.332 -11.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 117.875 11.817 -12.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 117.136 13.238 -12.838 1.00 0.00 H new ATOM 271 N MET A 21 114.143 11.048 -6.618 1.00 0.00 N ATOM 272 CA MET A 21 114.840 10.470 -5.467 1.00 0.00 C ATOM 273 C MET A 21 115.569 9.183 -5.837 1.00 0.00 C ATOM 274 O MET A 21 115.141 8.454 -6.730 1.00 0.00 O ATOM 275 CB MET A 21 113.823 10.169 -4.366 1.00 0.00 C ATOM 276 CG MET A 21 113.161 11.473 -3.915 1.00 0.00 C ATOM 277 SD MET A 21 112.104 11.160 -2.478 1.00 0.00 S ATOM 278 CE MET A 21 110.975 9.982 -3.261 1.00 0.00 C ATOM 0 H MET A 21 113.586 10.388 -7.160 1.00 0.00 H new ATOM 0 HA MET A 21 115.581 11.192 -5.123 1.00 0.00 H new ATOM 0 HB2 MET A 21 113.068 9.473 -4.733 1.00 0.00 H new ATOM 0 HB3 MET A 21 114.316 9.688 -3.522 1.00 0.00 H new ATOM 0 HG2 MET A 21 113.923 12.210 -3.663 1.00 0.00 H new ATOM 0 HG3 MET A 21 112.569 11.891 -4.729 1.00 0.00 H new ATOM 0 HE1 MET A 21 110.019 9.992 -2.738 1.00 0.00 H new ATOM 0 HE2 MET A 21 110.822 10.263 -4.303 1.00 0.00 H new ATOM 0 HE3 MET A 21 111.404 8.981 -3.214 1.00 0.00 H new ATOM 288 N GLY A 22 116.662 8.908 -5.128 1.00 0.00 N ATOM 289 CA GLY A 22 117.390 7.653 -5.302 1.00 0.00 C ATOM 290 C GLY A 22 117.617 7.001 -3.944 1.00 0.00 C ATOM 291 O GLY A 22 117.975 7.684 -2.986 1.00 0.00 O ATOM 0 H GLY A 22 117.062 9.535 -4.430 1.00 0.00 H new ATOM 0 HA2 GLY A 22 116.827 6.981 -5.950 1.00 0.00 H new ATOM 0 HA3 GLY A 22 118.346 7.840 -5.791 1.00 0.00 H new ATOM 295 N GLY A 23 117.387 5.692 -3.855 1.00 0.00 N ATOM 296 CA GLY A 23 117.486 5.009 -2.569 1.00 0.00 C ATOM 297 C GLY A 23 117.916 3.554 -2.716 1.00 0.00 C ATOM 298 O GLY A 23 117.914 2.997 -3.813 1.00 0.00 O ATOM 0 H GLY A 23 117.136 5.094 -4.642 1.00 0.00 H new ATOM 0 HA2 GLY A 23 118.201 5.534 -1.936 1.00 0.00 H new ATOM 0 HA3 GLY A 23 116.521 5.051 -2.063 1.00 0.00 H new ATOM 302 N PHE A 24 118.261 2.947 -1.583 1.00 0.00 N ATOM 303 CA PHE A 24 118.705 1.556 -1.556 1.00 0.00 C ATOM 304 C PHE A 24 117.834 0.757 -0.592 1.00 0.00 C ATOM 305 O PHE A 24 117.239 1.330 0.321 1.00 0.00 O ATOM 306 CB PHE A 24 120.166 1.481 -1.111 1.00 0.00 C ATOM 307 CG PHE A 24 121.116 2.193 -2.045 1.00 0.00 C ATOM 308 CD1 PHE A 24 121.612 1.535 -3.177 1.00 0.00 C ATOM 309 CD2 PHE A 24 121.499 3.513 -1.780 1.00 0.00 C ATOM 310 CE1 PHE A 24 122.492 2.196 -4.042 1.00 0.00 C ATOM 311 CE2 PHE A 24 122.379 4.174 -2.646 1.00 0.00 C ATOM 312 CZ PHE A 24 122.875 3.515 -3.776 1.00 0.00 C ATOM 0 H PHE A 24 118.241 3.399 -0.669 1.00 0.00 H new ATOM 0 HA PHE A 24 118.616 1.136 -2.558 1.00 0.00 H new ATOM 0 HB2 PHE A 24 120.257 1.913 -0.114 1.00 0.00 H new ATOM 0 HB3 PHE A 24 120.461 0.435 -1.033 1.00 0.00 H new ATOM 0 HD1 PHE A 24 121.316 0.517 -3.383 1.00 0.00 H new ATOM 0 HD2 PHE A 24 121.116 4.022 -0.908 1.00 0.00 H new ATOM 0 HE1 PHE A 24 122.875 1.688 -4.915 1.00 0.00 H new ATOM 0 HE2 PHE A 24 122.675 5.192 -2.442 1.00 0.00 H new ATOM 0 HZ PHE A 24 123.554 4.025 -4.443 1.00 0.00 H new ATOM 322 N ASN A 25 117.752 -0.557 -0.800 1.00 0.00 N ATOM 323 CA ASN A 25 116.914 -1.395 0.055 1.00 0.00 C ATOM 324 C ASN A 25 117.541 -2.765 0.293 1.00 0.00 C ATOM 325 O ASN A 25 118.280 -3.273 -0.550 1.00 0.00 O ATOM 326 CB ASN A 25 115.531 -1.562 -0.579 1.00 0.00 C ATOM 327 CG ASN A 25 115.650 -2.223 -1.950 1.00 0.00 C ATOM 328 OD1 ASN A 25 116.292 -3.263 -2.089 1.00 0.00 O ATOM 329 ND2 ASN A 25 115.065 -1.674 -2.979 1.00 0.00 N ATOM 0 H ASN A 25 118.246 -1.057 -1.539 1.00 0.00 H new ATOM 0 HA ASN A 25 116.821 -0.898 1.021 1.00 0.00 H new ATOM 0 HB2 ASN A 25 114.897 -2.167 0.070 1.00 0.00 H new ATOM 0 HB3 ASN A 25 115.049 -0.589 -0.678 1.00 0.00 H new ATOM 0 HD21 ASN A 25 115.140 -2.107 -3.899 1.00 0.00 H new ATOM 0 HD22 ASN A 25 114.533 -0.812 -2.863 1.00 0.00 H new ATOM 336 N LEU A 26 117.246 -3.342 1.458 1.00 0.00 N ATOM 337 CA LEU A 26 117.705 -4.688 1.796 1.00 0.00 C ATOM 338 C LEU A 26 116.498 -5.554 2.143 1.00 0.00 C ATOM 339 O LEU A 26 115.533 -5.054 2.718 1.00 0.00 O ATOM 340 CB LEU A 26 118.657 -4.642 2.997 1.00 0.00 C ATOM 341 CG LEU A 26 119.817 -3.678 2.726 1.00 0.00 C ATOM 342 CD1 LEU A 26 120.706 -3.591 3.967 1.00 0.00 C ATOM 343 CD2 LEU A 26 120.650 -4.188 1.548 1.00 0.00 C ATOM 0 H LEU A 26 116.689 -2.895 2.186 1.00 0.00 H new ATOM 0 HA LEU A 26 118.236 -5.108 0.942 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.114 -4.325 3.887 1.00 0.00 H new ATOM 0 HB3 LEU A 26 119.046 -5.640 3.199 1.00 0.00 H new ATOM 0 HG LEU A 26 119.416 -2.693 2.488 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.532 -2.906 3.776 1.00 0.00 H new ATOM 0 HD12 LEU A 26 120.119 -3.226 4.810 1.00 0.00 H new ATOM 0 HD13 LEU A 26 121.102 -4.579 4.201 1.00 0.00 H new ATOM 0 HD21 LEU A 26 121.473 -3.499 1.359 1.00 0.00 H new ATOM 0 HD22 LEU A 26 121.049 -5.174 1.785 1.00 0.00 H new ATOM 0 HD23 LEU A 26 120.022 -4.254 0.660 1.00 0.00 H new ATOM 355 N LYS A 27 116.542 -6.847 1.814 1.00 0.00 N ATOM 356 CA LYS A 27 115.396 -7.726 2.064 1.00 0.00 C ATOM 357 C LYS A 27 115.813 -8.968 2.849 1.00 0.00 C ATOM 358 O LYS A 27 116.835 -9.589 2.559 1.00 0.00 O ATOM 359 CB LYS A 27 114.768 -8.151 0.735 1.00 0.00 C ATOM 360 CG LYS A 27 113.470 -8.921 0.992 1.00 0.00 C ATOM 361 CD LYS A 27 112.811 -9.254 -0.348 1.00 0.00 C ATOM 362 CE LYS A 27 113.677 -10.261 -1.108 1.00 0.00 C ATOM 363 NZ LYS A 27 112.853 -10.936 -2.151 1.00 0.00 N ATOM 0 H LYS A 27 117.345 -7.304 1.381 1.00 0.00 H new ATOM 0 HA LYS A 27 114.669 -7.171 2.657 1.00 0.00 H new ATOM 0 HB2 LYS A 27 114.564 -7.273 0.122 1.00 0.00 H new ATOM 0 HB3 LYS A 27 115.466 -8.775 0.176 1.00 0.00 H new ATOM 0 HG2 LYS A 27 113.679 -9.836 1.546 1.00 0.00 H new ATOM 0 HG3 LYS A 27 112.794 -8.325 1.605 1.00 0.00 H new ATOM 0 HD2 LYS A 27 111.816 -9.666 -0.183 1.00 0.00 H new ATOM 0 HD3 LYS A 27 112.686 -8.347 -0.939 1.00 0.00 H new ATOM 0 HE2 LYS A 27 114.524 -9.753 -1.570 1.00 0.00 H new ATOM 0 HE3 LYS A 27 114.086 -10.999 -0.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 112.669 -11.919 -1.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 111.950 -10.432 -2.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 113.365 -10.928 -3.056 1.00 0.00 H new ATOM 377 N TYR A 28 115.005 -9.318 3.848 1.00 0.00 N ATOM 378 CA TYR A 28 115.254 -10.504 4.667 1.00 0.00 C ATOM 379 C TYR A 28 114.064 -11.458 4.604 1.00 0.00 C ATOM 380 O TYR A 28 112.914 -11.017 4.625 1.00 0.00 O ATOM 381 CB TYR A 28 115.502 -10.091 6.119 1.00 0.00 C ATOM 382 CG TYR A 28 116.696 -9.183 6.289 1.00 0.00 C ATOM 383 CD1 TYR A 28 117.964 -9.728 6.520 1.00 0.00 C ATOM 384 CD2 TYR A 28 116.533 -7.793 6.217 1.00 0.00 C ATOM 385 CE1 TYR A 28 119.071 -8.886 6.678 1.00 0.00 C ATOM 386 CE2 TYR A 28 117.640 -6.951 6.374 1.00 0.00 C ATOM 387 CZ TYR A 28 118.909 -7.497 6.605 1.00 0.00 C ATOM 388 OH TYR A 28 120.000 -6.666 6.760 1.00 0.00 O ATOM 0 H TYR A 28 114.169 -8.795 4.111 1.00 0.00 H new ATOM 0 HA TYR A 28 116.135 -11.014 4.278 1.00 0.00 H new ATOM 0 HB2 TYR A 28 114.615 -9.587 6.502 1.00 0.00 H new ATOM 0 HB3 TYR A 28 115.647 -10.986 6.724 1.00 0.00 H new ATOM 0 HD1 TYR A 28 118.089 -10.799 6.576 1.00 0.00 H new ATOM 0 HD2 TYR A 28 115.554 -7.372 6.041 1.00 0.00 H new ATOM 0 HE1 TYR A 28 120.049 -9.307 6.856 1.00 0.00 H new ATOM 0 HE2 TYR A 28 117.516 -5.880 6.317 1.00 0.00 H new ATOM 0 HH TYR A 28 119.714 -5.732 6.680 1.00 0.00 H new ATOM 398 N ARG A 29 114.350 -12.760 4.518 1.00 0.00 N ATOM 399 CA ARG A 29 113.302 -13.776 4.402 1.00 0.00 C ATOM 400 C ARG A 29 113.336 -14.748 5.578 1.00 0.00 C ATOM 401 O ARG A 29 114.406 -15.147 6.036 1.00 0.00 O ATOM 402 CB ARG A 29 113.480 -14.567 3.104 1.00 0.00 C ATOM 403 CG ARG A 29 113.318 -13.633 1.905 1.00 0.00 C ATOM 404 CD ARG A 29 113.467 -14.432 0.610 1.00 0.00 C ATOM 405 NE ARG A 29 112.323 -15.331 0.436 1.00 0.00 N ATOM 406 CZ ARG A 29 112.354 -16.427 -0.339 1.00 0.00 C ATOM 407 NH1 ARG A 29 113.425 -16.780 -1.010 1.00 0.00 N ATOM 408 NH2 ARG A 29 111.283 -17.167 -0.427 1.00 0.00 N ATOM 0 H ARG A 29 115.299 -13.135 4.527 1.00 0.00 H new ATOM 0 HA ARG A 29 112.342 -13.259 4.400 1.00 0.00 H new ATOM 0 HB2 ARG A 29 114.465 -15.034 3.083 1.00 0.00 H new ATOM 0 HB3 ARG A 29 112.745 -15.371 3.053 1.00 0.00 H new ATOM 0 HG2 ARG A 29 112.341 -13.150 1.936 1.00 0.00 H new ATOM 0 HG3 ARG A 29 114.066 -12.841 1.944 1.00 0.00 H new ATOM 0 HD2 ARG A 29 113.537 -13.752 -0.239 1.00 0.00 H new ATOM 0 HD3 ARG A 29 114.392 -15.009 0.634 1.00 0.00 H new ATOM 0 HE ARG A 29 111.458 -15.113 0.930 1.00 0.00 H new ATOM 0 HH11 ARG A 29 114.272 -16.215 -0.953 1.00 0.00 H new ATOM 0 HH12 ARG A 29 113.411 -17.620 -1.589 1.00 0.00 H new ATOM 0 HH21 ARG A 29 110.441 -16.909 0.088 1.00 0.00 H new ATOM 0 HH22 ARG A 29 111.288 -18.003 -1.011 1.00 0.00 H new ATOM 422 N TYR A 30 112.154 -15.126 6.063 1.00 0.00 N ATOM 423 CA TYR A 30 112.045 -16.088 7.160 1.00 0.00 C ATOM 424 C TYR A 30 111.119 -17.237 6.763 1.00 0.00 C ATOM 425 O TYR A 30 110.068 -17.014 6.163 1.00 0.00 O ATOM 426 CB TYR A 30 111.501 -15.385 8.405 1.00 0.00 C ATOM 427 CG TYR A 30 111.502 -16.252 9.642 1.00 0.00 C ATOM 428 CD1 TYR A 30 112.692 -16.463 10.348 1.00 0.00 C ATOM 429 CD2 TYR A 30 110.311 -16.837 10.087 1.00 0.00 C ATOM 430 CE1 TYR A 30 112.692 -17.261 11.498 1.00 0.00 C ATOM 431 CE2 TYR A 30 110.310 -17.634 11.238 1.00 0.00 C ATOM 432 CZ TYR A 30 111.502 -17.846 11.943 1.00 0.00 C ATOM 433 OH TYR A 30 111.501 -18.633 13.078 1.00 0.00 O ATOM 0 H TYR A 30 111.259 -14.782 5.715 1.00 0.00 H new ATOM 0 HA TYR A 30 113.033 -16.495 7.378 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.097 -14.493 8.597 1.00 0.00 H new ATOM 0 HB3 TYR A 30 110.482 -15.051 8.207 1.00 0.00 H new ATOM 0 HD1 TYR A 30 113.611 -16.010 10.005 1.00 0.00 H new