USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 831 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 15 GLN : amide:sc= 0.403 K(o=-0.46,f=-1) USER MOD Set 1.2: A 17 GLN : amide:sc= -0.859 K(o=-0.46,f=-1) USER MOD Single : A 1 MET CE :methyl 138:sc= -0.143 (180deg=-0.642) USER MOD Single : A 1 MET N :NH3+ 173:sc= -0.03 (180deg=-0.102) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc=-0.00896 X(o=-0.009,f=-0.0082) USER MOD Single : A 6 HIS : no HD1:sc= -0.23 X(o=-0.23,f=-0.00034) USER MOD Single : A 7 HIS : no HE2:sc= 0.402 K(o=0.4,f=-3.6!) USER MOD Single : A 8 HIS : no HD1:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 9 MET CE :methyl 160:sc= -0.208 (180deg=-0.838) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 87:sc= 0.98 USER MOD Single : A 21 SER OG : rot -1:sc= 0.364 USER MOD Single : A 28 THR OG1 : rot 20:sc= 0.923 USER MOD Single : A 40 THR OG1 : rot 45:sc= 0.176 USER MOD Single : A 42 THR OG1 : rot -100:sc= 0.511 USER MOD Single : A 45 GLN : amide:sc= -0.0396 X(o=-0.04,f=-0.04) USER MOD Single : A 47 GLN : amide:sc= -6.9! C(o=-6.9!,f=-7.4!) USER MOD Single : A 52 LYS NZ :NH3+ -146:sc= 1.2 (180deg=0.675) USER MOD Single : A 54 THR OG1 : rot -80:sc= 0.659 USER MOD Single : A 58 SER OG : rot 78:sc= 0.881 USER MOD Single : A 59 SER OG : rot -166:sc= 0.0933 USER MOD Single : A 61 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.13) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 154:sc= -2.6! (180deg=-3.56!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -122:sc= 1.52 (180deg=0.059) USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.121 USER MOD Single : A 86 GLN : amide:sc= -1.71 K(o=-1.7,f=-0.41) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -57.066 18.122 -45.133 1.00 42.33 N ATOM 2 CA MET A 1 -57.653 17.179 -46.112 1.00 64.05 C ATOM 3 C MET A 1 -56.547 16.532 -46.946 1.00 13.42 C ATOM 4 O MET A 1 -55.988 17.155 -47.853 1.00 71.30 O ATOM 5 CB MET A 1 -58.681 17.890 -47.016 1.00 34.21 C ATOM 6 CG MET A 1 -58.134 19.100 -47.767 1.00 22.10 C ATOM 7 SD MET A 1 -59.385 19.929 -48.775 1.00 51.33 S ATOM 8 CE MET A 1 -60.539 20.476 -47.517 1.00 62.53 C ATOM 0 H1 MET A 1 -57.828 18.643 -44.653 1.00 42.33 H new ATOM 0 H2 MET A 1 -56.513 17.592 -44.429 1.00 42.33 H new ATOM 0 H3 MET A 1 -56.445 18.794 -45.627 1.00 42.33 H new ATOM 0 HA MET A 1 -58.179 16.396 -45.566 1.00 64.05 H new ATOM 0 HB2 MET A 1 -59.066 17.172 -47.740 1.00 34.21 H new ATOM 0 HB3 MET A 1 -59.525 18.209 -46.404 1.00 34.21 H new ATOM 0 HG2 MET A 1 -57.723 19.811 -47.050 1.00 22.10 H new ATOM 0 HG3 MET A 1 -57.311 18.782 -48.407 1.00 22.10 H new ATOM 0 HE1 MET A 1 -60.870 21.490 -47.743 1.00 62.53 H new ATOM 0 HE2 MET A 1 -61.401 19.809 -47.499 1.00 62.53 H new ATOM 0 HE3 MET A 1 -60.049 20.463 -46.543 1.00 62.53 H new ATOM 20 N ALA A 2 -56.219 15.289 -46.603 1.00 15.35 N ATOM 21 CA ALA A 2 -55.170 14.531 -47.283 1.00 62.22 C ATOM 22 C ALA A 2 -55.110 13.106 -46.736 1.00 54.21 C ATOM 23 O ALA A 2 -55.947 12.710 -45.922 1.00 13.45 O ATOM 24 CB ALA A 2 -53.813 15.219 -47.120 1.00 15.21 C ATOM 0 H ALA A 2 -56.673 14.778 -45.846 1.00 15.35 H new ATOM 0 HA ALA A 2 -55.408 14.491 -48.346 1.00 62.22 H new ATOM 0 HB1 ALA A 2 -53.047 14.638 -47.634 1.00 15.21 H new ATOM 0 HB2 ALA A 2 -53.859 16.220 -47.549 1.00 15.21 H new ATOM 0 HB3 ALA A 2 -53.566 15.290 -46.061 1.00 15.21 H new ATOM 30 N HIS A 3 -54.130 12.338 -47.194 1.00 62.30 N ATOM 31 CA HIS A 3 -53.890 10.997 -46.672 1.00 61.24 C ATOM 32 C HIS A 3 -52.420 10.630 -46.843 1.00 75.23 C ATOM 33 O HIS A 3 -51.870 10.729 -47.942 1.00 31.12 O ATOM 34 CB HIS A 3 -54.783 9.960 -47.369 1.00 53.45 C ATOM 35 CG HIS A 3 -54.540 8.553 -46.901 1.00 10.41 C ATOM 36 ND1 HIS A 3 -54.927 8.094 -45.660 1.00 44.13 N ATOM 37 CD2 HIS A 3 -53.925 7.506 -47.507 1.00 54.24 C ATOM 38 CE1 HIS A 3 -54.561 6.834 -45.524 1.00 44.22 C ATOM 39 NE2 HIS A 3 -53.952 6.452 -46.628 1.00 52.33 N ATOM 0 H HIS A 3 -53.484 12.622 -47.931 1.00 62.30 H new ATOM 0 HA HIS A 3 -54.140 10.993 -45.611 1.00 61.24 H new ATOM 0 HB2 HIS A 3 -55.828 10.217 -47.197 1.00 53.45 H new ATOM 0 HB3 HIS A 3 -54.615 10.011 -48.445 1.00 53.45 H new ATOM 0 HD2 HIS A 3 -53.494 7.503 -48.497 1.00 54.24 H new ATOM 0 HE1 HIS A 3 -54.732 6.218 -44.653 1.00 44.22 H new ATOM 0 HE2 HIS A 3 -53.564 5.525 -46.801 1.00 52.33 H new ATOM 48 N HIS A 4 -51.788 10.221 -45.751 1.00 45.44 N ATOM 49 CA HIS A 4 -50.380 9.840 -45.767 1.00 14.04 C ATOM 50 C HIS A 4 -50.249 8.332 -45.597 1.00 24.20 C ATOM 51 O HIS A 4 -51.246 7.636 -45.400 1.00 32.41 O ATOM 52 CB HIS A 4 -49.619 10.570 -44.654 1.00 31.14 C ATOM 53 CG HIS A 4 -49.702 12.064 -44.750 1.00 25.40 C ATOM 54 ND1 HIS A 4 -48.797 12.827 -45.457 1.00 41.35 N ATOM 55 CD2 HIS A 4 -50.599 12.937 -44.230 1.00 61.12 C ATOM 56 CE1 HIS A 4 -49.131 14.100 -45.365 1.00 25.52 C ATOM 57 NE2 HIS A 4 -50.220 14.193 -44.629 1.00 63.11 N ATOM 0 H HIS A 4 -52.231 10.144 -44.836 1.00 45.44 H new ATOM 0 HA HIS A 4 -49.947 10.126 -46.726 1.00 14.04 H new ATOM 0 HB2 HIS A 4 -50.013 10.254 -43.688 1.00 31.14 H new ATOM 0 HB3 HIS A 4 -48.572 10.270 -44.684 1.00 31.14 H new ATOM 0 HD2 HIS A 4 -51.453 12.690 -43.616 1.00 61.12 H new ATOM 0 HE1 HIS A 4 -48.602 14.926 -45.816 1.00 25.52 H new ATOM 0 HE2 HIS A 4 -50.703 15.060 -44.394 1.00 63.11 H new ATOM 66 N HIS A 5 -49.023 7.830 -45.685 1.00 43.15 N ATOM 67 CA HIS A 5 -48.765 6.403 -45.526 1.00 52.04 C ATOM 68 C HIS A 5 -47.333 6.176 -45.050 1.00 31.33 C ATOM 69 O HIS A 5 -46.397 6.791 -45.566 1.00 44.54 O ATOM 70 CB HIS A 5 -49.022 5.652 -46.843 1.00 13.13 C ATOM 71 CG HIS A 5 -48.142 6.080 -47.983 1.00 51.14 C ATOM 72 ND1 HIS A 5 -48.486 7.080 -48.869 1.00 45.22 N ATOM 73 CD2 HIS A 5 -46.926 5.632 -48.382 1.00 75.11 C ATOM 74 CE1 HIS A 5 -47.524 7.226 -49.760 1.00 22.22 C ATOM 75 NE2 HIS A 5 -46.568 6.362 -49.486 1.00 71.23 N ATOM 0 H HIS A 5 -48.190 8.391 -45.866 1.00 43.15 H new ATOM 0 HA HIS A 5 -49.449 6.010 -44.774 1.00 52.04 H new ATOM 0 HB2 HIS A 5 -48.881 4.585 -46.672 1.00 13.13 H new ATOM 0 HB3 HIS A 5 -50.064 5.794 -47.131 1.00 13.13 H new ATOM 0 HD2 HIS A 5 -46.348 4.847 -47.917 1.00 75.11 H new ATOM 0 HE1 HIS A 5 -47.521 7.934 -50.576 1.00 22.22 H new ATOM 0 HE2 HIS A 5 -45.700 6.253 -50.011 1.00 71.23 H new ATOM 84 N HIS A 6 -47.174 5.324 -44.047 1.00 45.44 N ATOM 85 CA HIS A 6 -45.856 4.988 -43.509 1.00 65.41 C ATOM 86 C HIS A 6 -45.399 3.629 -44.031 1.00 61.41 C ATOM 87 O HIS A 6 -46.222 2.800 -44.427 1.00 42.22 O ATOM 88 CB HIS A 6 -45.890 4.952 -41.973 1.00 63.14 C ATOM 89 CG HIS A 6 -46.207 6.264 -41.316 1.00 1.11 C ATOM 90 ND1 HIS A 6 -46.003 6.493 -39.974 1.00 42.22 N ATOM 91 CD2 HIS A 6 -46.722 7.416 -41.814 1.00 65.43 C ATOM 92 CE1 HIS A 6 -46.379 7.721 -39.674 1.00 42.01 C ATOM 93 NE2 HIS A 6 -46.819 8.305 -40.773 1.00 73.25 N ATOM 0 H HIS A 6 -47.947 4.847 -43.583 1.00 45.44 H new ATOM 0 HA HIS A 6 -45.155 5.757 -43.834 1.00 65.41 H new ATOM 0 HB2 HIS A 6 -46.630 4.216 -41.658 1.00 63.14 H new ATOM 0 HB3 HIS A 6 -44.922 4.606 -41.611 1.00 63.14 H new ATOM 0 HD2 HIS A 6 -47.004 7.600 -42.840 1.00 65.43 H new ATOM 0 HE1 HIS A 6 -46.334 8.173 -38.694 1.00 42.01 H new ATOM 0 HE2 HIS A 6 -47.173 9.260 -40.838 1.00 73.25 H new ATOM 102 N HIS A 7 -44.089 3.408 -44.033 1.00 41.25 N ATOM 103 CA HIS A 7 -43.514 2.117 -44.401 1.00 71.21 C ATOM 104 C HIS A 7 -42.061 2.061 -43.939 1.00 1.31 C ATOM 105 O HIS A 7 -41.334 3.051 -44.039 1.00 43.01 O ATOM 106 CB HIS A 7 -43.604 1.870 -45.919 1.00 4.24 C ATOM 107 CG HIS A 7 -42.697 2.736 -46.743 1.00 51.54 C ATOM 108 ND1 HIS A 7 -41.578 2.251 -47.383 1.00 41.15 N ATOM 109 CD2 HIS A 7 -42.757 4.056 -47.045 1.00 64.14 C ATOM 110 CE1 HIS A 7 -40.988 3.231 -48.039 1.00 54.14 C ATOM 111 NE2 HIS A 7 -41.682 4.337 -47.852 1.00 55.45 N ATOM 0 H HIS A 7 -43.398 4.114 -43.781 1.00 41.25 H new ATOM 0 HA HIS A 7 -44.086 1.331 -43.908 1.00 71.21 H new ATOM 0 HB2 HIS A 7 -43.369 0.825 -46.119 1.00 4.24 H new ATOM 0 HB3 HIS A 7 -44.633 2.033 -46.241 1.00 4.24 H new ATOM 0 HD1 HIS A 7 -41.256 1.284 -47.354 1.00 41.15 H new ATOM 0 HD2 HIS A 7 -43.510 4.756 -46.713 1.00 64.14 H new ATOM 0 HE1 HIS A 7 -40.088 3.143 -48.630 1.00 54.14 H new ATOM 120 N HIS A 8 -41.644 0.911 -43.423 1.00 21.43 N ATOM 121 CA HIS A 8 -40.295 0.754 -42.889 1.00 5.40 C ATOM 122 C HIS A 8 -39.692 -0.572 -43.327 1.00 12.40 C ATOM 123 O HIS A 8 -40.185 -1.641 -42.955 1.00 22.00 O ATOM 124 CB HIS A 8 -40.315 0.842 -41.356 1.00 32.05 C ATOM 125 CG HIS A 8 -38.971 0.636 -40.706 1.00 21.35 C ATOM 126 ND1 HIS A 8 -38.172 1.674 -40.273 1.00 12.31 N ATOM 127 CD2 HIS A 8 -38.298 -0.500 -40.397 1.00 33.13 C ATOM 128 CE1 HIS A 8 -37.073 1.184 -39.729 1.00 71.32 C ATOM 129 NE2 HIS A 8 -37.123 -0.131 -39.791 1.00 14.55 N ATOM 0 H HIS A 8 -42.221 0.072 -43.363 1.00 21.43 H new ATOM 0 HA HIS A 8 -39.677 1.561 -43.282 1.00 5.40 H new ATOM 0 HB2 HIS A 8 -40.701 1.819 -41.065 1.00 32.05 H new ATOM 0 HB3 HIS A 8 -41.010 0.097 -40.970 1.00 32.05 H new ATOM 0 HD2 HIS A 8 -38.626 -1.510 -40.592 1.00 33.13 H new ATOM 0 HE1 HIS A 8 -36.267 1.765 -39.304 1.00 71.32 H new ATOM 0 HE2 HIS A 8 -36.407 -0.770 -39.446 1.00 14.55 H new ATOM 138 N MET A 9 -38.632 -0.495 -44.120 1.00 14.33 N ATOM 139 CA MET A 9 -37.882 -1.675 -44.535 1.00 10.20 C ATOM 140 C MET A 9 -36.681 -1.849 -43.608 1.00 4.43 C ATOM 141 O MET A 9 -35.756 -1.036 -43.628 1.00 62.05 O ATOM 142 CB MET A 9 -37.413 -1.538 -45.995 1.00 34.12 C ATOM 143 CG MET A 9 -38.534 -1.209 -46.976 1.00 74.25 C ATOM 144 SD MET A 9 -39.230 0.440 -46.720 1.00 10.14 S ATOM 145 CE MET A 9 -37.794 1.466 -47.019 1.00 71.55 C ATOM 0 H MET A 9 -38.268 0.382 -44.493 1.00 14.33 H new ATOM 0 HA MET A 9 -38.527 -2.552 -44.472 1.00 10.20 H new ATOM 0 HB2 MET A 9 -36.654 -0.758 -46.051 1.00 34.12 H new ATOM 0 HB3 MET A 9 -36.936 -2.469 -46.302 1.00 34.12 H new ATOM 0 HG2 MET A 9 -38.152 -1.283 -47.994 1.00 74.25 H new ATOM 0 HG3 MET A 9 -39.326 -1.952 -46.878 1.00 74.25 H new ATOM 0 HE1 MET A 9 -38.114 2.482 -47.250 1.00 71.55 H new ATOM 0 HE2 MET A 9 -37.164 1.478 -46.130 1.00 71.55 H new ATOM 0 HE3 MET A 9 -37.228 1.064 -47.859 1.00 71.55 H new ATOM 155 N GLY A 10 -36.709 -2.891 -42.781 1.00 32.43 N ATOM 156 CA GLY A 10 -35.675 -3.078 -41.775 1.00 33.53 C ATOM 157 C GLY A 10 -34.662 -4.136 -42.162 1.00 23.23 C ATOM 158 O GLY A 10 -34.712 -4.688 -43.268 1.00 62.21 O ATOM 0 H GLY A 10 -37.431 -3.611 -42.789 1.00 32.43 H new ATOM 0 HA2 GLY A 10 -35.160 -2.132 -41.610 1.00 33.53 H new ATOM 0 HA3 GLY A 10 -36.141 -3.356 -40.830 1.00 33.53 H new ATOM 162 N THR A 11 -33.741 -4.416 -41.250 1.00 34.53 N ATOM 163 CA THR A 11 -32.726 -5.438 -41.456 1.00 13.23 C ATOM 164 C THR A 11 -32.987 -6.628 -40.535 1.00 32.22 C ATOM 165 O THR A 11 -32.887 -6.509 -39.313 1.00 32.32 O ATOM 166 CB THR A 11 -31.312 -4.874 -41.187 1.00 72.22 C ATOM 167 OG1 THR A 11 -31.090 -3.715 -42.003 1.00 34.23 O ATOM 168 CG2 THR A 11 -30.233 -5.915 -41.472 1.00 74.25 C ATOM 0 H THR A 11 -33.677 -3.942 -40.349 1.00 34.53 H new ATOM 0 HA THR A 11 -32.778 -5.764 -42.495 1.00 13.23 H new ATOM 0 HB THR A 11 -31.252 -4.603 -40.133 1.00 72.22 H new ATOM 0 HG1 THR A 11 -30.194 -3.359 -41.829 1.00 34.23 H new ATOM 0 HG21 THR A 11 -29.251 -5.485 -41.273 1.00 74.25 H new ATOM 0 HG22 THR A 11 -30.386 -6.783 -40.831 1.00 74.25 H new ATOM 0 HG23 THR A 11 -30.290 -6.221 -42.517 1.00 74.25 H new ATOM 176 N LEU A 12 -33.357 -7.758 -41.130 1.00 71.50 N ATOM 177 CA LEU A 12 -33.621 -8.988 -40.386 1.00 51.12 C ATOM 178 C LEU A 12 -33.127 -10.198 -41.180 1.00 2.41 C ATOM 179 O LEU A 12 -33.788 -10.633 -42.130 1.00 51.53 O ATOM 180 CB LEU A 12 -35.130 -9.143 -40.098 1.00 41.54 C ATOM 181 CG LEU A 12 -35.738 -8.149 -39.091 1.00 1.12 C ATOM 182 CD1 LEU A 12 -37.257 -8.317 -39.016 1.00 2.03 C ATOM 183 CD2 LEU A 12 -35.102 -8.328 -37.710 1.00 4.44 C ATOM 0 H LEU A 12 -33.482 -7.848 -42.138 1.00 71.50 H new ATOM 0 HA LEU A 12 -33.087 -8.932 -39.437 1.00 51.12 H new ATOM 0 HB2 LEU A 12 -35.670 -9.048 -41.040 1.00 41.54 H new ATOM 0 HB3 LEU A 12 -35.306 -10.154 -39.730 1.00 41.54 H new ATOM 0 HG LEU A 12 -35.526 -7.137 -39.436 1.00 1.12 H new ATOM 0 HD11 LEU A 12 -37.667 -7.606 -38.299 1.00 2.03 H new ATOM 0 HD12 LEU A 12 -37.692 -8.134 -39.998 1.00 2.03 H new ATOM 0 HD13 LEU A 12 -37.496 -9.332 -38.697 1.00 2.03 H new ATOM 0 HD21 LEU A 12 -35.544 -7.618 -37.011 1.00 4.44 H new ATOM 0 HD22 LEU A 12 -35.280 -9.343 -37.356 1.00 4.44 H new ATOM 0 HD23 LEU A 12 -34.029 -8.151 -37.778 1.00 4.44 H new ATOM 195 N GLU A 13 -31.960 -10.718 -40.811 1.00 71.43 N ATOM 196 CA GLU A 13 -31.434 -11.940 -41.416 1.00 21.04 C ATOM 197 C GLU A 13 -31.431 -13.075 -40.392 1.00 44.32 C ATOM 198 O GLU A 13 -30.659 -13.064 -39.427 1.00 71.34 O ATOM 199 CB GLU A 13 -30.024 -11.727 -42.011 1.00 3.43 C ATOM 200 CG GLU A 13 -28.962 -11.229 -41.026 1.00 72.42 C ATOM 201 CD GLU A 13 -29.099 -9.751 -40.690 1.00 50.02 C ATOM 202 OE1 GLU A 13 -28.599 -8.912 -41.480 1.00 62.43 O ATOM 203 OE2 GLU A 13 -29.696 -9.424 -39.646 1.00 21.45 O ATOM 0 H GLU A 13 -31.359 -10.312 -40.094 1.00 71.43 H new ATOM 0 HA GLU A 13 -32.090 -12.214 -42.242 1.00 21.04 H new ATOM 0 HB2 GLU A 13 -29.683 -12.669 -42.440 1.00 3.43 H new ATOM 0 HB3 GLU A 13 -30.098 -11.012 -42.830 1.00 3.43 H new ATOM 0 HG2 GLU A 13 -29.027 -11.811 -40.107 1.00 72.42 H new ATOM 0 HG3 GLU A 13 -27.973 -11.409 -41.447 1.00 72.42 H new ATOM 210 N ALA A 14 -32.321 -14.043 -40.591 1.00 72.45 N ATOM 211 CA ALA A 14 -32.450 -15.173 -39.676 1.00 22.35 C ATOM 212 C ALA A 14 -31.279 -16.138 -39.845 1.00 63.12 C ATOM 213 O ALA A 14 -31.354 -17.100 -40.617 1.00 72.22 O ATOM 214 CB ALA A 14 -33.781 -15.889 -39.888 1.00 2.03 C ATOM 0 H ALA A 14 -32.966 -14.067 -41.381 1.00 72.45 H new ATOM 0 HA ALA A 14 -32.430 -14.792 -38.655 1.00 22.35 H new ATOM 0 HB1 ALA A 14 -33.857 -16.728 -39.196 1.00 2.03 H new ATOM 0 HB2 ALA A 14 -34.601 -15.194 -39.707 1.00 2.03 H new ATOM 0 HB3 ALA A 14 -33.837 -16.257 -40.912 1.00 2.03 H new ATOM 220 N GLN A 15 -30.192 -15.851 -39.137 1.00 2.04 N ATOM 221 CA GLN A 15 -28.986 -16.674 -39.182 1.00 24.44 C ATOM 222 C GLN A 15 -28.113 -16.403 -37.955 1.00 22.42 C ATOM 223 O GLN A 15 -28.127 -15.300 -37.401 1.00 65.33 O ATOM 224 CB GLN A 15 -28.177 -16.392 -40.460 1.00 35.54 C ATOM 225 CG GLN A 15 -27.643 -14.963 -40.548 1.00 1.34 C ATOM 226 CD GLN A 15 -26.745 -14.741 -41.754 1.00 30.44 C ATOM 227 OE1 GLN A 15 -27.210 -14.357 -42.830 1.00 73.05 O ATOM 228 NE2 GLN A 15 -25.450 -14.975 -41.586 1.00 13.14 N ATOM 0 H GLN A 15 -30.121 -15.044 -38.517 1.00 2.04 H new ATOM 0 HA GLN A 15 -29.293 -17.720 -39.184 1.00 24.44 H new ATOM 0 HB2 GLN A 15 -27.339 -17.087 -40.509 1.00 35.54 H new ATOM 0 HB3 GLN A 15 -28.806 -16.589 -41.328 1.00 35.54 H new ATOM 0 HG2 GLN A 15 -28.482 -14.269 -40.593 1.00 1.34 H new ATOM 0 HG3 GLN A 15 -27.087 -14.732 -39.640 1.00 1.34 H new ATOM 0 HE21 GLN A 15 -25.102 -15.292 -40.681 1.00 13.14 H new ATOM 0 HE22 GLN A 15 -24.802 -14.838 -42.362 1.00 13.14 H new ATOM 237 N THR A 16 -27.355 -17.412 -37.541 1.00 51.14 N ATOM 238 CA THR A 16 -26.431 -17.285 -36.420 1.00 52.51 C ATOM 239 C THR A 16 -25.239 -18.219 -36.620 1.00 40.13 C ATOM 240 O THR A 16 -25.393 -19.329 -37.140 1.00 51.13 O ATOM 241 CB THR A 16 -27.132 -17.587 -35.070 1.00 11.31 C ATOM 242 OG1 THR A 16 -26.213 -17.419 -33.983 1.00 65.40 O ATOM 243 CG2 THR A 16 -27.703 -19.003 -35.041 1.00 41.52 C ATOM 0 H THR A 16 -27.363 -18.337 -37.971 1.00 51.14 H new ATOM 0 HA THR A 16 -26.079 -16.254 -36.386 1.00 52.51 H new ATOM 0 HB THR A 16 -27.956 -16.882 -34.963 1.00 11.31 H new ATOM 0 HG1 THR A 16 -26.211 -16.481 -33.699 1.00 65.40 H new ATOM 0 HG21 THR A 16 -28.187 -19.181 -34.081 1.00 41.52 H new ATOM 0 HG22 THR A 16 -28.433 -19.117 -35.842 1.00 41.52 H new ATOM 0 HG23 THR A 16 -26.897 -19.723 -35.180 1.00 41.52 H new ATOM 251 N GLN A 17 -24.054 -17.760 -36.229 1.00 32.42 N ATOM 252 CA GLN A 17 -22.825 -18.526 -36.416 1.00 51.23 C ATOM 253 C GLN A 17 -21.733 -18.025 -35.465 1.00 30.41 C ATOM 254 O GLN A 17 -21.473 -16.821 -35.377 1.00 31.24 O ATOM 255 CB GLN A 17 -22.350 -18.452 -37.886 1.00 54.23 C ATOM 256 CG GLN A 17 -21.897 -17.068 -38.358 1.00 74.01 C ATOM 257 CD GLN A 17 -22.988 -16.008 -38.278 1.00 13.51 C ATOM 258 OE1 GLN A 17 -23.767 -15.821 -39.215 1.00 30.33 O ATOM 259 NE2 GLN A 17 -23.046 -15.297 -37.158 1.00 74.31 N ATOM 0 H GLN A 17 -23.918 -16.855 -35.778 1.00 32.42 H new ATOM 0 HA GLN A 17 -23.032 -19.570 -36.182 1.00 51.23 H new ATOM 0 HB2 GLN A 17 -21.525 -19.151 -38.020 1.00 54.23 H new ATOM 0 HB3 GLN A 17 -23.162 -18.790 -38.530 1.00 54.23 H new ATOM 0 HG2 GLN A 17 -21.047 -16.748 -37.755 1.00 74.01 H new ATOM 0 HG3 GLN A 17 -21.548 -17.141 -39.388 1.00 74.01 H new ATOM 0 HE21 GLN A 17 -22.385 -15.480 -36.403 1.00 74.31 H new ATOM 0 HE22 GLN A 17 -23.752 -14.568 -37.052 1.00 74.31 H new ATOM 268 N GLY A 18 -21.110 -18.956 -34.750 1.00 45.01 N ATOM 269 CA GLY A 18 -20.066 -18.620 -33.794 1.00 32.05 C ATOM 270 C GLY A 18 -20.098 -19.545 -32.593 1.00 22.41 C ATOM 271 O GLY A 18 -20.640 -20.647 -32.686 1.00 30.02 O ATOM 0 H GLY A 18 -21.313 -19.953 -34.817 1.00 45.01 H new ATOM 0 HA2 GLY A 18 -19.092 -18.684 -34.279 1.00 32.05 H new ATOM 0 HA3 GLY A 18 -20.191 -17.589 -33.464 1.00 32.05 H new ATOM 275 N PRO A 19 -19.524 -19.131 -31.447 1.00 55.32 N ATOM 276 CA PRO A 19 -19.577 -19.918 -30.210 1.00 11.14 C ATOM 277 C PRO A 19 -21.021 -20.212 -29.802 1.00 0.34 C ATOM 278 O PRO A 19 -21.755 -19.311 -29.387 1.00 64.54 O ATOM 279 CB PRO A 19 -18.879 -19.019 -29.174 1.00 61.35 C ATOM 280 CG PRO A 19 -18.025 -18.104 -29.986 1.00 20.44 C ATOM 281 CD PRO A 19 -18.777 -17.875 -31.270 1.00 71.31 C ATOM 0 HA PRO A 19 -19.100 -20.893 -30.312 1.00 11.14 H new ATOM 0 HB2 PRO A 19 -19.604 -18.462 -28.580 1.00 61.35 H new ATOM 0 HB3 PRO A 19 -18.280 -19.607 -28.478 1.00 61.35 H new ATOM 0 HG2 PRO A 19 -17.850 -17.164 -29.462 1.00 20.44 H new ATOM 0 HG3 PRO A 19 -17.048 -18.548 -30.178 1.00 20.44 H new ATOM 0 HD2 PRO A 19 -19.444 -17.016 -31.199 1.00 71.31 H new ATOM 0 HD3 PRO A 19 -18.102 -17.686 -32.105 1.00 71.31 H new ATOM 289 N GLY A 20 -21.428 -21.470 -29.949 1.00 10.05 N ATOM 290 CA GLY A 20 -22.805 -21.847 -29.697 1.00 74.10 C ATOM 291 C GLY A 20 -23.746 -21.217 -30.706 1.00 65.13 C ATOM 292 O GLY A 20 -23.847 -21.682 -31.847 1.00 74.44 O ATOM 0 H GLY A 20 -20.823 -22.238 -30.240 1.00 10.05 H new ATOM 0 HA2 GLY A 20 -22.900 -22.932 -29.737 1.00 74.10 H new ATOM 0 HA3 GLY A 20 -23.089 -21.539 -28.691 1.00 74.10 H new ATOM 296 N SER A 21 -24.415 -20.147 -30.297 1.00 30.53 N ATOM 297 CA SER A 21 -25.312 -19.403 -31.170 1.00 4.43 C ATOM 298 C SER A 21 -25.429 -17.953 -30.693 1.00 25.13 C ATOM 299 O SER A 21 -26.248 -17.647 -29.827 1.00 5.22 O ATOM 300 CB SER A 21 -26.698 -20.068 -31.218 1.00 44.22 C ATOM 301 OG SER A 21 -26.613 -21.390 -31.729 1.00 33.34 O ATOM 0 H SER A 21 -24.351 -19.771 -29.351 1.00 30.53 H new ATOM 0 HA SER A 21 -24.898 -19.407 -32.178 1.00 4.43 H new ATOM 0 HB2 SER A 21 -27.130 -20.089 -30.217 1.00 44.22 H new ATOM 0 HB3 SER A 21 -27.368 -19.476 -31.842 1.00 44.22 H new ATOM 0 HG SER A 21 -25.683 -21.590 -31.965 1.00 33.34 H new ATOM 307 N PRO A 22 -24.570 -17.055 -31.216 1.00 74.53 N ATOM 308 CA PRO A 22 -24.605 -15.630 -30.873 1.00 53.05 C ATOM 309 C PRO A 22 -25.752 -14.900 -31.574 1.00 14.45 C ATOM 310 O PRO A 22 -25.845 -14.901 -32.805 1.00 2.32 O ATOM 311 CB PRO A 22 -23.243 -15.122 -31.359 1.00 32.50 C ATOM 312 CG PRO A 22 -22.900 -16.014 -32.505 1.00 73.23 C ATOM 313 CD PRO A 22 -23.489 -17.364 -32.176 1.00 50.00 C ATOM 0 HA PRO A 22 -24.776 -15.458 -29.810 1.00 53.05 H new ATOM 0 HB2 PRO A 22 -23.296 -14.079 -31.670 1.00 32.50 H new ATOM 0 HB3 PRO A 22 -22.493 -15.182 -30.571 1.00 32.50 H new ATOM 0 HG2 PRO A 22 -23.311 -15.626 -33.437 1.00 73.23 H new ATOM 0 HG3 PRO A 22 -21.820 -16.082 -32.637 1.00 73.23 H new ATOM 0 HD2 PRO A 22 -23.875 -17.859 -33.067 1.00 50.00 H new ATOM 0 HD3 PRO A 22 -22.744 -18.029 -31.739 1.00 50.00 H new ATOM 321 N GLU A 23 -26.623 -14.289 -30.784 1.00 31.13 N ATOM 322 CA GLU A 23 -27.779 -13.564 -31.301 1.00 2.43 C ATOM 323 C GLU A 23 -27.880 -12.213 -30.592 1.00 50.22 C ATOM 324 O GLU A 23 -27.726 -12.133 -29.372 1.00 63.33 O ATOM 325 CB GLU A 23 -29.052 -14.413 -31.101 1.00 32.34 C ATOM 326 CG GLU A 23 -30.305 -13.889 -31.810 1.00 31.05 C ATOM 327 CD GLU A 23 -30.986 -12.741 -31.081 1.00 11.01 C ATOM 328 OE1 GLU A 23 -31.404 -12.931 -29.920 1.00 72.13 O ATOM 329 OE2 GLU A 23 -31.117 -11.648 -31.669 1.00 31.24 O ATOM 0 H GLU A 23 -26.550 -14.281 -29.767 1.00 31.13 H new ATOM 0 HA GLU A 23 -27.668 -13.380 -32.370 1.00 2.43 H new ATOM 0 HB2 GLU A 23 -28.853 -15.426 -31.452 1.00 