ATOM 0 HD2 TYR A 30 109.393 -16.674 9.543 1.00 0.00 H new ATOM 0 HE1 TYR A 30 113.611 -17.425 12.042 1.00 0.00 H new ATOM 0 HE2 TYR A 30 109.391 -18.085 11.582 1.00 0.00 H new ATOM 0 HH TYR A 30 110.593 -18.960 13.248 1.00 0.00 H new ATOM 443 N GLU A 31 111.512 -18.466 7.092 1.00 0.00 N ATOM 444 CA GLU A 31 110.741 -19.643 6.689 1.00 0.00 C ATOM 445 C GLU A 31 110.496 -20.587 7.865 1.00 0.00 C ATOM 446 O GLU A 31 111.320 -20.692 8.773 1.00 0.00 O ATOM 447 CB GLU A 31 111.488 -20.395 5.585 1.00 0.00 C ATOM 448 CG GLU A 31 111.654 -19.481 4.365 1.00 0.00 C ATOM 449 CD GLU A 31 110.298 -19.073 3.783 1.00 0.00 C ATOM 450 OE1 GLU A 31 109.306 -19.723 4.077 1.00 0.00 O ATOM 451 OE2 GLU A 31 110.273 -18.104 3.042 1.00 0.00 O ATOM 0 H GLU A 31 112.352 -18.673 7.632 1.00 0.00 H new ATOM 0 HA GLU A 31 109.774 -19.298 6.323 1.00 0.00 H new ATOM 0 HB2 GLU A 31 112.464 -20.717 5.947 1.00 0.00 H new ATOM 0 HB3 GLU A 31 110.938 -21.294 5.307 1.00 0.00 H new ATOM 0 HG2 GLU A 31 112.212 -18.589 4.650 1.00 0.00 H new ATOM 0 HG3 GLU A 31 112.240 -19.993 3.602 1.00 0.00 H new ATOM 458 N GLU A 32 109.354 -21.272 7.835 1.00 0.00 N ATOM 459 CA GLU A 32 109.027 -22.256 8.863 1.00 0.00 C ATOM 460 C GLU A 32 109.395 -23.661 8.392 1.00 0.00 C ATOM 461 O GLU A 32 109.285 -23.976 7.207 1.00 0.00 O ATOM 462 CB GLU A 32 107.533 -22.199 9.187 1.00 0.00 C ATOM 463 CG GLU A 32 107.190 -20.840 9.801 1.00 0.00 C ATOM 464 CD GLU A 32 107.924 -20.665 11.127 1.00 0.00 C ATOM 465 OE1 GLU A 32 107.368 -21.046 12.144 1.00 0.00 O ATOM 466 OE2 GLU A 32 109.031 -20.153 11.106 1.00 0.00 O ATOM 0 H GLU A 32 108.642 -21.164 7.112 1.00 0.00 H new ATOM 0 HA GLU A 32 109.600 -22.022 9.760 1.00 0.00 H new ATOM 0 HB2 GLU A 32 106.948 -22.358 8.281 1.00 0.00 H new ATOM 0 HB3 GLU A 32 107.270 -22.999 9.880 1.00 0.00 H new ATOM 0 HG2 GLU A 32 107.468 -20.041 9.114 1.00 0.00 H new ATOM 0 HG3 GLU A 32 106.114 -20.764 9.959 1.00 0.00 H new ATOM 473 N ASP A 33 109.834 -24.499 9.326 1.00 0.00 N ATOM 474 CA ASP A 33 110.338 -25.823 8.976 1.00 0.00 C ATOM 475 C ASP A 33 109.235 -26.770 8.503 1.00 0.00 C ATOM 476 O ASP A 33 109.406 -27.467 7.503 1.00 0.00 O ATOM 477 CB ASP A 33 111.044 -26.439 10.186 1.00 0.00 C ATOM 478 CG ASP A 33 112.261 -25.603 10.579 1.00 0.00 C ATOM 479 OD1 ASP A 33 112.864 -25.008 9.699 1.00 0.00 O ATOM 480 OD2 ASP A 33 112.573 -25.570 11.757 1.00 0.00 O ATOM 0 H ASP A 33 109.851 -24.287 10.324 1.00 0.00 H new ATOM 0 HA ASP A 33 111.034 -25.691 8.147 1.00 0.00 H new ATOM 0 HB2 ASP A 33 110.352 -26.501 11.026 1.00 0.00 H new ATOM 0 HB3 ASP A 33 111.355 -27.457 9.953 1.00 0.00 H new ATOM 485 N ASN A 34 108.106 -26.801 9.211 1.00 0.00 N ATOM 486 CA ASN A 34 107.050 -27.773 8.899 1.00 0.00 C ATOM 487 C ASN A 34 105.851 -27.163 8.163 1.00 0.00 C ATOM 488 O ASN A 34 105.019 -27.898 7.631 1.00 0.00 O ATOM 489 CB ASN A 34 106.571 -28.429 10.198 1.00 0.00 C ATOM 490 CG ASN A 34 105.889 -27.408 11.107 1.00 0.00 C ATOM 491 OD1 ASN A 34 106.062 -26.202 10.933 1.00 0.00 O ATOM 492 ND2 ASN A 34 105.119 -27.824 12.075 1.00 0.00 N ATOM 0 H ASN A 34 107.898 -26.178 9.991 1.00 0.00 H new ATOM 0 HA ASN A 34 107.487 -28.508 8.223 1.00 0.00 H new ATOM 0 HB2 ASN A 34 105.877 -29.237 9.967 1.00 0.00 H new ATOM 0 HB3 ASN A 34 107.418 -28.876 10.718 1.00 0.00 H new ATOM 0 HD21 ASN A 34 104.660 -27.150 12.688 1.00 0.00 H new ATOM 0 HD22 ASN A 34 104.976 -28.824 12.219 1.00 0.00 H new ATOM 499 N SER A 35 105.753 -25.836 8.127 1.00 0.00 N ATOM 500 CA SER A 35 104.668 -25.176 7.407 1.00 0.00 C ATOM 501 C SER A 35 105.165 -23.849 6.830 1.00 0.00 C ATOM 502 O SER A 35 104.886 -22.787 7.396 1.00 0.00 O ATOM 503 CB SER A 35 103.482 -24.945 8.347 1.00 0.00 C ATOM 504 OG SER A 35 103.965 -24.523 9.615 1.00 0.00 O ATOM 0 H SER A 35 106.407 -25.201 8.585 1.00 0.00 H new ATOM 0 HA SER A 35 104.338 -25.813 6.586 1.00 0.00 H new ATOM 0 HB2 SER A 35 102.814 -24.192 7.930 1.00 0.00 H new ATOM 0 HB3 SER A 35 102.902 -25.862 8.452 1.00 0.00 H new ATOM 0 HG SER A 35 104.531 -25.224 9.999 1.00 0.00 H new ATOM 510 N PRO A 36 105.875 -23.870 5.721 1.00 0.00 N ATOM 511 CA PRO A 36 106.573 -22.641 5.239 1.00 0.00 C ATOM 512 C PRO A 36 105.610 -21.550 4.777 1.00 0.00 C ATOM 513 O PRO A 36 104.648 -21.802 4.051 1.00 0.00 O ATOM 514 CB PRO A 36 107.439 -23.133 4.076 1.00 0.00 C ATOM 515 CG PRO A 36 106.775 -24.374 3.585 1.00 0.00 C ATOM 516 CD PRO A 36 106.086 -25.002 4.797 1.00 0.00 C ATOM 0 HA PRO A 36 107.149 -22.176 6.039 1.00 0.00 H new ATOM 0 HB2 PRO A 36 107.501 -22.383 3.288 1.00 0.00 H new ATOM 0 HB3 PRO A 36 108.458 -23.336 4.404 1.00 0.00 H new ATOM 0 HG2 PRO A 36 106.052 -24.144 2.803 1.00 0.00 H new ATOM 0 HG3 PRO A 36 107.504 -25.060 3.154 1.00 0.00 H new ATOM 0 HD2 PRO A 36 105.142 -25.471 4.520 1.00 0.00 H new ATOM 0 HD3 PRO A 36 106.705 -25.776 5.250 1.00 0.00 H new ATOM 524 N LEU A 37 105.902 -20.335 5.222 1.00 0.00 N ATOM 525 CA LEU A 37 105.214 -19.135 4.764 1.00 0.00 C ATOM 526 C LEU A 37 106.265 -18.146 4.279 1.00 0.00 C ATOM 527 O LEU A 37 107.274 -17.964 4.967 1.00 0.00 O ATOM 528 CB LEU A 37 104.400 -18.517 5.904 1.00 0.00 C ATOM 529 CG LEU A 37 103.595 -17.330 5.374 1.00 0.00 C ATOM 530 CD1 LEU A 37 102.434 -17.841 4.520 1.00 0.00 C ATOM 531 CD2 LEU A 37 103.045 -16.523 6.551 1.00 0.00 C ATOM 0 H LEU A 37 106.628 -20.153 5.915 1.00 0.00 H new ATOM 0 HA LEU A 37 104.526 -19.386 3.957 1.00 0.00 H new ATOM 0 HB2 LEU A 37 103.729 -19.263 6.331 1.00 0.00 H new ATOM 0 HB3 LEU A 37 105.065 -18.191 6.704 1.00 0.00 H new ATOM 0 HG LEU A 37 104.240 -16.695 4.767 1.00 0.00 H new ATOM 0 HD11 LEU A 37 101.860 -16.995 4.142 1.00 0.00 H new ATOM 0 HD12 LEU A 37 102.825 -18.417 3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 37 101.788 -18.476 5.127 1.00 0.00 H new ATOM 0 HD21 LEU A 37 102.471 -15.676 6.175 1.00 0.00 H new ATOM 0 HD22 LEU A 37 102.400 -17.158 7.158 1.00 0.00 H new ATOM 0 HD23 LEU A 37 103.872 -16.159 7.160 1.00 0.00 H new ATOM 543 N GLY A 38 106.051 -17.507 3.127 1.00 0.00 N ATOM 544 CA GLY A 38 107.090 -16.648 2.576 1.00 0.00 C ATOM 545 C GLY A 38 106.863 -15.226 3.054 1.00 0.00 C ATOM 546 O GLY A 38 105.844 -14.616 2.750 1.00 0.00 O ATOM 0 H GLY A 38 105.195 -17.566 2.575 1.00 0.00 H new ATOM 0 HA2 GLY A 38 108.073 -16.998 2.890 1.00 0.00 H new ATOM 0 HA3 GLY A 38 107.071 -16.686 1.487 1.00 0.00 H new ATOM 550 N VAL A 39 107.815 -14.702 3.818 1.00 0.00 N ATOM 551 CA VAL A 39 107.684 -13.358 4.364 1.00 0.00 C ATOM 552 C VAL A 39 108.931 -12.550 4.054 1.00 0.00 C ATOM 553 O VAL A 39 110.053 -13.001 4.279 1.00 0.00 O ATOM 554 CB VAL A 39 107.470 -13.419 5.880 1.00 0.00 C ATOM 555 CG1 VAL A 39 106.162 -14.155 6.179 1.00 0.00 C ATOM 556 CG2 VAL A 39 108.632 -14.167 6.538 1.00 0.00 C ATOM 0 H VAL A 39 108.678 -15.183 4.071 1.00 0.00 H new ATOM 0 HA VAL A 39 106.820 -12.877 3.905 1.00 0.00 H new ATOM 0 HB VAL A 39 107.422 -12.405 6.277 1.00 0.00 H new ATOM 0 HG11 VAL A 39 106.008 -14.200 7.257 1.00 0.00 H new ATOM 0 HG12 VAL A 39 105.331 -13.623 5.715 1.00 0.00 H new ATOM 0 HG13 VAL A 39 106.214 -15.167 5.778 1.00 0.00 H new ATOM 0 HG21 VAL A 39 108.475 -14.207 7.616 1.00 0.00 H new ATOM 0 HG22 VAL A 39 108.684 -15.181 6.141 1.00 0.00 H new ATOM 0 HG23 VAL A 39 109.566 -13.646 6.327 1.00 0.00 H new ATOM 566 N ILE A 40 108.719 -11.349 3.535 1.00 0.00 N ATOM 567 CA ILE A 40 109.822 -10.441 3.247 1.00 0.00 C ATOM 568 C ILE A 40 109.609 -9.118 3.965 1.00 0.00 C ATOM 569 O ILE A 40 108.490 -8.610 4.040 1.00 0.00 O ATOM 570 CB ILE A 40 109.945 -10.196 1.738 1.00 0.00 C ATOM 571 CG1 ILE A 40 108.607 -9.707 1.166 1.00 0.00 C ATOM 572 CG2 ILE A 40 110.375 -11.491 1.033 1.00 0.00 C ATOM 573 CD1 ILE A 40 108.823 -9.184 -0.255 1.00 0.00 C ATOM 0 H ILE A 40 107.796 -10.981 3.305 1.00 0.00 H new ATOM 0 HA ILE A 40 110.745 -10.901 3.602 1.00 0.00 H new ATOM 0 HB ILE A 40 110.699 -9.428 1.567 1.00 0.00 H new ATOM 0 HG12 ILE A 40 107.882 -10.521 1.159 1.00 0.00 H new ATOM 0 HG13 ILE A 40 108.195 -8.919 1.797 1.00 0.00 H new ATOM 0 HG21 ILE A 40 110.461 -11.311 -0.039 1.00 0.00 H new ATOM 0 HG22 ILE A 40 111.339 -11.816 1.425 1.00 0.00 H new ATOM 0 HG23 ILE A 40 109.631 -12.267 1.212 1.00 0.00 H new ATOM 0 HD11 ILE A 40 107.874 -8.836 -0.663 1.00 0.00 H new ATOM 0 HD12 ILE A 40 109.534 -8.358 -0.235 1.00 0.00 H new ATOM 0 HD13 ILE A 40 109.216 -9.985 -0.882 1.00 0.00 H new ATOM 585 N GLY A 41 110.690 -8.610 4.543 1.00 0.00 N ATOM 586 CA GLY A 41 110.694 -7.273 5.121 1.00 0.00 C ATOM 587 C GLY A 41 111.772 -6.443 4.440 1.00 0.00 C ATOM 588 O GLY A 41 112.909 -6.896 4.302 1.00 0.00 O ATOM 0 H GLY A 41 111.578 -9.106 4.624 1.00 0.00 H new ATOM 0 HA2 GLY A 41 109.719 -6.804 4.991 1.00 0.00 H new ATOM 0 HA3 GLY A 41 110.881 -7.327 6.193 1.00 0.00 H new ATOM 592 N SER A 42 111.404 -5.248 3.985 1.00 0.00 N ATOM 593 CA SER A 42 112.340 -4.390 3.265 1.00 0.00 C ATOM 594 C SER A 42 112.383 -2.993 3.872 1.00 0.00 C ATOM 595 O SER A 42 111.348 -2.420 4.210 1.00 0.00 O ATOM 596 CB SER A 42 111.930 -4.292 1.795 1.00 0.00 C ATOM 597 OG SER A 42 112.925 -3.571 1.080 1.00 0.00 O ATOM 0 H SER A 42 110.470 -4.854 4.101 1.00 0.00 H new ATOM 0 HA SER A 42 113.333 -4.833 3.343 1.00 0.00 H new ATOM 0 HB2 SER A 42 111.811 -5.289 1.371 1.00 0.00 H new ATOM 0 HB3 SER A 42 110.966 -3.791 1.706 1.00 0.00 H new ATOM 0 HG SER A 42 112.668 -3.507 0.137 1.00 0.00 H new ATOM 603 N PHE A 43 113.590 -2.453 4.007 1.00 0.00 N ATOM 604 CA PHE A 43 113.764 -1.085 4.484 1.00 0.00 C ATOM 605 C PHE A 43 114.403 -0.251 3.382 1.00 0.00 C ATOM 606 O PHE A 43 115.457 -0.615 2.862 1.00 0.00 O ATOM 607 CB PHE A 43 114.655 -1.074 5.726 1.00 0.00 C ATOM 608 CG PHE A 43 114.099 -1.892 6.868 1.00 0.00 C ATOM 609 CD1 PHE A 43 113.083 -1.369 7.676 1.00 0.00 C ATOM 610 CD2 PHE A 43 114.602 -3.174 7.119 1.00 0.00 C ATOM 611 CE1 PHE A 43 112.570 -2.128 8.735 1.00 0.00 C ATOM 612 CE2 PHE A 43 114.088 -3.933 8.177 1.00 0.00 C ATOM 613 CZ PHE A 43 113.072 -3.410 8.985 1.00 0.00 C ATOM 0 H PHE A 43 114.460 -2.940 3.793 1.00 0.00 H new ATOM 0 HA PHE A 43 112.793 -0.664 4.746 1.00 0.00 H new ATOM 0 HB2 PHE A 43 115.641 -1.456 5.461 1.00 0.00 H new ATOM 0 HB3 PHE A 43 114.791 -0.045 6.058 1.00 0.00 H new ATOM 0 HD1 PHE A 43 112.695 -0.380 7.483 1.00 0.00 H new ATOM 0 HD2 PHE A 43 115.387 -3.578 6.496 1.00 0.00 H new ATOM 0 HE1 PHE A 43 111.787 -1.724 9.359 1.00 0.00 H new ATOM 0 HE2 PHE A 43 114.476 -4.922 8.370 1.00 0.00 H new ATOM 0 HZ PHE A 43 112.676 -3.996 9.801 1.00 0.00 H new ATOM 623 N THR A 44 113.776 0.866 3.028 1.00 0.00 N ATOM 624 CA THR A 44 114.269 1.689 1.925 1.00 0.00 C ATOM 625 C THR A 44 114.583 3.097 2.409 1.00 0.00 C ATOM 626 O THR A 44 113.805 3.691 3.154 1.00 0.00 O ATOM 627 CB THR A 44 113.214 1.754 0.818 1.00 0.00 C ATOM 628 OG1 THR A 44 112.840 0.434 0.447 1.00 0.00 O ATOM 629 CG2 THR A 44 113.789 2.483 -0.398 1.00 0.00 C ATOM 0 H THR A 44 112.934 1.221 3.482 1.00 0.00 H new ATOM 0 HA THR A 44 115.182 1.238 1.536 1.00 0.00 H new ATOM 0 HB THR A 44 112.339 2.294 1.181 1.00 0.00 H new ATOM 0 HG1 THR A 44 112.163 0.472 -0.261 1.00 0.00 H new ATOM 0 HG21 THR A 44 113.036 2.528 -1.185 1.00 0.00 H new ATOM 0 HG22 THR A 44 114.077 3.495 -0.113 1.00 0.00 H new ATOM 0 HG23 THR A 44 114.664 1.946 -0.764 1.00 0.00 H new ATOM 637 N TYR A 45 115.728 3.617 1.978 1.00 0.00 N ATOM 638 CA TYR A 45 116.118 4.983 2.311 1.00 0.00 C ATOM 639 C TYR A 45 116.449 5.738 1.031 1.00 0.00 C ATOM 640 O TYR A 45 117.269 5.276 0.237 1.00 0.00 O ATOM 641 CB TYR A 45 117.338 4.970 3.233 1.00 0.00 C ATOM 642 CG TYR A 45 117.763 6.346 3.688 1.00 0.00 C ATOM 643 CD1 TYR A 45 117.156 6.933 4.805 1.00 0.00 C ATOM 644 CD2 TYR A 45 118.764 7.035 2.993 1.00 0.00 C ATOM 645 CE1 TYR A 45 117.550 8.208 5.226 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.159 8.310 3.415 1.00 0.00 C ATOM 647 CZ TYR A 45 118.551 8.897 4.531 1.00 0.00 C ATOM 648 OH TYR A 45 118.940 10.154 4.947 1.00 0.00 O ATOM 0 H TYR A 45 116.401 3.115 1.399 1.00 0.00 H new ATOM 0 HA TYR A 45 115.294 5.478 2.825 1.00 0.00 H new ATOM 0 HB2 TYR A 45 117.116 4.359 4.108 1.00 0.00 H new ATOM 0 HB3 TYR A 45 118.170 4.494 2.715 1.00 0.00 H new ATOM 0 HD1 TYR A 45 116.384 6.402 5.342 1.00 0.00 H new ATOM 0 HD2 TYR A 45 119.232 6.583 2.131 1.00 0.00 H new ATOM 0 HE1 TYR A 45 117.082 8.661 6.087 1.00 0.00 H new ATOM 0 HE2 TYR A 45 119.933 8.841 2.880 1.00 0.00 H new ATOM 0 HH TYR A 45 119.645 10.491 4.356 1.00 0.00 H new ATOM 658 N THR A 46 115.801 6.883 0.831 1.00 0.00 N ATOM 659 CA THR A 46 116.009 7.673 -0.381 1.00 0.00 C ATOM 660 C THR A 46 116.405 9.100 -0.018 1.00 0.00 C ATOM 661 O THR A 46 115.967 9.635 1.003 1.00 0.00 O ATOM 662 CB THR A 46 114.732 7.709 -1.228 1.00 0.00 C ATOM 663 OG1 THR A 46 113.702 8.358 -0.498 1.00 0.00 O ATOM 664 CG2 THR A 46 114.280 6.293 -1.597 1.00 0.00 C ATOM 0 H THR A 46 115.131 7.283 1.488 1.00 0.00 H new ATOM 0 HA THR A 46 116.808 7.205 -0.956 1.00 0.00 H new ATOM 0 HB THR A 46 114.941 8.256 -2.148 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.885 8.384 -1.038 1.00 0.00 H new ATOM 0 HG21 THR A 46 113.372 6.346 -2.198 1.00 0.00 H new ATOM 0 HG22 THR A 46 115.065 5.798 -2.168 1.00 0.00 H new ATOM 0 HG23 THR A 46 114.081 5.726 -0.688 1.00 0.00 H new ATOM 672 N GLU A 47 117.208 9.711 -0.881 1.00 0.00 N ATOM 673 CA GLU A 47 117.691 11.066 -0.647 1.00 0.00 C ATOM 674 C GLU A 47 117.682 11.854 -1.953 1.00 0.00 C ATOM 675 O GLU A 47 117.766 11.272 -3.036 1.00 0.00 O ATOM 676 CB GLU A 47 119.111 11.004 -0.074 1.00 0.00 C ATOM 677 CG GLU A 47 119.558 12.394 0.398 1.00 0.00 C ATOM 678 CD GLU A 47 121.001 12.386 0.914 1.00 0.00 C ATOM 679 OE1 GLU A 47 121.646 11.348 0.878 1.00 0.00 O ATOM 680 OE2 GLU A 47 121.447 13.438 1.345 1.00 0.00 O ATOM 0 H GLU A 47 117.538 9.289 -1.749 1.00 0.00 H new ATOM 0 HA GLU A 47 117.038 11.569 0.066 1.00 0.00 H new ATOM 0 HB2 GLU A 47 119.144 10.302 0.759 1.00 0.00 H new ATOM 0 HB3 GLU A 47 119.800 10.631 -0.832 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.471 13.102 -0.426 1.00 0.00 H new ATOM 0 HG3 GLU A 47 118.892 12.741 1.188 1.00 0.00 H new ATOM 880 N GLN A 61 114.624 13.813 3.643 1.00 0.00 N ATOM 881 CA GLN A 61 114.928 12.382 3.677 1.00 0.00 C ATOM 882 C GLN A 61 113.640 11.579 3.812 1.00 0.00 C ATOM 883 O GLN A 61 112.714 12.007 4.498 1.00 0.00 O ATOM 884 CB GLN A 61 115.849 12.075 4.859 1.00 0.00 C ATOM 885 CG GLN A 61 117.187 12.793 4.663 1.00 0.00 C ATOM 886 CD GLN A 61 118.095 12.576 5.873 1.00 0.00 C ATOM 887 OE1 GLN A 61 117.629 12.202 6.950 1.00 0.00 O ATOM 888 NE2 GLN A 61 119.377 12.791 5.757 1.00 0.00 N ATOM 0 HA GLN A 61 115.427 12.105 2.749 1.00 0.00 H new ATOM 0 HB2 GLN A 61 115.384 12.398 5.790 1.00 0.00 H new ATOM 0 HB3 GLN A 61 116.009 11.000 4.939 1.00 0.00 H new ATOM 0 HG2 GLN A 61 117.677 12.422 3.763 1.00 0.00 H new ATOM 0 HG3 GLN A 61 117.016 13.859 4.516 1.00 0.00 H new ATOM 0 HE21 GLN A 61 119.764 13.101 4.865 1.00 0.00 H new ATOM 0 HE22 GLN A 61 119.992 12.649 6.558 1.00 0.00 H new ATOM 897 N TYR A 62 113.582 10.419 3.161 1.00 0.00 N ATOM 898 CA TYR A 62 112.393 9.571 3.232 1.00 0.00 C ATOM 899 C TYR A 62 112.771 8.139 3.595 1.00 0.00 C ATOM 900 O TYR A 62 113.759 7.606 3.093 1.00 0.00 O ATOM 901 CB TYR A 62 111.668 9.580 1.886 1.00 0.00 C ATOM 902 CG TYR A 62 111.248 10.959 1.434 1.00 0.00 C ATOM 903 CD1 TYR A 62 112.118 11.733 0.655 1.00 0.00 C ATOM 904 CD2 TYR A 62 109.994 11.465 1.792 1.00 0.00 C ATOM 905 CE1 TYR A 62 111.732 13.010 0.234 1.00 0.00 C ATOM 906 CE2 TYR A 62 109.607 12.743 1.371 1.00 0.00 C ATOM 907 CZ TYR A 62 110.477 13.515 0.591 1.00 0.00 C ATOM 908 OH TYR A 62 110.095 14.775 0.176 1.00 0.00 O ATOM 0 H TYR A 62 114.336 10.047 2.584 1.00 0.00 H new ATOM 0 HA TYR A 62 111.735 9.967 4.006 1.00 0.00 H new ATOM 0 HB2 TYR A 62 112.319 9.141 1.129 1.00 0.00 H new ATOM 0 HB3 TYR A 62 110.785 8.945 1.954 1.00 0.00 H new ATOM 0 HD1 TYR A 62 113.087 11.344 0.379 1.00 0.00 H new ATOM 0 HD2 TYR A 62 109.324 10.869 2.394 1.00 0.00 H new ATOM 0 HE1 TYR A 62 112.403 13.606 -0.367 1.00 0.00 H new ATOM 0 HE2 TYR A 62 108.639 13.133 1.647 1.00 0.00 H new ATOM 0 HH TYR A 62 109.195 14.970 0.510 1.00 0.00 H new ATOM 918 N TYR A 63 111.966 7.521 4.455 1.00 0.00 N ATOM 919 CA TYR A 63 112.209 6.142 4.870 1.00 0.00 C ATOM 920 C TYR A 63 110.904 5.355 4.809 1.00 0.00 C ATOM 921 O TYR A 63 109.854 5.872 5.189 1.00 0.00 O ATOM 922 CB TYR A 63 112.763 6.128 6.296 1.00 0.00 C ATOM 923 CG TYR A 63 113.226 4.766 6.759 1.00 0.00 C ATOM 924 CD1 TYR A 63 112.333 3.902 7.403 1.00 0.00 C ATOM 925 CD2 TYR A 63 114.554 4.374 6.552 1.00 0.00 C ATOM 926 CE1 TYR A 63 112.768 2.646 7.842 1.00 0.00 C ATOM 927 CE2 TYR A 63 114.989 3.117 6.989 1.00 0.00 C ATOM 928 CZ TYR A 63 114.096 2.253 7.634 1.00 0.00 C ATOM 929 OH TYR A 63 114.526 1.017 8.068 1.00 0.00 O ATOM 0 H TYR A 63 111.143 7.951 4.877 1.00 0.00 H new ATOM 0 HA TYR A 63 112.935 5.681 4.201 1.00 0.00 H new ATOM 0 HB2 TYR A 63 113.598 6.825 6.358 1.00 0.00 H new ATOM 0 HB3 TYR A 63 111.994 6.491 6.978 1.00 0.00 H new ATOM 0 HD1 TYR A 63 111.308 4.204 7.561 1.00 0.00 H new ATOM 0 HD2 TYR A 63 115.243 5.041 6.055 1.00 0.00 H new ATOM 0 HE1 TYR A 63 112.080 1.980 8.341 1.00 0.00 H new ATOM 0 HE2 TYR A 63 116.013 2.814 6.829 1.00 0.00 H new ATOM 0 HH TYR A 63 113.756 0.487 8.362 1.00 0.00 H new ATOM 939 N GLY A 64 110.962 4.117 4.324 1.00 0.00 N ATOM 940 CA GLY A 64 109.749 3.322 4.145 1.00 0.00 C ATOM 941 C GLY A 64 109.936 1.894 4.640 1.00 0.00 C ATOM 942 O GLY A 64 110.974 1.279 4.397 1.00 0.00 O ATOM 0 H GLY A 64 111.825 3.647 4.051 1.00 0.00 H new ATOM 0 HA2 GLY A 64 108.924 3.789 4.683 1.00 0.00 H new ATOM 0 HA3 GLY A 64 109.474 3.309 3.090 1.00 0.00 H new ATOM 946 N ILE A 65 108.927 1.379 5.342 1.00 0.00 N ATOM 947 CA ILE A 65 108.963 0.007 5.842 1.00 0.00 C ATOM 948 C ILE A 65 107.848 -0.798 5.179 1.00 0.00 C ATOM 949 O ILE A 65 106.704 -0.346 5.131 1.00 0.00 O ATOM 950 CB ILE A 65 108.798 0.009 7.368 1.00 0.00 C ATOM 951 CG1 ILE A 65 108.855 -1.425 7.904 1.00 0.00 C ATOM 952 CG2 ILE A 65 107.459 0.644 7.751 1.00 0.00 C ATOM 953 CD1 ILE A 65 109.088 -1.397 9.416 1.00 0.00 C ATOM 0 H ILE A 65 108.076 1.891 5.576 1.00 0.00 H new ATOM 0 HA ILE A 65 109.921 -0.452 5.600 1.00 0.00 H new ATOM 0 HB ILE A 65 109.610 0.590 7.806 1.00 0.00 H new ATOM 0 HG12 ILE A 65 107.924 -1.946 7.679 1.00 0.00 H new ATOM 0 HG13 ILE A 65 109.656 -1.977 7.412 1.00 0.00 H new ATOM 0 HG21 ILE A 65 107.352 0.641 8.836 1.00 0.00 H new ATOM 0 HG22 ILE A 65 107.426 1.671 7.386 1.00 0.00 H new ATOM 0 HG23 ILE A 65 106.645 0.074 7.304 1.00 0.00 H new ATOM 0 HD11 ILE A 65 109.128 -2.417 9.797 1.00 0.00 H new ATOM 0 HD12 ILE A 65 110.030 -0.892 9.630 1.00 0.00 H new ATOM 0 HD13 ILE A 65 108.272 -0.861 9.900 1.00 0.00 H new ATOM 965 N THR A 66 108.190 -1.975 4.658 1.00 0.00 N ATOM 966 CA THR A 66 107.215 -2.804 3.951 1.00 0.00 C ATOM 967 C THR A 66 107.253 -4.248 4.443 1.00 0.00 C ATOM 968 O THR A 66 108.242 -4.695 5.025 1.00 0.00 O ATOM 969 CB THR A 66 107.502 -2.784 2.447 1.00 0.00 C ATOM 970 OG1 THR A 66 108.769 -3.377 2.203 1.00 0.00 O ATOM 971 CG2 THR A 66 107.501 -1.345 1.922 1.00 0.00 C ATOM 0 H THR A 66 109.127 -2.374 4.711 1.00 0.00 H new ATOM 0 HA THR A 66 106.226 -2.392 4.149 1.00 0.00 H new ATOM 0 HB THR A 66 106.724 -3.346 1.930 1.00 0.00 H new ATOM 0 HG1 THR A 66 108.886 -3.513 1.240 1.00 0.00 H new ATOM 0 HG21 THR A 66 107.707 -1.348 0.852 1.00 0.00 H new ATOM 0 HG22 THR A 66 106.526 -0.892 2.103 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.270 -0.769 2.437 1.00 0.00 H