32.34 H new ATOM 0 HB3 GLU A 23 -29.260 -14.481 -30.033 1.00 32.34 H new ATOM 0 HG2 GLU A 23 -30.033 -13.560 -32.813 1.00 31.05 H new ATOM 0 HG3 GLU A 23 -31.016 -14.707 -31.924 1.00 31.05 H new ATOM 336 N GLY A 24 -28.115 -11.151 -31.361 1.00 33.14 N ATOM 337 CA GLY A 24 -28.145 -9.810 -30.798 1.00 73.02 C ATOM 338 C GLY A 24 -26.752 -9.239 -30.628 1.00 74.44 C ATOM 339 O GLY A 24 -26.555 -8.248 -29.922 1.00 72.20 O ATOM 0 H GLY A 24 -28.285 -11.196 -32.366 1.00 33.14 H new ATOM 0 HA2 GLY A 24 -28.729 -9.157 -31.446 1.00 73.02 H new ATOM 0 HA3 GLY A 24 -28.649 -9.833 -29.832 1.00 73.02 H new ATOM 343 N VAL A 25 -25.782 -9.873 -31.276 1.00 72.40 N ATOM 344 CA VAL A 25 -24.391 -9.433 -31.226 1.00 22.33 C ATOM 345 C VAL A 25 -24.061 -8.584 -32.456 1.00 61.30 C ATOM 346 O VAL A 25 -24.632 -8.797 -33.528 1.00 30.12 O ATOM 347 CB VAL A 25 -23.418 -10.640 -31.147 1.00 54.23 C ATOM 348 CG1 VAL A 25 -23.663 -11.451 -29.874 1.00 44.42 C ATOM 349 CG2 VAL A 25 -23.542 -11.527 -32.388 1.00 24.31 C ATOM 0 H VAL A 25 -25.935 -10.703 -31.849 1.00 72.40 H new ATOM 0 HA VAL A 25 -24.265 -8.833 -30.325 1.00 22.33 H new ATOM 0 HB VAL A 25 -22.401 -10.250 -31.113 1.00 54.23 H new ATOM 0 HG11 VAL A 25 -22.970 -12.292 -29.839 1.00 44.42 H new ATOM 0 HG12 VAL A 25 -23.507 -10.816 -29.002 1.00 44.42 H new ATOM 0 HG13 VAL A 25 -24.687 -11.824 -29.872 1.00 44.42 H new ATOM 0 HG21 VAL A 25 -22.850 -12.365 -32.307 1.00 24.31 H new ATOM 0 HG22 VAL A 25 -24.562 -11.905 -32.465 1.00 24.31 H new ATOM 0 HG23 VAL A 25 -23.303 -10.944 -33.277 1.00 24.31 H new ATOM 359 N PRO A 26 -23.150 -7.603 -32.318 1.00 53.20 N ATOM 360 CA PRO A 26 -22.741 -6.746 -33.432 1.00 53.23 C ATOM 361 C PRO A 26 -21.744 -7.448 -34.363 1.00 63.22 C ATOM 362 O PRO A 26 -20.894 -8.218 -33.906 1.00 4.41 O ATOM 363 CB PRO A 26 -22.087 -5.552 -32.726 1.00 71.45 C ATOM 364 CG PRO A 26 -21.526 -6.120 -31.465 1.00 61.30 C ATOM 365 CD PRO A 26 -22.450 -7.246 -31.063 1.00 20.30 C ATOM 0 HA PRO A 26 -23.576 -6.469 -34.076 1.00 53.23 H new ATOM 0 HB2 PRO A 26 -21.306 -5.107 -33.342 1.00 71.45 H new ATOM 0 HB3 PRO A 26 -22.815 -4.768 -32.518 1.00 71.45 H new ATOM 0 HG2 PRO A 26 -20.511 -6.486 -31.620 1.00 61.30 H new ATOM 0 HG3 PRO A 26 -21.475 -5.361 -30.685 1.00 61.30 H new ATOM 0 HD2 PRO A 26 -21.895 -8.093 -30.661 1.00 20.30 H new ATOM 0 HD3 PRO A 26 -23.152 -6.930 -30.291 1.00 20.30 H new ATOM 373 N PRO A 27 -21.854 -7.213 -35.687 1.00 22.12 N ATOM 374 CA PRO A 27 -20.915 -7.767 -36.672 1.00 12.14 C ATOM 375 C PRO A 27 -19.504 -7.191 -36.506 1.00 32.44 C ATOM 376 O PRO A 27 -19.284 -6.294 -35.690 1.00 51.44 O ATOM 377 CB PRO A 27 -21.520 -7.357 -38.031 1.00 2.02 C ATOM 378 CG PRO A 27 -22.930 -6.966 -37.729 1.00 33.14 C ATOM 379 CD PRO A 27 -22.907 -6.412 -36.333 1.00 24.33 C ATOM 0 HA PRO A 27 -20.798 -8.845 -36.564 1.00 12.14 H new ATOM 0 HB2 PRO A 27 -20.968 -6.528 -38.474 1.00 2.02 H new ATOM 0 HB3 PRO A 27 -21.484 -8.181 -38.743 1.00 2.02 H new ATOM 0 HG2 PRO A 27 -23.291 -6.222 -38.440 1.00 33.14 H new ATOM 0 HG3 PRO A 27 -23.598 -7.824 -37.799 1.00 33.14 H new ATOM 0 HD2 PRO A 27 -22.671 -5.348 -36.323 1.00 24.33 H new ATOM 0 HD3 PRO A 27 -23.869 -6.529 -35.834 1.00 24.33 H new ATOM 387 N THR A 28 -18.560 -7.730 -37.282 1.00 45.53 N ATOM 388 CA THR A 28 -17.140 -7.328 -37.258 1.00 23.35 C ATOM 389 C THR A 28 -16.486 -7.521 -35.878 1.00 32.41 C ATOM 390 O THR A 28 -15.333 -7.144 -35.672 1.00 52.34 O ATOM 391 CB THR A 28 -16.916 -5.874 -37.763 1.00 42.45 C ATOM 392 OG1 THR A 28 -17.685 -4.930 -37.001 1.00 3.44 O ATOM 393 CG2 THR A 28 -17.278 -5.752 -39.240 1.00 14.13 C ATOM 0 H THR A 28 -18.758 -8.469 -37.957 1.00 45.53 H new ATOM 0 HA THR A 28 -16.646 -8.003 -37.956 1.00 23.35 H new ATOM 0 HB THR A 28 -15.858 -5.646 -37.633 1.00 42.45 H new ATOM 0 HG1 THR A 28 -17.932 -5.328 -36.140 1.00 3.44 H new ATOM 0 HG21 THR A 28 -17.114 -4.727 -39.571 1.00 14.13 H new ATOM 0 HG22 THR A 28 -16.653 -6.427 -39.825 1.00 14.13 H new ATOM 0 HG23 THR A 28 -18.326 -6.015 -39.381 1.00 14.13 H new ATOM 401 N ASP A 29 -17.222 -8.125 -34.951 1.00 43.22 N ATOM 402 CA ASP A 29 -16.703 -8.497 -33.630 1.00 