new ATOM 979 N ALA A 67 106.162 -4.967 4.200 1.00 0.00 N ATOM 980 CA ALA A 67 106.094 -6.391 4.503 1.00 0.00 C ATOM 981 C ALA A 67 105.149 -7.065 3.514 1.00 0.00 C ATOM 982 O ALA A 67 104.180 -6.444 3.075 1.00 0.00 O ATOM 983 CB ALA A 67 105.589 -6.606 5.931 1.00 0.00 C ATOM 0 H ALA A 67 105.309 -4.584 3.792 1.00 0.00 H new ATOM 0 HA ALA A 67 107.090 -6.826 4.418 1.00 0.00 H new ATOM 0 HB1 ALA A 67 105.543 -7.674 6.144 1.00 0.00 H new ATOM 0 HB2 ALA A 67 106.269 -6.125 6.634 1.00 0.00 H new ATOM 0 HB3 ALA A 67 104.594 -6.172 6.034 1.00 0.00 H new ATOM 989 N GLY A 68 105.443 -8.310 3.140 1.00 0.00 N ATOM 990 CA GLY A 68 104.612 -8.996 2.153 1.00 0.00 C ATOM 991 C GLY A 68 104.615 -10.524 2.327 1.00 0.00 C ATOM 992 O GLY A 68 105.672 -11.092 2.604 1.00 0.00 O ATOM 0 H GLY A 68 106.230 -8.853 3.495 1.00 0.00 H new ATOM 0 HA2 GLY A 68 103.589 -8.629 2.229 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.966 -8.749 1.152 1.00 0.00 H new ATOM 996 N PRO A 69 103.489 -11.206 2.198 1.00 0.00 N ATOM 997 CA PRO A 69 103.485 -12.699 2.100 1.00 0.00 C ATOM 998 C PRO A 69 103.946 -13.171 0.721 1.00 0.00 C ATOM 999 O PRO A 69 103.935 -12.383 -0.230 1.00 0.00 O ATOM 1000 CB PRO A 69 102.029 -13.092 2.350 1.00 0.00 C ATOM 1001 CG PRO A 69 101.231 -11.917 1.905 1.00 0.00 C ATOM 1002 CD PRO A 69 102.105 -10.685 2.143 1.00 0.00 C ATOM 0 HA PRO A 69 104.171 -13.156 2.813 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.760 -13.987 1.789 1.00 0.00 H new ATOM 0 HB3 PRO A 69 101.855 -13.311 3.403 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.964 -12.006 0.852 1.00 0.00 H new ATOM 0 HG3 PRO A 69 100.299 -11.846 2.466 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.988 -9.957 1.340 1.00 0.00 H new ATOM 0 HD3 PRO A 69 101.835 -10.182 3.072 1.00 0.00 H new ATOM 1010 N ALA A 70 104.321 -14.448 0.596 1.00 0.00 N ATOM 1011 CA ALA A 70 104.801 -14.958 -0.687 1.00 0.00 C ATOM 1012 C ALA A 70 104.337 -16.395 -0.913 1.00 0.00 C ATOM 1013 O ALA A 70 104.093 -17.137 0.040 1.00 0.00 O ATOM 1014 CB ALA A 70 106.330 -14.889 -0.731 1.00 0.00 C ATOM 0 H ALA A 70 104.302 -15.133 1.352 1.00 0.00 H new ATOM 0 HA ALA A 70 104.386 -14.338 -1.481 1.00 0.00 H new ATOM 0 HB1 ALA A 70 106.684 -15.270 -1.689 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.651 -13.854 -0.611 1.00 0.00 H new ATOM 0 HB3 ALA A 70 106.745 -15.493 0.076 1.00 0.00 H new ATOM 1020 N TYR A 71 104.217 -16.780 -2.182 1.00 0.00 N ATOM 1021 CA TYR A 71 103.780 -18.126 -2.538 1.00 0.00 C ATOM 1022 C TYR A 71 104.844 -18.800 -3.396 1.00 0.00 C ATOM 1023 O TYR A 71 105.311 -18.217 -4.374 1.00 0.00 O ATOM 1024 CB TYR A 71 102.463 -18.059 -3.312 1.00 0.00 C ATOM 1025 CG TYR A 71 101.340 -17.414 -2.534 1.00 0.00 C ATOM 1026 CD1 TYR A 71 100.505 -18.199 -1.730 1.00 0.00 C ATOM 1027 CD2 TYR A 71 101.135 -16.033 -2.617 1.00 0.00 C ATOM 1028 CE1 TYR A 71 99.465 -17.602 -1.009 1.00 0.00 C ATOM 1029 CE2 TYR A 71 100.094 -15.434 -1.896 1.00 0.00 C ATOM 1030 CZ TYR A 71 99.259 -16.219 -1.092 1.00 0.00 C ATOM 1031 OH TYR A 71 98.234 -15.630 -0.381 1.00 0.00 O ATOM 0 H TYR A 71 104.417 -16.178 -2.980 1.00 0.00 H new ATOM 0 HA TYR A 71 103.629 -18.705 -1.627 1.00 0.00 H new ATOM 0 HB2 TYR A 71 102.621 -17.502 -4.236 1.00 0.00 H new ATOM 0 HB3 TYR A 71 102.165 -19.069 -3.595 1.00 0.00 H new ATOM 0 HD1 TYR A 71 100.664 -19.265 -1.666 1.00 0.00 H new ATOM 0 HD2 TYR A 71 101.780 -15.428 -3.237 1.00 0.00 H new ATOM 0 HE1 TYR A 71 98.821 -18.208 -0.388 1.00 0.00 H new ATOM 0 HE2 TYR A 71 99.936 -14.368 -1.960 1.00 0.00 H new ATOM 0 HH TYR A 71 98.231 -14.665 -0.550 1.00 0.00 H new ATOM 1144 N SER A 78 108.413 -17.752 -7.818 1.00 0.00 N ATOM 1145 CA SER A 78 107.594 -17.422 -6.655 1.00 0.00 C ATOM 1146 C SER A 78 107.137 -15.971 -6.745 1.00 0.00 C ATOM 1147 O SER A 78 107.825 -15.135 -7.328 1.00 0.00 O ATOM 1148 CB SER A 78 108.397 -17.632 -5.371 1.00 0.00 C ATOM 1149 OG SER A 78 108.829 -18.984 -5.305 1.00 0.00 O ATOM 0 HA SER A 78 106.722 -18.075 -6.638 1.00 0.00 H new ATOM 0 HB2 SER A 78 109.256 -16.962 -5.352 1.00 0.00 H new ATOM 0 HB3 SER A 78 107.785 -17.391 -4.502 1.00 0.00 H new ATOM 0 HG SER A 78 109.160 -19.265 -6.184 1.00 0.00 H new ATOM 1155 N ILE A 79 105.978 -15.668 -6.162 1.00 0.00 N ATOM 1156 CA ILE A 79 105.400 -14.329 -6.289 1.00 0.00 C ATOM 1157 C ILE A 79 105.137 -13.756 -4.904 1.00 0.00 C ATOM 1158 O ILE A 79 104.901 -14.506 -3.959 1.00 0.00 O ATOM 1159 CB ILE A 79 104.086 -14.397 -7.080 1.00 0.00 C ATOM 1160 CG1 ILE A 79 104.340 -15.031 -8.450 1.00 0.00 C ATOM 1161 CG2 ILE A 79 103.526 -12.985 -7.280 1.00 0.00 C ATOM 1162 CD1 ILE A 79 103.004 -15.305 -9.145 1.00 0.00 C ATOM 0 H ILE A 79 105.427 -16.320 -5.605 1.00 0.00 H new ATOM 0 HA ILE A 79 106.100 -13.685 -6.821 1.00 0.00 H new ATOM 0 HB ILE A 79 103.369 -15.000 -6.523 1.00 0.00 H new ATOM 0 HG12 ILE A 79 104.950 -14.367 -9.062 1.00 0.00 H new ATOM 0 HG13 ILE A 79 104.898 -15.960 -8.334 1.00 0.00 H new ATOM 0 HG21 ILE A 79 102.594 -13.040 -7.842 1.00 0.00 H new ATOM 0 HG22 ILE A 79 103.338 -12.527 -6.309 1.00 0.00 H new ATOM 0 HG23 ILE A 79 104.247 -12.382 -7.832 1.00 0.00 H new ATOM 0 HD11 ILE A 79 103.187 -15.756 -10.120 1.00 0.00 H new ATOM 0 HD12 ILE A 79 102.410 -15.986 -8.536 1.00 0.00 H new ATOM 0 HD13 ILE A 79 102.462 -14.368 -9.275 1.00 0.00 H new ATOM 1174 N TYR A 80 105.175 -12.432 -4.788 1.00 0.00 N ATOM 1175 CA TYR A 80 104.915 -11.793 -3.505 1.00 0.00 C ATOM 1176 C TYR A 80 104.208 -10.457 -3.689 1.00 0.00 C ATOM 1177 O TYR A 80 104.310 -9.832 -4.743 1.00 0.00 O ATOM 1178 CB TYR A 80 106.236 -11.589 -2.757 1.00 0.00 C ATOM 1179 CG TYR A 80 107.164 -10.589 -3.409 1.00 0.00 C ATOM 1180 CD1 TYR A 80 108.097 -11.016 -4.361 1.00 0.00 C ATOM 1181 CD2 TYR A 80 107.089 -9.235 -3.063 1.00 0.00 C ATOM 1182 CE1 TYR A 80 108.956 -10.091 -4.964 1.00 0.00 C ATOM 1183 CE2 TYR A 80 107.948 -8.309 -3.666 1.00 0.00 C ATOM 1184 CZ TYR A 80 108.882 -8.736 -4.616 1.00 0.00 C ATOM 1185 OH TYR A 80 109.730 -7.825 -5.211 1.00 0.00 O ATOM 0 H TYR A 80 105.380 -11.790 -5.554 1.00 0.00 H new ATOM 0 HA TYR A 80 104.261 -12.442 -2.923 1.00 0.00 H new ATOM 0 HB2 TYR A 80 106.019 -11.259 -1.741 1.00 0.00 H new ATOM 0 HB3 TYR A 80 106.749 -12.548 -2.678 1.00 0.00 H new ATOM 0 HD1 TYR A 80 108.154 -12.060 -4.630 1.00 0.00 H new ATOM 0 HD2 TYR A 80 106.368 -8.904 -2.330 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.676 -10.422 -5.698 1.00 0.00 H new ATOM 0 HE2 TYR A 80 107.890 -7.264 -3.398 1.00 0.00 H new ATOM 0 HH TYR A 80 110.142 -8.230 -6.003 1.00 0.00 H new ATOM 1195 N GLY A 81 103.514 -10.019 -2.645 1.00 0.00 N ATOM 1196 CA GLY A 81 102.884 -8.701 -2.653 1.00 0.00 C ATOM 1197 C GLY A 81 103.197 -7.980 -1.351 1.00 0.00 C ATOM 1198 O GLY A 81 103.250 -8.608 -0.295 1.00 0.00 O ATOM 0 H GLY A 81 103.373 -10.552 -1.787 1.00 0.00 H new ATOM 0 HA2 GLY A 81 103.247 -8.118 -3.500 1.00 0.00 H new ATOM 0 HA3 GLY A 81 101.806 -8.803 -2.774 1.00 0.00 H new ATOM 1202 N VAL A 82 103.352 -6.660 -1.410 1.00 0.00 N ATOM 1203 CA VAL A 82 103.823 -5.908 -0.250 1.00 0.00 C ATOM 1204 C VAL A 82 103.024 -4.629 -0.048 1.00 0.00 C ATOM 1205 O VAL A 82 102.520 -4.037 -1.003 1.00 0.00 O ATOM 1206 CB VAL A 82 105.302 -5.541 -0.424 1.00 0.00 C ATOM 1207 CG1 VAL A 82 106.152 -6.809 -0.489 1.00 0.00 C ATOM 1208 CG2 VAL A 82 105.489 -4.741 -1.716 1.00 0.00 C ATOM 0 H VAL A 82 103.161 -6.095 -2.237 1.00 0.00 H new ATOM 0 HA VAL A 82 103.691 -6.545 0.624 1.00 0.00 H new ATOM 0 HB VAL A 82 105.617 -4.938 0.428 1.00 0.00 H new ATOM 0 HG11 VAL A 82 107.201 -6.538 -0.613 1.00 0.00 H new ATOM 0 HG12 VAL A 82 106.030 -7.376 0.434 1.00 0.00 H new ATOM 0 HG13 VAL A 82 105.833 -7.418 -1.334 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.541 -4.483 -1.835 1.00 0.00 H new ATOM 0 HG22 VAL A 82 105.164 -5.341 -2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 82 104.895 -3.829 -1.668 1.00 0.00 H new ATOM 1218 N VAL A 83 102.930 -4.220 1.211 1.00 0.00 N ATOM 1219 CA VAL A 83 102.372 -2.922 1.562 1.00 0.00 C ATOM 1220 C VAL A 83 103.274 -2.284 2.610 1.00 0.00 C ATOM 1221 O VAL A 83 103.968 -3.003 3.330 1.00 0.00 O ATOM 1222 CB VAL A 83 100.948 -3.091 2.104 1.00 0.00 C ATOM 1223 CG1 VAL A 83 100.065 -3.720 1.022 1.00 0.00 C ATOM 1224 CG2 VAL A 83 100.960 -4.004 3.335 1.00 0.00 C ATOM 0 H VAL A 83 103.236 -4.774 2.011 1.00 0.00 H new ATOM 0 HA VAL A 83 102.321 -2.281 0.682 1.00 0.00 H new ATOM 0 HB VAL A 83 100.555 -2.114 2.384 1.00 0.00 H new ATOM 0 HG11 VAL A 83 99.052 -3.841 1.405 1.00 0.00 H new ATOM 0 HG12 VAL A 83 100.047 -3.072 0.145 1.00 0.00 H new ATOM 0 HG13 VAL A 83 100.467 -4.694 0.745 1.00 0.00 H new ATOM 0 HG21 VAL A 83 99.944 -4.118 3.713 1.00 0.00 H new ATOM 0 HG22 VAL A 83 101.357 -4.981 3.059 1.00 0.00 H new ATOM 0 HG23 VAL A 83 101.588 -3.563 4.109 1.00 0.00 H new ATOM 1234 N GLY A 84 103.286 -0.954 2.688 1.00 0.00 N ATOM 1235 CA GLY A 84 104.118 -0.288 3.687 1.00 0.00 C ATOM 1236 C GLY A 84 103.802 1.195 3.807 1.00 0.00 C ATOM 1237 O GLY A 84 102.929 1.716 3.116 1.00 0.00 O ATOM 0 H GLY A 84 102.745 -0.331 2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 84 103.973 -0.767 4.655 1.00 0.00 H new ATOM 0 HA3 GLY A 84 105.168 -0.413 3.423 1.00 0.00 H new ATOM 1241 N VAL A 85 104.559 1.866 4.669 1.00 0.00 N ATOM 1242 CA VAL A 85 104.336 3.281 4.945 1.00 0.00 C ATOM 1243 C VAL A 85 105.657 4.031 4.834 1.00 0.00 C ATOM 1244 O VAL A 85 106.697 3.529 5.258 1.00 0.00 O ATOM 1245 CB VAL A 85 103.749 3.465 6.351 1.00 0.00 C ATOM 1246 CG1 VAL A 85 103.435 4.944 6.590 1.00 0.00 C ATOM 1247 CG2 VAL A 85 102.457 2.653 6.482 1.00 0.00 C ATOM 0 H VAL A 85 105.333 1.452 5.189 1.00 0.00 H new ATOM 0 HA VAL A 85 103.627 3.678 4.218 1.00 0.00 H new ATOM 0 HB VAL A 85 104.476 3.120 7.087 1.00 0.00 H new ATOM 0 HG11 VAL A 85 103.018 5.071 7.589 1.00 0.00 H new ATOM 0 HG12 VAL A 85 104.350 5.529 6.502 1.00 0.00 H new ATOM 0 HG13 VAL A 85 102.712 5.287 5.850 1.00 0.00 H new ATOM 0 HG21 VAL A 85 102.043 2.786 7.482 1.00 0.00 H new ATOM 0 HG22 VAL A 85 101.735 2.997 5.742 1.00 0.00 H new ATOM 0 HG23 VAL A 85 102.672 1.597 6.316 1.00 0.00 H new ATOM 1257 N GLY A 86 105.614 5.223 4.247 1.00 0.00 N ATOM 1258 CA GLY A 86 106.818 6.029 4.083 1.00 0.00 C ATOM 1259 C GLY A 86 106.597 7.423 4.649 1.00 0.00 C ATOM 1260 O GLY A 86 105.516 7.990 4.498 1.00 0.00 O ATOM 0 H GLY A 86 104.764 5.650 3.879 1.00 0.00 H new ATOM 0 HA2 GLY A 86 107.656 5.551 4.590 1.00 0.00 H new ATOM 0 HA3 GLY A 86 107.080 6.094 3.027 1.00 0.00 H new ATOM 1264 N TYR A 87 107.617 7.961 5.309 1.00 0.00 N ATOM 1265 CA TYR A 87 107.528 9.298 5.887 1.00 0.00 C ATOM 1266 C TYR A 87 108.708 10.152 5.439 1.00 0.00 C ATOM 1267 O TYR A 87 109.809 9.642 5.233 1.00 0.00 O ATOM 1268 CB TYR A 87 107.480 9.209 7.417 1.00 0.00 C ATOM 1269 CG TYR A 87 108.768 8.739 8.055 1.00 0.00 C ATOM 1270 CD1 TYR A 87 109.007 7.371 8.225 1.00 0.00 C ATOM 1271 CD2 TYR A 87 109.721 9.674 8.479 1.00 0.00 C ATOM 1272 CE1 TYR A 87 110.198 6.937 8.818 1.00 0.00 C ATOM 1273 CE2 TYR A 87 110.912 9.240 9.072 1.00 0.00 C ATOM 1274 CZ TYR A 87 111.150 7.870 9.242 1.00 0.00 C ATOM 1275 OH TYR A 87 112.324 7.442 9.828 1.00 0.00 O ATOM 0 H TYR A 87 108.512 7.494 5.457 1.00 0.00 H new ATOM 0 HA TYR A 87 106.611 9.770 5.536 1.00 0.00 H new ATOM 0 HB2 TYR A 87 107.227 10.190 7.818 1.00 0.00 H new ATOM 0 HB3 TYR A 87 106.677 8.530 7.705 1.00 0.00 H new ATOM 0 HD1 TYR A 87 108.272 6.650 7.899 1.00 0.00 H new ATOM 0 HD2 TYR A 87 109.537 10.730 8.348 1.00 0.00 H new ATOM 0 HE1 TYR A 87 110.382 5.881 8.948 1.00 0.00 H new ATOM 0 HE2 TYR A 87 111.647 9.961 9.398 1.00 0.00 H new ATOM 0 HH TYR A 87 112.874 8.218 10.062 1.00 0.00 H new ATOM 1285 N GLY A 88 108.458 11.447 5.287 1.00 0.00 N ATOM 1286 CA GLY A 88 109.492 12.392 4.880 1.00 0.00 C ATOM 1287 C GLY A 88 109.676 13.464 5.945 1.00 0.00 C ATOM 1288 O GLY A 88 108.694 13.986 6.480 1.00 0.00 O ATOM 0 H GLY A 88 107.542 11.869 5.441 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.432 11.865 4.718 1.00 0.00 H new ATOM 0 HA3 GLY A 88 109.219 12.855 3.932 1.00 0.00 H new ATOM 1529 N SER A 103 104.941 16.403 9.542 1.00 0.00 N ATOM 1530 CA SER A 103 105.594 15.410 8.695 1.00 0.00 C ATOM 1531 C SER A 103 104.687 15.000 7.539 1.00 0.00 C ATOM 1532 O SER A 103 103.473 15.195 7.591 1.00 0.00 O ATOM 1533 CB SER A 103 105.955 14.176 9.523 1.00 0.00 C ATOM 1534 OG SER A 103 104.770 13.449 9.818 1.00 0.00 O ATOM 0 HA SER A 103 106.501 15.855 8.285 1.00 0.00 H new ATOM 0 HB2 SER A 103 106.655 13.547 8.974 1.00 0.00 H new ATOM 0 HB3 SER A 103 106.452 14.475 10.446 1.00 0.00 H new ATOM 0 HG SER A 103 104.030 14.075 9.965 1.00 0.00 H new ATOM 1540 N ASP A 104 105.284 14.444 6.488 1.00 0.00 N ATOM 1541 CA ASP A 104 104.511 13.955 5.349 1.00 0.00 C ATOM 1542 C ASP A 104 104.521 12.430 5.325 1.00 0.00 C ATOM 1543 O ASP A 104 105.554 11.818 5.581 1.00 0.00 O ATOM 1544 CB ASP A 104 105.107 14.492 4.045 1.00 0.00 C ATOM 1545 CG ASP A 104 105.021 16.016 4.005 1.00 0.00 C ATOM 1546 OD1 ASP A 104 104.086 16.559 4.572 1.00 0.00 O ATOM 1547 OD2 ASP A 104 105.896 16.621 3.406 1.00 0.00 O ATOM 0 H ASP A 104 106.293 14.321 6.401 1.00 0.00 H new ATOM 0 HA ASP A 104 103.483 14.304 5.447 1.00 0.00 H new ATOM 0 HB2 ASP A 104 106.147 14.178 3.957 1.00 0.00 H new ATOM 0 HB3 ASP A 104 104.574 14.069 3.193 1.00 0.00 H new ATOM 1552 N TYR A 105 103.379 11.819 5.017 1.00 0.00 N ATOM 1553 CA TYR A 105 103.292 10.360 4.977 1.00 0.00 C ATOM 1554 C TYR A 105 102.521 9.883 3.748 1.00 0.00 C ATOM 1555 O TYR A 105 101.699 10.615 3.195 1.00 0.00 O ATOM 1556 CB TYR A 105 102.618 9.849 6.256 1.00 0.00 C ATOM 1557 CG TYR A 105 101.149 10.200 6.363 1.00 0.00 C ATOM 1558 CD1 TYR A 105 100.763 11.440 6.886 1.00 0.00 C ATOM 1559 CD2 TYR A 105 100.179 9.285 5.939 1.00 0.00 C ATOM 1560 CE1 TYR A 105 99.404 11.764 6.984 1.00 0.00 C ATOM 1561 CE2 TYR A 105 98.820 9.609 6.038 1.00 0.00 C ATOM 1562 CZ TYR A 105 98.433 10.849 6.560 1.00 0.00 C ATOM 1563 OH TYR A 105 97.094 11.169 6.657 1.00 0.00 O ATOM 0 H TYR A 105 102.510 12.304 4.794 1.00 0.00 H new ATOM 0 HA TYR A 105 104.303 9.958 4.912 1.00 0.00 H new ATOM 0 HB2 TYR A 105 102.726 8.765 6.303 1.00 0.00 H new ATOM 0 HB3 TYR A 105 103.142 10.259 7.119 1.00 0.00 H new ATOM 0 HD1 TYR A 105 101.512 12.146 7.213 1.00 0.00 H new ATOM 0 HD2 TYR A 105 100.478 8.329 5.535 1.00 0.00 H new ATOM 0 HE1 TYR A 105 99.105 12.720 7.387 1.00 0.00 H new ATOM 0 HE2 TYR A 105 98.071 8.903 5.712 1.00 0.00 H new ATOM 0 HH TYR A 105 96.554 10.424 6.318 1.00 0.00 H new ATOM 1573 N GLY A 106 102.793 8.650 3.326 1.00 0.00 N ATOM 1574 CA GLY A 106 102.074 8.065 2.199 1.00 0.00 C ATOM 1575 C GLY A 106 102.049 6.543 2.293 1.00 0.00 C ATOM 1576 O GLY A 106 102.804 5.950 3.061 1.00 0.00 O ATOM 0 H GLY A 106 103.499 8.043 3.743 1.00 0.00 H new ATOM 0 HA2 GLY A 106 101.054 8.448 2.177 1.00 0.00 H new ATOM 0 HA3 GLY A 106 102.548 8.367 1.265 1.00 0.00 H new ATOM 1580 N PHE A 107 101.193 5.922 1.486 1.00 0.00 N ATOM 1581 CA PHE A 107 101.047 4.465 1.497 1.00 0.00 C ATOM 1582 C PHE A 107 101.541 3.869 0.183 1.00 0.00 C ATOM 1583 O PHE A 107 101.342 4.459 -0.878 1.00 0.00 O ATOM 1584 CB PHE A 107 99.578 4.092 1.707 1.00 0.00 C ATOM 1585 CG PHE A 107 99.021 4.569 3.028 1.00 0.00 C ATOM 1586 CD1 PHE A 107 99.192 3.793 4.181 1.00 0.00 C ATOM 1587 CD2 PHE A 107 98.335 5.787 3.101 1.00 0.00 C ATOM 1588 CE1 PHE A 107 98.677 4.234 5.405 1.00 0.00 C ATOM 1589 CE2 PHE A 107 97.820 6.229 4.324 1.00 0.00 C ATOM 1590 CZ PHE A 107 97.991 5.452 5.477 1.00 0.00 C ATOM 0 H PHE A 107 100.590 6.401 0.817 1.00 0.00 H new ATOM 0 HA PHE A 107 101.646 4.063 2.314 1.00 0.00 H new ATOM 0 HB2 PHE A 107 98.984 4.515 0.897 1.00 0.00 H new ATOM 0 HB3 PHE A 107 99.474 3.009 1.647 1.00 0.00 H new ATOM 0 HD1 PHE A 107 99.722 2.853 4.125 1.00 0.00 H new ATOM 0 HD2 PHE A 107 98.203 6.386 2.212 1.00 0.00 H new ATOM 0 HE1 PHE A 107 98.809 3.635 6.294 1.00 0.00 H new ATOM 0 HE2 PHE A 107 97.291 7.169 4.379 1.00 0.00 H new ATOM 0 HZ PHE A 107 97.593 5.793 6.422 1.00 0.00 H new ATOM 1600 N SER A 108 102.180 2.699 0.249 1.00 0.00 N ATOM 1601 CA SER A 108 102.729 2.068 -0.952 1.00 0.00 C ATOM 1602 C SER A 108 102.265 0.619 -1.076 1.00 0.00 C ATOM 1603 O SER A 108 102.139 -0.085 -0.074 1.00 0.00 O ATOM 1604 CB SER A 108 104.256 2.106 -0.899 1.00 0.00 C ATOM 1605 OG SER A 108 104.683 3.453 -0.744 1.00 0.00 O ATOM 0 H SER A 108 102.329 2.175 1.111 1.00 0.00 H new ATOM 0 HA SER A 108 102.370 2.621 -1.820 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.619 1.499 -0.070 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.675 1.682 -1.812 1.00 0.00 H new ATOM 0 HG SER A 108 105.661 3.482 -0.692 1.00 0.00 H new ATOM 1611 N TYR A 109 102.025 0.191 -2.314 1.00 0.00 N ATOM 1612 CA TYR A 109 101.630 -1.188 -2.595 1.00 0.00 C ATOM 1613 C TYR A 109 102.316 -1.668 -3.873 1.00 0.00 C ATOM 1614 O TYR A 109 102.591 -0.858 -4.760 1.00 0.00 O ATOM 1615 CB TYR A 109 100.113 -1.264 -2.778 1.00 0.00 C ATOM 1616 CG TYR A 109 99.332 -0.642 -1.644 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.218 0.752 -1.553 1.00 0.00 C ATOM 1618 CD2 TYR A 109 98.714 -1.456 -0.687 1.00 0.00 C ATOM 1619 CE1 TYR A 109 98.491 1.328 -0.505 1.00 0.00 C ATOM 1620 CE2 TYR A 109 97.987 -0.880 0.360 1.00 0.00 C ATOM 1621 CZ TYR A 109 97.876 0.513 0.452 1.00 0.00 C ATOM 1622 OH TYR A 109 97.160 1.082 1.485 1.00 0.00 O ATOM 0 H TYR A 109 102.098 0.782 -3.142 1.00 0.00 H new ATOM 0 HA TYR A 109 101.928 -1.822 -1.760 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.843 -0.766 -3.709 1.00 0.00 H new ATOM 0 HB3 TYR A 109 99.820 -2.309 -2.879 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.691 1.382 -2.292 1.00 0.00 H new ATOM 0 HD2 TYR A 109 98.799 -2.530 -0.757 1.00 0.00 H new ATOM 0 HE1 TYR A 109 98.405 2.402 -0.435 1.00 0.00 H new ATOM 0 HE2 TYR A 109 97.511 -1.510 1.097 1.00 0.00 H new ATOM 0 HH TYR A 109 96.797 0.376 2.059 1.00 0.00 H new ATOM 1632 N GLY A 110 102.609 -2.967 -3.966 1.00 0.00 N ATOM 1633 CA GLY A 110 103.191 -3.506 -5.195 1.00 0.00 C ATOM 1634 C GLY A 110 103.322 -5.025 -5.153 1.00 0.00 C ATOM 1635 O GLY A 110 102.977 -5.658 -4.158 1.00 0.00 O ATOM 0 H GLY A 110 102.457 -3.650 -3.224 1.00 0.00 H new ATOM 0 HA2 GLY A 110 102.571 -3.220 -6.044 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.174 -3.063 -5.354 1.00 0.00 H new ATOM 1639 N ALA A 111 103.831 -5.596 -6.242 1.00 0.00 N ATOM 1640 CA ALA A 111 104.042 -7.039 -6.325 1.00 0.00 C ATOM 1641 C ALA A 111 105.264 -7.335 -7.189 1.00 0.00 C ATOM 1642 O ALA A 111 105.598 -6.553 -8.080 1.00 0.00 O ATOM 1643 CB ALA A 111 102.809 -7.716 -6.925 1.00 0.00 C ATOM 0 H ALA A 111 104.105 -5.082 -7.079 1.00 0.00 H new ATOM 0 HA ALA A 111 104.209 -7.430 -5.321 1.00 0.00 H new ATOM 0 HB1 ALA A 111 102.976 -8.792 -6.983 1.00 0.00 H new ATOM 0 HB2 ALA A 111 101.942 -7.517 -6.295 1.00 0.00 H new ATOM 0 HB3 ALA A 111 102.629 -7.323 -7.925 1.00 0.00 H new ATOM 1649 N GLY A 112 105.917 -8.470 -6.944 1.00 0.00 N ATOM 1650 CA GLY A 112 107.156 -8.782 -7.651 1.00 0.00 C ATOM 1651 C GLY A 112 107.317 -10.277 -7.896 1.00 0.00 C ATOM 1652 O GLY A 112 106.598 -11.094 -7.320 1.00 0.00 O ATOM 0 H GLY A 112 105.615 -9.177 -6.274 1.00 0.00 H new ATOM 0 HA2 GLY A 112 107.170 -8.255 -8.605 1.00 0.00 H new ATOM 0 HA3 GLY A 112 108.005 -8.417 -7.072 1.00 0.00 H new ATOM 1656 N LEU A 113 108.287 -10.614 -8.742 1.00 0.00 N ATOM 1657 CA LEU A 113 108.566 -12.001 -9.095 1.00 0.00 C ATOM 1658 C LEU A 113 110.043 -12.299 -8.863 1.00 0.00 C ATOM 1659 O LEU A 113 