33.15 C ATOM 403 C ASP A 29 -16.433 -9.998 -33.589 1.00 10.15 C ATOM 404 O ASP A 29 -16.543 -10.636 -32.542 1.00 40.43 O ATOM 405 CB ASP A 29 -17.678 -8.083 -32.515 1.00 41.45 C ATOM 406 CG ASP A 29 -17.615 -6.593 -32.209 1.00 41.33 C ATOM 407 OD1 ASP A 29 -16.750 -6.178 -31.405 1.00 53.41 O ATOM 408 OD2 ASP A 29 -18.418 -5.822 -32.775 1.00 72.33 O ATOM 0 H ASP A 29 -18.201 -8.374 -35.091 1.00 43.22 H new ATOM 0 HA ASP A 29 -15.767 -7.965 -33.459 1.00 33.15 H new ATOM 0 HB2 ASP A 29 -18.694 -8.348 -32.808 1.00 41.45 H new ATOM 0 HB3 ASP A 29 -17.450 -8.646 -31.610 1.00 41.45 H new ATOM 413 N ARG A 30 -16.109 -10.544 -34.766 1.00 41.34 N ATOM 414 CA ARG A 30 -15.829 -11.975 -34.950 1.00 50.12 C ATOM 415 C ARG A 30 -14.945 -12.547 -33.836 1.00 1.41 C ATOM 416 O ARG A 30 -14.185 -11.815 -33.200 1.00 73.43 O ATOM 417 CB ARG A 30 -15.145 -12.197 -36.307 1.00 54.12 C ATOM 418 CG ARG A 30 -15.989 -11.779 -37.508 1.00 21.54 C ATOM 419 CD ARG A 30 -15.197 -11.879 -38.808 1.00 40.24 C ATOM 420 NE ARG A 30 -14.628 -13.214 -39.006 1.00 70.52 N ATOM 421 CZ ARG A 30 -13.566 -13.473 -39.772 1.00 52.34 C ATOM 422 NH1 ARG A 30 -12.951 -12.491 -40.423 1.00 32.25 N ATOM 423 NH2 ARG A 30 -13.119 -14.717 -39.877 1.00 22.53 N ATOM 0 H ARG A 30 -16.033 -10.001 -35.626 1.00 41.34 H new ATOM 0 HA ARG A 30 -16.784 -12.499 -34.914 1.00 50.12 H new ATOM 0 HB2 ARG A 30 -14.208 -11.641 -36.324 1.00 54.12 H new ATOM 0 HB3 ARG A 30 -14.891 -13.252 -36.405 1.00 54.12 H new ATOM 0 HG2 ARG A 30 -16.874 -12.412 -37.570 1.00 21.54 H new ATOM 0 HG3 ARG A 30 -16.338 -10.755 -37.371 1.00 21.54 H new ATOM 0 HD2 ARG A 30 -15.847 -11.635 -39.648 1.00 40.24 H new ATOM 0 HD3 ARG A 30 -14.395 -11.141 -38.801 1.00 40.24 H new ATOM 0 HE ARG A 30 -15.072 -13.997 -38.527 1.00 70.52 H new ATOM 0 HH11 ARG A 30 -13.290 -11.533 -40.339 1.00 32.25 H new ATOM 0 HH12 ARG A 30 -12.140 -12.696 -41.007 1.00 32.25 H new ATOM 0 HH21 ARG A 30 -13.586 -15.471 -39.374 1.00 22.53 H new ATOM 0 HH22 ARG A 30 -12.308 -14.920 -40.461 1.00 22.53 H new ATOM 437 N PHE A 31 -15.027 -13.871 -33.659 1.00 5.02 N ATOM 438 CA PHE A 31 -14.360 -14.590 -32.565 1.00 30.21 C ATOM 439 C PHE A 31 -14.507 -13.852 -31.228 1.00 11.12 C ATOM 440 O PHE A 31 -13.574 -13.226 -30.728 1.00 60.42 O ATOM 441 CB PHE A 31 -12.885 -14.944 -32.884 1.00 54.15 C ATOM 442 CG PHE A 31 -12.004 -13.802 -33.354 1.00 41.22 C ATOM 443 CD1 PHE A 31 -11.914 -13.486 -34.704 1.00 24.24 C ATOM 444 CD2 PHE A 31 -11.256 -13.057 -32.448 1.00 64.33 C ATOM 445 CE1 PHE A 31 -11.101 -12.454 -35.138 1.00 62.10 C ATOM 446 CE2 PHE A 31 -10.445 -12.024 -32.877 1.00 34.10 C ATOM 447 CZ PHE A 31 -10.367 -11.723 -34.223 1.00 23.03 C ATOM 0 H PHE A 31 -15.563 -14.480 -34.277 1.00 5.02 H new ATOM 0 HA PHE A 31 -14.877 -15.544 -32.463 1.00 30.21 H new ATOM 0 HB2 PHE A 31 -12.436 -15.376 -31.990 1.00 54.15 H new ATOM 0 HB3 PHE A 31 -12.878 -15.719 -33.650 1.00 54.15 H new ATOM 0 HD1 PHE A 31 -12.486 -14.053 -35.424 1.00 24.24 H new ATOM 0 HD2 PHE A 31 -11.310 -13.289 -31.395 1.00 64.33 H new ATOM 0 HE1 PHE A 31 -11.040 -12.220 -36.191 1.00 62.10 H new ATOM 0 HE2 PHE A 31 -9.873 -11.453 -32.161 1.00 34.10 H new ATOM 0 HZ PHE A 31 -9.733 -10.917 -34.560 1.00 23.03 H new ATOM 457 N PRO A 32 -15.709 -13.945 -30.626 1.00 23.40 N ATOM 458 CA PRO A 32 -16.052 -13.256 -29.371 1.00 61.21 C ATOM 459 C PRO A 32 -15.389 -13.893 -28.141 1.00 12.12 C ATOM 460 O PRO A 32 -15.810 -13.659 -27.003 1.00 45.31 O ATOM 461 CB PRO A 32 -17.591 -13.398 -29.287 1.00 34.33 C ATOM 462 CG PRO A 32 -18.017 -13.950 -30.610 1.00 12.11 C ATOM 463 CD PRO A 32 -16.841 -14.727 -31.130 1.00 51.11 C ATOM 0 HA PRO A 32 -15.703 -12.223 -29.374 1.00 61.21 H new ATOM 0 HB2 PRO A 32 -17.879 -14.064 -28.473 1.00 34.33 H new ATOM 0 HB3 PRO A 32 -18.063 -12.435 -29.094 1.00 34.33 H new ATOM 0 HG2 PRO A 32 -18.892 -14.591 -30.502 1.00 12.11 H new ATOM 0 HG3 PRO A 32 -18.291 -13.150 -31.297 1.00 12.11 H new ATOM 0 HD2 PRO A 32 -16.830 -15.750 -30.753 1.00 51.11 H new ATOM 0 HD3 PRO A 32 -16.842 -14.788 -32.218 1.00 51.11 H new ATOM 471 N LEU A 33 -14.358 -14.695 -28.372 1.00 21.14 N ATOM 472 