110.896 -11.452 -9.130 1.00 0.00 O ATOM 1660 CB LEU A 113 108.215 -12.241 -10.566 1.00 0.00 C ATOM 1661 CG LEU A 113 108.378 -13.723 -10.913 1.00 0.00 C ATOM 1662 CD1 LEU A 113 107.170 -14.509 -10.399 1.00 0.00 C ATOM 1663 CD2 LEU A 113 108.473 -13.879 -12.433 1.00 0.00 C ATOM 0 H LEU A 113 108.898 -9.937 -9.199 1.00 0.00 H new ATOM 0 HA LEU A 113 107.962 -12.660 -8.471 1.00 0.00 H new ATOM 0 HB2 LEU A 113 107.190 -11.925 -10.759 1.00 0.00 H new ATOM 0 HB3 LEU A 113 108.860 -11.637 -11.205 1.00 0.00 H new ATOM 0 HG LEU A 113 109.285 -14.106 -10.445 1.00 0.00 H new ATOM 0 HD11 LEU A 113 107.289 -15.563 -10.648 1.00 0.00 H new ATOM 0 HD12 LEU A 113 107.097 -14.397 -9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 113 106.262 -14.127 -10.865 1.00 0.00 H new ATOM 0 HD21 LEU A 113 108.589 -14.933 -12.684 1.00 0.00 H new ATOM 0 HD22 LEU A 113 107.564 -13.494 -12.896 1.00 0.00 H new ATOM 0 HD23 LEU A 113 109.333 -13.321 -12.803 1.00 0.00 H new ATOM 1675 N GLN A 114 110.341 -13.490 -8.346 1.00 0.00 N ATOM 1676 CA GLN A 114 111.725 -13.894 -8.104 1.00 0.00 C ATOM 1677 C GLN A 114 112.056 -15.169 -8.879 1.00 0.00 C ATOM 1678 O GLN A 114 111.299 -16.138 -8.839 1.00 0.00 O ATOM 1679 CB GLN A 114 111.948 -14.096 -6.599 1.00 0.00 C ATOM 1680 CG GLN A 114 111.104 -15.263 -6.074 1.00 0.00 C ATOM 1681 CD GLN A 114 111.115 -15.270 -4.549 1.00 0.00 C ATOM 1682 OE1 GLN A 114 111.020 -14.215 -3.922 1.00 0.00 O ATOM 1683 NE2 GLN A 114 111.222 -16.404 -3.912 1.00 0.00 N ATOM 0 H GLN A 114 109.645 -14.190 -8.087 1.00 0.00 H new ATOM 0 HA GLN A 114 112.392 -13.107 -8.455 1.00 0.00 H new ATOM 0 HB2 GLN A 114 113.003 -14.289 -6.406 1.00 0.00 H new ATOM 0 HB3 GLN A 114 111.688 -13.183 -6.063 1.00 0.00 H new ATOM 0 HG2 GLN A 114 110.080 -15.175 -6.438 1.00 0.00 H new ATOM 0 HG3 GLN A 114 111.497 -16.206 -6.453 1.00 0.00 H new ATOM 0 HE21 GLN A 114 111.301 -17.277 -4.434 1.00 0.00 H new ATOM 0 HE22 GLN A 114 111.227 -16.418 -2.892 1.00 0.00 H new ATOM 1692 N PHE A 115 113.187 -15.166 -9.583 1.00 0.00 N ATOM 1693 CA PHE A 115 113.590 -16.336 -10.362 1.00 0.00 C ATOM 1694 C PHE A 115 115.056 -16.671 -10.116 1.00 0.00 C ATOM 1695 O PHE A 115 115.853 -15.794 -9.786 1.00 0.00 O ATOM 1696 CB PHE A 115 113.339 -16.090 -11.852 1.00 0.00 C ATOM 1697 CG PHE A 115 114.089 -14.908 -12.420 1.00 0.00 C ATOM 1698 CD1 PHE A 115 113.602 -13.610 -12.224 1.00 0.00 C ATOM 1699 CD2 PHE A 115 115.263 -15.111 -13.156 1.00 0.00 C ATOM 1700 CE1 PHE A 115 114.289 -12.516 -12.764 1.00 0.00 C ATOM 1701 CE2 PHE A 115 115.950 -14.018 -13.694 1.00 0.00 C ATOM 1702 CZ PHE A 115 115.464 -12.719 -13.499 1.00 0.00 C ATOM 0 H PHE A 115 113.833 -14.378 -9.630 1.00 0.00 H new ATOM 0 HA PHE A 115 112.990 -17.187 -10.041 1.00 0.00 H new ATOM 0 HB2 PHE A 115 113.618 -16.985 -12.408 1.00 0.00 H new ATOM 0 HB3 PHE A 115 112.271 -15.938 -12.009 1.00 0.00 H new ATOM 0 HD1 PHE A 115 112.697 -13.453 -11.656 1.00 0.00 H new ATOM 0 HD2 PHE A 115 115.638 -16.112 -13.308 1.00 0.00 H new ATOM 0 HE1 PHE A 115 113.913 -11.515 -12.614 1.00 0.00 H new ATOM 0 HE2 PHE A 115 116.856 -14.176 -14.260 1.00 0.00 H new ATOM 0 HZ PHE A 115 115.994 -11.875 -13.915 1.00 0.00 H new ATOM 1786 N VAL A 121 122.552 -17.098 -7.952 1.00 0.00 N ATOM 1787 CA VAL A 121 121.864 -15.975 -7.320 1.00 0.00 C ATOM 1788 C VAL A 121 120.477 -15.793 -7.929 1.00 0.00 C ATOM 1789 O VAL A 121 120.224 -16.218 -9.056 1.00 0.00 O ATOM 1790 CB VAL A 121 122.683 -14.694 -7.500 1.00 0.00 C ATOM 1791 CG1 VAL A 121 124.043 -14.859 -6.819 1.00 0.00 C ATOM 1792 CG2 VAL A 121 122.897 -14.422 -8.992 1.00 0.00 C ATOM 0 HA VAL A 121 121.755 -16.185 -6.256 1.00 0.00 H new ATOM 0 HB VAL A 121 122.145 -13.859 -7.052 1.00 0.00 H new ATOM 0 HG11 VAL A 121 124.627 -13.947 -6.947 1.00 0.00 H new ATOM 0 HG12 VAL A 121 123.897 -15.050 -5.756 1.00 0.00 H new ATOM 0 HG13 VAL A 121 124.576 -15.697 -7.269 1.00 0.00 H new ATOM 0 HG21 VAL A 121 123.480 -13.509 -9.115 1.00 0.00 H new ATOM 0 HG22 VAL A 121 123.432 -15.258 -9.441 1.00 0.00 H new ATOM 0 HG23 VAL A 121 121.931 -14.304 -9.483 1.00 0.00 H new ATOM 1802 N ALA A 122 119.580 -15.159 -7.177 1.00 0.00 N ATOM 1803 CA ALA A 122 118.210 -14.951 -7.639 1.00 0.00 C ATOM 1804 C ALA A 122 117.942 -13.462 -7.821 1.00 0.00 C ATOM 1805 O ALA A 122 118.512 -12.637 -7.110 1.00 0.00 O ATOM 1806 CB ALA A 122 117.223 -15.526 -6.620 1.00 0.00 C ATOM 0 H ALA A 122 119.776 -14.782 -6.250 1.00 0.00 H new ATOM 0 HA ALA A 122 118.080 -15.459 -8.594 1.00 0.00 H new ATOM 0 HB1 ALA A 122 116.203 -15.367 -6.971 1.00 0.00 H new ATOM 0 HB2 ALA A 122 117.404 -16.594 -6.501 1.00 0.00 H new ATOM 0 HB3 ALA A 122 117.358 -15.026 -5.661 1.00 0.00 H new ATOM 1812 N LEU A 123 117.069 -13.128 -8.768 1.00 0.00 N ATOM 1813 CA LEU A 123 116.778 -11.730 -9.078 1.00 0.00 C ATOM 1814 C LEU A 123 115.318 -11.422 -8.774 1.00 0.00 C ATOM 1815 O LEU A 123 114.445 -12.251 -9.030 1.00 0.00 O ATOM 1816 CB LEU A 123 117.063 -11.447 -10.554 1.00 0.00 C ATOM 1817 CG LEU A 123 118.559 -11.619 -10.836 1.00 0.00 C ATOM 1818 CD1 LEU A 123 118.865 -13.091 -11.122 1.00 0.00 C ATOM 1819 CD2 LEU A 123 118.953 -10.776 -12.052 1.00 0.00 C ATOM 0 H LEU A 123 116.552 -13.803 -9.332 1.00 0.00 H new ATOM 0 HA LEU A 123 117.416 -11.096 -8.462 1.00 0.00 H new ATOM 0 HB2 LEU A 123 116.485 -12.125 -11.182 1.00 0.00 H new ATOM 0 HB3 LEU A 123 116.750 -10.434 -10.807 1.00 0.00 H new ATOM 0 HG LEU A 123 119.127 -11.292 -9.965 1.00 0.00 H new ATOM 0 HD11 LEU A 123 119.930 -13.209 -11.322 1.00 0.00 H new ATOM 0 HD12 LEU A 123 118.589 -13.695 -10.257 1.00 0.00 H new ATOM 0 HD13 LEU A 123 118.294 -13.419 -11.991 1.00 0.00 H new ATOM 0 HD21 LEU A 123 120.018 -10.900 -12.251 1.00 0.00 H new ATOM 0 HD22 LEU A 123 118.381 -11.101 -12.921 1.00 0.00 H new ATOM 0 HD23 LEU A 123 118.741 -9.726 -11.851 1.00 0.00 H new ATOM 1831 N ASP A 124 115.064 -10.237 -8.223 1.00 0.00 N ATOM 1832 CA ASP A 124 113.707 -9.835 -7.870 1.00 0.00 C ATOM 1833 C ASP A 124 113.342 -8.538 -8.580 1.00 0.00 C ATOM 1834 O ASP A 124 114.092 -7.562 -8.509 1.00 0.00 O ATOM 1835 CB ASP A 124 113.603 -9.630 -6.356 1.00 0.00 C ATOM 1836 CG ASP A 124 113.978 -10.909 -5.611 1.00 0.00 C ATOM 1837 OD1 ASP A 124 113.771 -11.981 -6.154 1.00 0.00 O ATOM 1838 OD2 ASP A 124 114.471 -10.795 -4.500 1.00 0.00 O ATOM 0 H ASP A 124 115.779 -9.541 -8.012 1.00 0.00 H new ATOM 0 HA ASP A 124 113.018 -10.620 -8.180 1.00 0.00 H new ATOM 0 HB2 ASP A 124 114.261 -8.818 -6.048 1.00 0.00 H new ATOM 0 HB3 ASP A 124 112.587 -9.335 -6.093 1.00 0.00 H new ATOM 1843 N PHE A 125 112.205 -8.544 -9.276 1.00 0.00 N ATOM 1844 CA PHE A 125 111.719 -7.346 -9.955 1.00 0.00 C ATOM 1845 C PHE A 125 110.282 -7.066 -9.534 1.00 0.00 C ATOM 1846 O PHE A 125 109.450 -7.970 -9.536 1.00 0.00 O ATOM 1847 CB PHE A 125 111.781 -7.541 -11.470 1.00 0.00 C ATOM 1848 CG PHE A 125 113.182 -7.764 -11.991 1.00 0.00 C ATOM 1849 CD1 PHE A 125 113.999 -6.668 -12.290 1.00 0.00 C ATOM 1850 CD2 PHE A 125 113.663 -9.066 -12.171 1.00 0.00 C ATOM 1851 CE1 PHE A 125 115.298 -6.873 -12.772 1.00 0.00 C ATOM 1852 CE2 PHE A 125 114.961 -9.272 -12.653 1.00 0.00 C ATOM 1853 CZ PHE A 125 115.779 -8.176 -12.954 1.00 0.00 C ATOM 0 H PHE A 125 111.606 -9.363 -9.383 1.00 0.00 H new ATOM 0 HA PHE A 125 112.349 -6.501 -9.679 1.00 0.00 H new ATOM 0 HB2 PHE A 125 111.160 -8.393 -11.745 1.00 0.00 H new ATOM 0 HB3 PHE A 125 111.355 -6.665 -11.959 1.00 0.00 H new ATOM 0 HD1 PHE A 125 113.628 -5.664 -12.149 1.00 0.00 H new ATOM 0 HD2 PHE A 125 113.033 -9.912 -11.938 1.00 0.00 H new ATOM 0 HE1 PHE A 125 115.928 -6.027 -13.003 1.00 0.00 H new ATOM 0 HE2 PHE A 125 115.332 -10.277 -12.793 1.00 0.00 H new ATOM 0 HZ PHE A 125 116.780 -8.335 -13.326 1.00 0.00 H new ATOM 1863 N SER A 126 109.996 -5.821 -9.164 1.00 0.00 N ATOM 1864 CA SER A 126 108.653 -5.462 -8.722 1.00 0.00 C ATOM 1865 C SER A 126 108.276 -4.063 -9.197 1.00 0.00 C ATOM 1866 O SER A 126 109.140 -3.215 -9.416 1.00 0.00 O ATOM 1867 CB SER A 126 108.573 -5.521 -7.196 1.00 0.00 C ATOM 1868 OG SER A 126 107.252 -5.199 -6.783 1.00 0.00 O ATOM 0 H SER A 126 110.667 -5.053 -9.161 1.00 0.00 H new ATOM 0 HA SER A 126 107.952 -6.176 -9.155 1.00 0.00 H new ATOM 0 HB2 SER A 126 108.844 -6.516 -6.844 1.00 0.00 H new ATOM 0 HB3 SER A 126 109.285 -4.823 -6.756 1.00 0.00 H new ATOM 0 HG SER A 126 106.621 -5.424 -7.499 1.00 0.00 H new ATOM 1874 N TYR A 127 106.976 -3.832 -9.354 1.00 0.00 N ATOM 1875 CA TYR A 127 106.474 -2.507 -9.704 1.00 0.00 C ATOM 1876 C TYR A 127 105.738 -1.914 -8.509 1.00 0.00 C ATOM 1877 O TYR A 127 104.778 -2.500 -8.008 1.00 0.00 O ATOM 1878 CB TYR A 127 105.524 -2.606 -10.899 1.00 0.00 C ATOM 1879 CG TYR A 127 106.173 -3.180 -12.136 1.00 0.00 C ATOM 1880 CD1 TYR A 127 106.796 -2.331 -13.058 1.00 0.00 C ATOM 1881 CD2 TYR A 127 106.150 -4.562 -12.361 1.00 0.00 C ATOM 1882 CE1 TYR A 127 107.397 -2.863 -14.205 1.00 0.00 C ATOM 1883 CE2 TYR A 127 106.751 -5.094 -13.508 1.00 0.00 C ATOM 1884 CZ TYR A 127 107.375 -4.244 -14.430 1.00 0.00 C ATOM 1885 OH TYR A 127 107.967 -4.770 -15.560 1.00 0.00 O ATOM 0 H TYR A 127 106.253 -4.543 -9.245 1.00 0.00 H new ATOM 0 HA TYR A 127 107.312 -1.864 -9.972 1.00 0.00 H new ATOM 0 HB2 TYR A 127 104.671 -3.226 -10.625 1.00 0.00 H new ATOM 0 HB3 TYR A 127 105.136 -1.613 -11.129 1.00 0.00 H new ATOM 0 HD1 TYR A 127 106.813 -1.265 -12.885 1.00 0.00 H new ATOM 0 HD2 TYR A 127 105.669 -5.217 -11.650 1.00 0.00 H new ATOM 0 HE1 TYR A 127 107.878 -2.208 -14.916 1.00 0.00 H new ATOM 0 HE2 TYR A 127 106.734 -6.160 -13.682 1.00 0.00 H new ATOM 0 HH TYR A 127 107.862 -5.744 -15.561 1.00 0.00 H new ATOM 1895 N GLU A 128 106.191 -0.750 -8.055 1.00 0.00 N ATOM 1896 CA GLU A 128 105.639 -0.136 -6.850 1.00 0.00 C ATOM 1897 C GLU A 128 104.978 1.201 -7.168 1.00 0.00 C ATOM 1898 O GLU A 128 105.517 2.009 -7.923 1.00 0.00 O ATOM 1899 CB GLU A 128 106.764 0.082 -5.836 1.00 0.00 C ATOM 1900 CG GLU A 128 106.175 0.553 -4.503 1.00 0.00 C ATOM 1901 CD GLU A 128 105.413 -0.578 -3.812 1.00 0.00 C ATOM 1902 OE1 GLU A 128 105.717 -1.733 -4.067 1.00 0.00 O ATOM 1903 OE2 GLU A 128 104.531 -0.269 -3.029 1.00 0.00 O ATOM 0 H GLU A 128 106.936 -0.214 -8.500 1.00 0.00 H new ATOM 0 HA GLU A 128 104.882 -0.803 -6.437 1.00 0.00 H new ATOM 0 HB2 GLU A 128 107.321 -0.844 -5.691 1.00 0.00 H new ATOM 0 HB3 GLU A 128 107.469 0.822 -6.215 1.00 0.00 H new ATOM 0 HG2 GLU A 128 106.975 0.908 -3.853 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.506 1.396 -4.674 1.00 0.00 H new ATOM 1910 N GLN A 129 103.804 1.424 -6.584 1.00 0.00 N ATOM 1911 CA GLN A 129 103.105 2.695 -6.733 1.00 0.00 C ATOM 1912 C GLN A 129 102.741 3.235 -5.356 1.00 0.00 C ATOM 1913 O GLN A 129 102.340 2.474 -4.477 1.00 0.00 O ATOM 1914 CB GLN A 129 101.833 2.501 -7.562 1.00 0.00 C ATOM 1915 CG GLN A 129 102.207 2.060 -8.979 1.00 0.00 C ATOM 1916 CD GLN A 129 100.953 1.775 -9.802 1.00 0.00 C ATOM 1917 OE1 GLN A 129 99.868 1.581 -9.250 1.00 0.00 O ATOM 1918 NE2 GLN A 129 101.036 1.736 -11.103 1.00 0.00 N ATOM 0 H GLN A 129 103.318 0.741 -6.004 1.00 0.00 H new ATOM 0 HA GLN A 129 103.756 3.404 -7.245 1.00 0.00 H new ATOM 0 HB2 GLN A 129 101.193 1.753 -7.095 1.00 0.00 H new ATOM 0 HB3 GLN A 129 101.264 3.430 -7.597 1.00 0.00 H new ATOM 0 HG2 GLN A 129 102.798 2.837 -9.464 1.00 0.00 H new ATOM 0 HG3 GLN A 129 102.830 1.167 -8.935 1.00 0.00 H new ATOM 0 HE21 GLN A 129 101.933 1.896 -11.562 1.00 0.00 H new ATOM 0 HE22 GLN A 129 100.204 1.545 -11.662 1.00 0.00 H new ATOM 1927 N SER A 130 102.895 4.542 -5.161 1.00 0.00 N ATOM 1928 CA SER A 130 102.606 5.148 -3.865 1.00 0.00 C ATOM 1929 C SER A 130 101.736 6.388 -4.027 1.00 0.00 C ATOM 1930 O SER A 130 101.862 7.124 -5.005 1.00 0.00 O ATOM 1931 CB SER A 130 103.911 5.532 -3.169 1.00 0.00 C ATOM 1932 OG SER A 130 104.737 4.379 -3.056 1.00 0.00 O ATOM 0 H SER A 130 103.215 5.196 -5.876 1.00 0.00 H new ATOM 0 HA SER A 130 102.067 4.419 -3.261 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.425 6.308 -3.736 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.703 5.944 -2.181 1.00 0.00 H new ATOM 0 HG SER A 130 104.956 4.225 -2.113 1.00 0.00 H new ATOM 1938 N ARG A 131 100.868 6.615 -3.048 1.00 0.00 N ATOM 1939 CA ARG A 131 100.021 7.802 -3.036 1.00 0.00 C ATOM 1940 C ARG A 131 100.402 8.691 -1.859 1.00 0.00 C ATOM 1941 O ARG A 131 100.397 8.243 -0.709 1.00 0.00 O ATOM 1942 CB ARG A 131 98.549 7.396 -2.920 1.00 0.00 C ATOM 1943 CG ARG A 131 97.664 8.639 -3.038 1.00 0.00 C ATOM 1944 CD ARG A 131 96.202 8.250 -2.812 1.00 0.00 C ATOM 1945 NE ARG A 131 95.774 7.281 -3.825 1.00 0.00 N ATOM 1946 CZ ARG A 131 95.333 7.630 -5.044 1.00 0.00 C ATOM 1947 NH1 ARG A 131 95.249 8.882 -5.424 1.00 0.00 N ATOM 1948 NH2 ARG A 131 94.976 6.692 -5.878 1.00 0.00 N ATOM 0 H ARG A 131 100.732 5.992 -2.252 1.00 0.00 H new ATOM 0 HA ARG A 131 100.165 8.351 -3.967 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.296 6.681 -3.703 1.00 0.00 H new ATOM 0 HB3 ARG A 131 98.372 6.900 -1.966 1.00 0.00 H new ATOM 0 HG2 ARG A 131 97.970 9.386 -2.306 1.00 0.00 H new ATOM 0 HG3 ARG A 131 97.783 9.090 -4.023 1.00 0.00 H new ATOM 0 HD2 ARG A 131 96.081 7.823 -1.816 1.00 0.00 H new ATOM 0 HD3 ARG A 131 95.571 9.137 -2.857 1.00 0.00 H new ATOM 0 HE ARG A 131 95.813 6.289 -3.591 1.00 0.00 H new ATOM 0 HH11 ARG A 131 95.524 9.628 -4.785 1.00 0.00 H new ATOM 0 HH12 ARG A 131 94.909 9.110 -6.358 1.00 0.00 H new ATOM 0 HH21 ARG A 131 95.034 5.713 -5.599 1.00 0.00 H new ATOM 0 HH22 ARG A 131 94.638 6.938 -6.808 1.00 0.00 H new ATOM 1962 N ILE A 132 100.756 9.936 -2.163 1.00 0.00 N ATOM 1963 CA ILE A 132 101.148 10.894 -1.139 1.00 0.00 C ATOM 1964 C ILE A 132 100.302 12.135 -1.341 1.00 0.00 C ATOM 1965 O ILE A 132 100.672 12.999 -2.135 1.00 0.00 O ATOM 1966 CB ILE A 132 102.631 11.252 -1.278 1.00 0.00 C ATOM 1967 CG1 ILE A 132 103.479 9.981 -1.193 1.00 0.00 C ATOM 1968 CG2 ILE A 132 103.034 12.206 -0.151 1.00 0.00 C ATOM 1969 CD1 ILE A 132 104.936 10.318 -1.511 1.00 0.00 C ATOM 0 H ILE A 132 100.779 10.304 -3.114 1.00 0.00 H new ATOM 0 HA ILE A 132 100.997 10.471 -0.146 1.00 0.00 H new ATOM 0 HB ILE A 132 102.795 11.734 -2.242 1.00 0.00 H new ATOM 0 HG12 ILE A 132 103.404 9.547 -0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 132 103.106 9.235 -1.894 1.00 0.00 H new ATOM 0 HG21 ILE A 132 104.089 12.461 -0.250 1.00 0.00 H new ATOM 0 HG22 ILE A 132 102.434 13.114 -0.211 1.00 0.00 H new ATOM 0 HG23 ILE A 132 102.866 11.723 0.812 1.00 0.00 H new ATOM 0 HD11 ILE A 132 105.540 9.413 -1.451 1.00 0.00 H new ATOM 0 HD12 ILE A 132 105.002 10.732 -2.517 1.00 0.00 H new ATOM 0 HD13 ILE A 132 105.305 11.050 -0.792 1.00 0.00 H new ATOM 1981 N ARG A 133 99.189 12.214 -0.606 1.00 0.00 N ATOM 1982 CA ARG A 133 98.078 13.149 -0.868 1.00 0.00 C ATOM 1983 C ARG A 133 98.110 13.841 -2.243 1.00 0.00 C ATOM 1984 O ARG A 133 98.799 14.836 -2.457 1.00 0.00 O ATOM 1985 CB ARG A 133 97.995 14.166 0.279 1.00 0.00 C ATOM 1986 CG ARG A 133 99.277 15.001 0.383 1.00 0.00 C ATOM 1987 CD ARG A 133 99.266 15.764 1.710 1.00 0.00 C ATOM 1988 NE ARG A 133 100.422 16.662 1.787 1.00 0.00 N ATOM 1989 CZ ARG A 133 100.449 17.771 2.542 1.00 0.00 C ATOM 1990 NH1 ARG A 133 99.426 18.144 3.274 1.00 0.00 N ATOM 1991 NH2 ARG A 133 101.529 18.503 2.548 1.00 0.00 N ATOM 0 H ARG A 133 99.027 11.619 0.207 1.00 0.00 H new ATOM 0 HA ARG A 133 97.171 12.546 -0.908 1.00 0.00 H new ATOM 0 HB2 ARG A 133 97.142 14.826 0.121 1.00 0.00 H new ATOM 0 HB3 ARG A 133 97.823 13.642 1.219 1.00 0.00 H new ATOM 0 HG2 ARG A 133 100.153 14.355 0.327 1.00 0.00 H new ATOM 0 HG3 ARG A 133 99.341 15.698 -0.452 1.00 0.00 H new ATOM 0 HD2 ARG A 133 98.344 16.338 1.800 1.00 0.00 H new ATOM 0 HD3 ARG A 133 99.286 15.061 2.542 1.00 0.00 H new ATOM 0 HE ARG A 133 101.250 16.432 1.237 1.00 0.00 H new ATOM 0 HH11 ARG A 133 98.573 17.584 3.282 1.00 0.00 H new ATOM 0 HH12 ARG A 133 99.483 18.994 3.835 1.00 0.00 H new ATOM 0 HH21 ARG A 133 102.334 18.229 1.985 1.00 0.00 H new ATOM 0 HH22 ARG A 133 101.568 19.350 3.116 1.00 0.00 H new ATOM 2005 N SER A 134 97.384 13.253 -3.192 1.00 0.00 N ATOM 2006 CA SER A 134 97.153 13.861 -4.509 1.00 0.00 C ATOM 2007 C SER A 134 98.377 13.797 -5.433 1.00 0.00 C ATOM 2008 O SER A 134 98.259 14.110 -6.618 1.00 0.00 O ATOM 2009 CB SER A 134 96.696 15.319 -4.381 1.00 0.00 C ATOM 2010 OG SER A 134 95.624 15.392 -3.450 1.00 0.00 O ATOM 0 H SER A 134 96.938 12.343 -3.074 1.00 0.00 H new ATOM 0 HA SER A 134 96.362 13.265 -4.964 1.00 0.00 H new ATOM 0 HB2 SER A 134 97.525 15.945 -4.050 1.00 0.00 H new ATOM 0 HB3 SER A 134 96.377 15.700 -5.351 1.00 0.00 H new ATOM 0 HG SER A 134 95.329 16.323 -3.363 1.00 0.00 H new ATOM 2016 N VAL A 135 99.543 13.402 -4.919 1.00 0.00 N ATOM 2017 CA VAL A 135 100.736 13.276 -5.755 1.00 0.00 C ATOM 2018 C VAL A 135 101.006 11.803 -6.040 1.00 0.00 C ATOM 2019 O VAL A 135 100.923 10.969 -5.139 1.00 0.00 O ATOM 2020 CB VAL A 135 101.946 13.902 -5.052 1.00 0.00 C ATOM 2021 CG1 VAL A 135 103.168 13.844 -5.971 1.00 0.00 C ATOM 2022 CG2 VAL A 135 101.648 15.365 -4.711 1.00 0.00 C ATOM 0 H VAL A 135 99.686 13.166 -3.937 1.00 0.00 H new ATOM 0 HA VAL A 135 100.568 13.802 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 135 102.149 13.345 -4.137 1.00 0.00 H new ATOM 0 HG11 VAL A 135 104.025 14.290 -5.466 1.00 0.00 H new ATOM 0 HG12 VAL A 135 103.391 12.805 -6.215 1.00 0.00 H new ATOM 0 HG13 VAL A 135 102.960 14.395 -6.888 1.00 0.00 H new ATOM 0 HG21 VAL A 135 102.511 15.805 -4.212 1.00 0.00 H new ATOM 0 HG22 VAL A 135 101.439 15.917 -5.627 1.00 0.00 H new ATOM 0 HG23 VAL A 135 100.782 15.416 -4.051 1.00 0.00 H new ATOM 2032 N ASP A 136 101.321 11.487 -7.294 1.00 0.00 N ATOM 2033 CA ASP A 136 101.542 10.097 -7.689 1.00 0.00 C ATOM 2034 C ASP A 136 103.034 9.807 -7.813 1.00 0.00 C ATOM 2035 O ASP A 136 103.732 10.456 -8.588 1.00 0.00 O ATOM 2036 CB ASP A 136 100.853 9.820 -9.028 1.00 0.00 C ATOM 2037 CG ASP A 136 100.974 8.342 -9.381 1.00 0.00 C ATOM 2038 OD1 ASP A 136 100.162 7.569 -8.900 1.00 0.00 O ATOM 2039 OD2 ASP A 136 101.878 8.004 -10.129 1.00 0.00 O ATOM 0 H ASP A 136 101.428 12.166 -8.047 1.00 0.00 H new ATOM 0 HA ASP A 136 101.120 9.448 -6.922 1.00 0.00 H new ATOM 0 HB2 ASP A 136 99.802 10.104 -8.971 1.00 0.00 H new ATOM 0 HB3 ASP A 136 101.305 10.428 -9.812 1.00 0.00 H new ATOM 2044 N VAL A 137 103.524 8.824 -7.060 1.00 0.00 N ATOM 2045 CA VAL A 137 104.947 8.488 -7.090 1.00 0.00 C ATOM 2046 C VAL A 137 105.134 7.092 -7.673 1.00 0.00 C ATOM 2047 O VAL A 137 104.458 6.150 -7.266 1.00 0.00 O ATOM 2048 CB VAL A 137 105.535 8.543 -5.674 1.00 0.00 C ATOM 2049 CG1 VAL A 137 107.043 8.283 -5.727 1.00 0.00 C ATOM 2050 CG2 VAL A 137 105.291 9.926 -5.064 1.00 0.00 C ATOM 0 H VAL A 137 102.964 8.251 -6.428 1.00 0.00 H new ATOM 0 HA VAL A 137 105.468 9.213 -7.716 1.00 0.00 H new ATOM 0 HB VAL A 137 105.052 7.781 -5.063 1.00 0.00 H new ATOM 0 HG11 VAL A 137 107.455 8.323 -4.719 1.00 0.00 H new ATOM 0 HG12 VAL A 137 107.228 7.298 -6.155 1.00 0.00 H new ATOM 0 HG13 VAL A 137 107.522 9.043 -6.345 1.00 0.00 H new ATOM 0 HG21 VAL A 137 105.711 9.959 -4.059 1.00 0.00 H new ATOM 0 HG22 VAL A 137 105.769 10.686 -5.682 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.219 10.119 -5.016 1.00 0.00 H new ATOM 2060 N GLY A 138 106.051 6.970 -8.627 1.00 0.00 N ATOM 2061 CA GLY A 138 106.322 5.685 -9.263 1.00 0.00 C ATOM 2062 C GLY A 138 107.782 5.299 -9.069 1.00 0.00 C ATOM 2063 O GLY A 138 108.679 6.064 -9.419 1.00 0.00 O ATOM 0 H GLY A 138 106.618 7.743 -8.976 1.00 0.00 H new ATOM 0 HA2 GLY A 138 105.676 4.917 -8.838 1.00 0.00 H new ATOM 0 HA3 GLY A 138 106.092 5.742 -10.327 1.00 0.00 H new ATOM 2067 N THR A 139 108.017 4.133 -8.479 1.00 0.00 N ATOM 2068 CA THR A 139 109.380 3.652 -8.276 1.00 0.00 C ATOM 2069 C THR A 139 109.500 2.186 -8.681 1.00 0.00 C ATOM 2070 O THR A 139 108.579 1.395 -8.475 1.00 0.00 O ATOM 2071 CB THR A 139 109.781 3.832 -6.807 1.00 0.00 C ATOM 2072 OG1 THR A 139 111.125 3.409 -6.630 1.00 0.00 O ATOM 2073 CG2 THR A 139 108.857 3.017 -5.900 1.00 0.00 C ATOM 0 H THR A 139 107.289 3.507 -8.135 1.00 0.00 H new ATOM 0 HA THR A 139 110.054 4.235 -8.904 1.00 0.00 H new ATOM 0 HB THR A 139 109.691 4.885 -6.540 1.00 0.00 H new ATOM 0 HG1 THR A 139 111.696 3.848 -7.294 1.00 0.00 H new ATOM 0 HG21 THR A 139 109.154 3.155 -4.860 1.00 0.00 H new ATOM 0 HG22 THR A 139 107.829 3.354 -6.031 1.00 0.00 H new ATOM 0 HG23 THR A 139 108.929 1.961 -6.161 1.00 0.00 H new ATOM 2081 N TRP A 140 110.643 1.834 -9.259 1.00 0.00 N ATOM 2082 CA TRP A 140 110.913 0.452 -9.641 1.00 0.00 C ATOM 2083 C TRP A 140 112.086 -0.084 -8.829 1.00 0.00 C ATOM 2084 O TRP A 140 113.094 0.602 -8.659 1.00 0.00 O ATOM 2085 CB TRP A 140 111.248 0.378 -11.132 1.00 0.00 C ATOM 2086 CG TRP A 140 110.124 0.810 -12.018 1.00 0.00 C ATOM 2087 CD1 TRP A 140 109.012 0.083 -12.274 1.00 0.00 C ATOM 2088 CD2 TRP A 140 109.983 2.052 -12.769 1.00 0.00 C ATOM 2089 NE1 TRP A 140 108.197 0.797 -13.132 1.00 0.00 N ATOM 2090 CE2 TRP A 140 108.751 2.017 -13.466 1.00 0.00 C ATOM 2091 CE3 TRP A 140 110.794 3.191 -12.910 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 108.341 3.079 -14.276 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 110.384 4.259 -13.722 1.00 0.00 C ATOM 2094 CH2 TRP A 140 109.161 4.204 -14.405 1.00 0.00 C ATOM 0 H TRP A 140 111.398 2.486 -9.473 1.00 0.00 H new ATOM 0 HA TRP A 140 110.027 -0.151 -9.443 1.00 0.00 H new ATOM 0 HB2 TRP A 140 112.119 1.003 -11.332 1.00 0.00 H new ATOM 0 HB3 TRP A 140 111.526 -0.646 -11.384 1.00 0.00 H new ATOM 0 HD1 TRP A 140 108.796 -0.896 -11.873 1.00 0.00 H new ATOM 0 HE1 TRP A 140 107.297 0.464 -13.476 1.00 0.00 H new ATOM 0 HE3 TRP A 140 111.739 3.244 -12.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 107.397 3.031 -14.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 111.015 5.130 -13.822 1.00 0.00 H new ATOM 0 HH2 TRP A 140 108.853 5.029 -15.030 1.00 0.00 H new ATOM 2105 N ILE A 141 111.955 -1.309 -8.328 1.00 0.00 N ATOM 2106 CA ILE A 141 113.017 -1.917 -7.528 1.00 0.00 C ATOM 2107 C ILE A 141 113.577 -3.153 -8.225 1.00 0.00 C ATOM 2108 O ILE A 141 112.837 -3.949 -8.804 1.00 0.00 O ATOM 2109 CB ILE A 141 112.483 -2.285 -6.137 1.00 0.00 C ATOM 2110 CG1 ILE A 141 111.357 -3.318 -6.252 1.00 0.00 C ATOM 2111 CG2 ILE A 141 111.944 -1.027 -5.452 1.00 0.00 C ATOM 2112 CD1 ILE A 141 110.937 -3.786 -4.855 1.00 0.00 C ATOM 0 H ILE A 141 111.132 -1.897 -8.459 1.00 0.00 H new ATOM 0 HA ILE A 141 113.824 -1.193 -7.416 1.00 0.00 H new ATOM 0 HB ILE A 141 113.296 -2.712 -5.550 1.00 0.00 H new ATOM 0 HG12 ILE A 141 110.503 -2.883 -6.772 1.00 0.00 H new ATOM 0 HG13 ILE A 141 111.691 -4.169 -6.845 1.00 0.00 H new ATOM 0 HG21 ILE A 141 111.564 -1.285 -4.464 1.00 0.00 H new ATOM 0 HG22 ILE A 141 112.746 -0.295 -5.353 1.00 0.00 H new ATOM 0 HG23 ILE A 141 111.138 -0.603 -6.051 1.00 0.00 H new ATOM 0 HD11 ILE A 141 110.136 -4.520 -4.943 1.00 0.00 H new ATOM 0 HD12 ILE A 141 111.791 -4.239 -4.351 1.00 0.00 H new ATOM 0 HD13 ILE A 141 110.585 -2.932 -4.276 1.00 0.00 H new ATOM 2124 N ALA A 142 114.898 -3.280 -8.202 1.00 0.00 N ATOM 2125 CA ALA A 142 115.546 -4.486 -8.703 1.00 0.00 C ATOM 2126 C ALA A 142 116.726 -4.838 -7.806 1.00 0.00 C ATOM 2127 O ALA A 142 117.509 -3.958 -7.443 1.00 0.00 O ATOM 2128 CB ALA A 142 116.032 -4.267 -10.136 1.00 0.00 C ATOM 0 H ALA A 142 115.537 -2.570 -7.845 1.00 0.00 H new ATOM 0 HA ALA A 142 114.828 -5.306 -8.698 1.00 0.00 H new ATOM 0 HB1 ALA A 142 116.514 -5.174 -10.499 1.00 0.00 H new ATOM 0 HB2 ALA A 142 115.183 -4.026 -10.775 1.00 0.00 H new ATOM 0 HB3 ALA A 142 116.746 -3.444 -10.156 1.00 0.00 H new ATOM 2134 N GLY A 143 116.846 -6.114 -7.444 1.00 0.00 N ATOM 2135 CA GLY A 143 117.921 -6.525 -6.546 1.00 0.00 C ATOM 2136 C GLY A 143 118.306 -7.987 -6.738 1.00 0.00 C ATOM 2137 O GLY A 143 117.651 -8.725 -7.473 1.00 0.00 O ATOM 0 H GLY A 143 116.228 -6.865 -7.751 1.00 0.00 H new ATOM 0 HA2 GLY A 143 118.795 -5.896 -6.716 1.00 0.00 H new ATOM 0 HA3 GLY A 143 117.610 -6.366 -5.513 1.00 0.00 H new ATOM 2141 N VAL A 144 119.364 -8.391 -6.042 1.00 0.00 N ATOM 2142 CA VAL A 144 119.865 -9.760 -6.117 1.00 0.00 C ATOM 2143 C VAL A 144 120.033 -10.308 -4.704 1.00 0.00 C ATOM 2144 O VAL A 144 120.355 -9.556 -3.784 1.00 0.00 O ATOM 2145 CB VAL A 144 121.209 -9.797 -6.855 1.00 0.00 C ATOM 2146 CG1 VAL A 144 121.677 -11.246 -7.002 1.00 0.00 C ATOM 2147 CG2 VAL A 144 121.052 -9.179 -8.246 1.00 0.00 C ATOM 0 H VAL A 144 119.894 -7.786 -5.416 1.00 0.00 H new ATOM 0 HA VAL A 144 119.152 -10.374 -6.667 1.00 0.00 H new ATOM 0 HB VAL A 144 121.944 -9.230 -6.283 1.00 0.00 H new ATOM 0 HG11 VAL A 144 122.632 -11.268 -7.527 1.00 0.00 H new ATOM 0 HG12 VAL A 144 121.795 -11.692 -6.015 1.00 0.00 H new ATOM 0 HG13 VAL A 144 120.938 -11.811 -7.570 1.00 0.00 H new ATOM 0 HG21 VAL A 144 122.009 -9.207 -8.767 1.00 0.00 H new ATOM 0 HG22 VAL A 144 120.313 -9.744 -8.814 1.00 0.00 H new ATOM 0 HG23 VAL A 144 120.722 -8.145 -8.149 1.00 0.00 H new ATOM 2157 N GLY A 145 119.788 -11.604 -4.529 1.00 0.00 N ATOM 2158 CA GLY A 145 119.870 -12.207 -3.202 1.00 0.00 C ATOM 2159 C GLY A 145 120.492 -13.597 -3.250 1.00 0.00 C ATOM 2160 O GLY A 145 120.487 -14.256 -4.288 1.00 0.00 O ATOM 0 H GLY A 145 119.535 -12.249 -5.278 1.00 0.00 H new ATOM 0 HA2 GLY A 145 120.461 -11.567 -2.548 1.00 0.00 H new ATOM 0 HA3 GLY A 145 118.872 -12.270 -2.769 1.00 0.00 H new ATOM 2164 N TYR A 146 121.018 -14.032 -2.107 1.00 0.00 N ATOM 2165 CA TYR A 146 121.592 -15.367 -1.987 1.00 0.00 C ATOM 2166 C TYR A 146 121.080 -16.021 -0.710 1.00 0.00 C ATOM 2167 O TYR A 146 120.911 -15.349 0.307 1.00 0.00 O ATOM 2168 CB TYR A 146 123.119 -15.282 -1.948 1.00 0.00 C ATOM 2169 CG TYR A 146 123.796 -16.631 -1.927 1.00 0.00 C ATOM 2170 CD1 TYR A 146 124.141 -17.260 -3.129 1.00 0.00 C ATOM 2171 CD2 TYR A 146 124.081 -17.253 -0.705 1.00 0.00 C ATOM 2172 CE1 TYR A 146 124.770 -18.511 -3.110 1.00 0.00 C ATOM 2173 CE2 TYR A 146 124.710 -18.503 -0.686 1.00 0.00 C ATOM 2174 CZ TYR A 146 125.054 -19.132 -1.888 1.00 0.00 C ATOM 2175 OH TYR A 146 125.675 -20.366 -1.868 1.00 0.00 O ATOM 0 H TYR A 146 121.058 -13.478 -1.251 1.00 0.00 H new ATOM 0 HA TYR A 146 121.296 -15.965 -2.849 1.00 0.00 H new ATOM 0 HB2 TYR A 146 123.466 -14.723 -2.817 1.00 0.00 H new ATOM 0 HB3 TYR A 146 123.421 -14.719 -1.065 1.00 0.00 H new ATOM 0 HD1 TYR A 146 123.922 -16.780 -4.071 1.00 0.00 H new ATOM 0 HD2 TYR A 146 123.815 -16.768 0.223 1.00 0.00 H new ATOM 0 HE1 TYR A 146 125.036 -18.996 -4.037 1.00 0.00 H new ATOM 0 HE2 TYR A 146 124.930 -18.982 0.256 1.00 0.00 H new ATOM 0 HH TYR A 146 125.800 -20.654 -0.940 1.00 0.00 H new ATOM 2185 N ARG A 147 120.831 -17.327 -0.760 1.00 0.00 N ATOM 2186 CA ARG A 147 120.275 -18.039 0.389 1.00 0.00 C ATOM 2187 C ARG A 147 121.144 -19.235 0.775 1.00 0.00 C ATOM 2188 O ARG A 147 121.723 -19.903 -0.083 1.00 0.00 O ATOM 2189 CB ARG A 147 118.845 -18.494 0.069 1.00 0.00 C ATOM 2190 CG ARG A 147 118.845 -19.508 -1.082 1.00 0.00 C ATOM 2191 CD ARG A 147 117.406 -19.787 -1.516 1.00 0.00 C ATOM 2192 NE ARG A 147 117.379 -20.846 -2.530 1.00 0.00 N ATOM 2193 CZ ARG A 147 116.417 -20.956 -3.459 1.00 0.00 C ATOM 2194 NH1 ARG A 147 115.412 -20.116 -3.530 1.00 0.00 N ATOM 2195 NH2 ARG A 147 116.484 -21.932 -4.323 1.00 0.00 N ATOM 0 H ARG A 147 121.004 -17.911 -1.578 1.00 0.00 H new ATOM 0 HA ARG A 147 120.255 -17.359 1.241 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.393 -18.941 0.955 1.00 0.00 H new ATOM 0 HB3 ARG A 147 118.235 -17.632 -0.199 1.00 0.00 H new ATOM 0 HG2 ARG A 147 119.421 -19.120 -1.922 1.00 0.00 H new ATOM 0 HG3 ARG A 147 119.327 -20.433 -0.766 1.00 0.00 H new ATOM 0 HD2 ARG A 147 116.809 -20.084 -0.653 1.00 0.00 H new ATOM 0 HD3 ARG A 147 116.957 -18.878 -1.917 1.00 0.00 H new ATOM 0 HE ARG A 147 118.131 -21.535 -2.529 1.00 0.00 H new ATOM 0 HH11 ARG A 147 115.343 -19.346 -2.864 1.00 0.00 H new ATOM 0 HH12 ARG A 147 114.700 -20.233 -4.251 1.00 0.00 H new ATOM 0 HH21 ARG A 147 117.258 -22.595 -4.285 1.00 0.00 H new ATOM 0 HH22 ARG A 147 115.762 -22.032 -5.037 1.00 0.00 H new ATOM 2209 N PHE A 148 121.225 -19.491 2.076 1.00 0.00 N ATOM 2210 CA PHE A 148 121.997 -20.621 2.580 1.00 0.00 C ATOM 2211 C PHE A 148 121.405 -21.129 3.891 1.00 0.00 C ATOM 2212 O PHE A 148 120.636 -20.399 4.494 1.00 0.00 O ATOM 2213 CB PHE A 148 123.454 -20.204 2.798 1.00 0.00 C ATOM 2214 CG PHE A 148 123.626 -19.143 3.860 1.00 0.00 C ATOM 2215 CD1 PHE A 148 123.585 -17.788 3.510 1.00 0.00 C ATOM 2216 CD2 PHE A 148 123.828 -19.515 5.194 1.00 0.00 C ATOM 2217 CE1 PHE A 148 123.746 -16.806 4.494 1.00 0.00 C ATOM 2218 CE2 PHE A 148 123.988 -18.533 6.179 1.00 0.00 C ATOM 2219 CZ PHE A 148 123.948 -17.178 5.828 1.00 0.00 C ATOM 2220 OXT PHE A 148 121.731 -22.241 4.273 1.00 0.00 O ATOM 0 H PHE A 148 120.768 -18.934 2.798 1.00 0.00 H new ATOM 0 HA PHE A 148 121.959 -21.423 1.843 1.00 0.00 H new ATOM 0 HB2 PHE A 148 124.037 -21.082 3.076 1.00 0.00 H new ATOM 0 HB3 PHE A 148 123.862 -19.835 1.857 1.00 0.00 H new ATOM 0 HD1 PHE A 148 123.429 -17.501 2.481 1.00 0.00 H new ATOM 0 HD2 PHE A 148 123.860 -20.560 5.464 1.00 0.00 H new ATOM 0 HE1 PHE A 148 123.714 -15.761 4.224 1.00 0.00 H new ATOM 0 HE2 PHE A 148 124.142 -18.820 7.209 1.00 0.00 H new ATOM 0 HZ PHE A 148 124.073 -16.420 6.587 1.00 0.00 H new