CA LEU A 33 -13.635 -15.357 -27.292 1.00 43.40 C ATOM 473 C LEU A 33 -12.248 -14.746 -27.142 1.00 31.24 C ATOM 474 O LEU A 33 -11.463 -14.721 -28.092 1.00 3.30 O ATOM 475 CB LEU A 33 -13.518 -16.866 -27.554 1.00 65.01 C ATOM 476 CG LEU A 33 -14.854 -17.616 -27.697 1.00 10.43 C ATOM 477 CD1 LEU A 33 -14.616 -19.099 -27.971 1.00 12.42 C ATOM 478 CD2 LEU A 33 -15.721 -17.428 -26.452 1.00 72.02 C ATOM 0 H LEU A 33 -14.001 -14.904 -29.304 1.00 21.14 H new ATOM 0 HA LEU A 33 -14.194 -15.212 -26.367 1.00 43.40 H new ATOM 0 HB2 LEU A 33 -12.937 -17.016 -28.464 1.00 65.01 H new ATOM 0 HB3 LEU A 33 -12.953 -17.317 -26.738 1.00 65.01 H new ATOM 0 HG LEU A 33 -15.388 -17.194 -28.548 1.00 10.43 H new ATOM 0 HD11 LEU A 33 -15.574 -19.609 -28.068 1.00 12.42 H new ATOM 0 HD12 LEU A 33 -14.049 -19.212 -28.895 1.00 12.42 H new ATOM 0 HD13 LEU A 33 -14.054 -19.536 -27.145 1.00 12.42 H new ATOM 0 HD21 LEU A 33 -16.660 -17.968 -26.577 1.00 72.02 H new ATOM 0 HD22 LEU A 33 -15.194 -17.815 -25.580 1.00 72.02 H new ATOM 0 HD23 LEU A 33 -15.928 -16.367 -26.310 1.00 72.02 H new ATOM 490 N LEU A 34 -11.949 -14.279 -25.939 1.00 14.54 N ATOM 491 CA LEU A 34 -10.676 -13.616 -25.633 1.00 1.15 C ATOM 492 C LEU A 34 -9.517 -14.622 -25.515 1.00 23.24 C ATOM 493 O LEU A 34 -8.530 -14.368 -24.825 1.00 75.43 O ATOM 494 CB LEU A 34 -10.822 -12.753 -24.345 1.00 54.33 C ATOM 495 CG LEU A 34 -10.973 -13.473 -22.969 1.00 63.34 C ATOM 496 CD1 LEU A 34 -11.689 -14.819 -23.080 1.00 52.15 C ATOM 497 CD2 LEU A 34 -9.625 -13.624 -22.260 1.00 55.35 C ATOM 0 H LEU A 34 -12.580 -14.346 -25.140 1.00 14.54 H new ATOM 0 HA LEU A 34 -10.427 -12.957 -26.465 1.00 1.15 H new ATOM 0 HB2 LEU A 34 -9.949 -12.103 -24.283 1.00 54.33 H new ATOM 0 HB3 LEU A 34 -11.691 -12.108 -24.477 1.00 54.33 H new ATOM 0 HG LEU A 34 -11.606 -12.829 -22.358 1.00 63.34 H new ATOM 0 HD11 LEU A 34 -11.765 -15.273 -22.092 1.00 52.15 H new ATOM 0 HD12 LEU A 34 -12.689 -14.667 -23.487 1.00 52.15 H new ATOM 0 HD13 LEU A 34 -11.125 -15.478 -23.740 1.00 52.15 H new ATOM 0 HD21 LEU A 34 -9.771 -14.130 -21.305 1.00 55.35 H new ATOM 0 HD22 LEU A 34 -8.950 -14.211 -22.883 1.00 55.35 H new ATOM 0 HD23 LEU A 34 -9.193 -12.639 -22.086 1.00 55.35 H new ATOM 509 N ALA A 35 -9.615 -15.736 -26.239 1.00 40.20 N ATOM 510 CA ALA A 35 -8.616 -16.797 -26.168 1.00 32.23 C ATOM 511 C ALA A 35 -7.286 -16.361 -26.795 1.00 54.11 C ATOM 512 O ALA A 35 -7.004 -16.660 -27.958 1.00 20.41 O ATOM 513 CB ALA A 35 -9.141 -18.065 -26.836 1.00 0.34 C ATOM 0 H ALA A 35 -10.381 -15.926 -26.885 1.00 40.20 H new ATOM 0 HA ALA A 35 -8.426 -17.009 -25.116 1.00 32.23 H new ATOM 0 HB1 ALA A 35 -8.385 -18.848 -26.775 1.00 0.34 H new ATOM 0 HB2 ALA A 35 -10.047 -18.395 -26.328 1.00 0.34 H new ATOM 0 HB3 ALA A 35 -9.366 -17.858 -27.882 1.00 0.34 H new ATOM 519 N LEU A 36 -6.501 -15.616 -26.024 1.00 11.44 N ATOM 520 CA LEU A 36 -5.142 -15.228 -26.404 1.00 70.21 C ATOM 521 C LEU A 36 -4.421 -14.675 -25.177 1.00 54.41 C ATOM 522 O LEU A 36 -4.928 -14.790 -24.057 1.00 32.22 O ATOM 523 CB LEU A 36 -5.121 -14.194 -27.557 1.00 21.24 C ATOM 524 CG LEU A 36 -5.636 -12.776 -27.226 1.00 12.54 C ATOM 525 CD1 LEU A 36 -5.195 -11.782 -28.295 1.00 32.02 C ATOM 526 CD2 LEU A 36 -7.156 -12.755 -27.092 1.00 4.31 C ATOM 0 H LEU A 36 -6.789 -15.261 -25.112 1.00 11.44 H new ATOM 0 HA LEU A 36 -4.628 -16.115 -26.774 1.00 70.21 H new ATOM 0 HB2 LEU A 36 -4.096 -14.108 -27.919 1.00 21.24 H new ATOM 0 HB3 LEU A 36 -5.717 -14.589 -28.380 1.00 21.24 H new ATOM 0 HG LEU A 36 -5.204 -12.484 -26.269 1.00 12.54 H new ATOM 0 HD11 LEU A 36 -5.567 -10.789 -28.044 1.00 32.02 H new ATOM 0 HD12 LEU A 36 -4.106 -11.760 -28.344 1.00 32.02 H new ATOM 0 HD13 LEU A 36 -5.596 -12.086 -29.262 1.00 32.02 H new ATOM 0 HD21 LEU A 36 -7.487 -11.743 -26.859 1.00 4.31 H new ATOM 0 HD22 LEU A 36 -7.608 -13.078 -28.030 1.00 4.31 H new ATOM 0 HD23 LEU A 36 -7.460 -13.429 -26.292 1.00 4.31 H new ATOM 538 N LEU A 37 -3.247 -14.082 -25.378 1.00 13.52 N ATOM 539 CA LEU A 37 -2.458 -13.552 -24.267 1.00 21.25 C ATOM 540 C LEU A 37 -3.153 -12.348 -23.626 1.00 14.11 C ATOM 541 O LEU A 37 -2.895 -11.199 -23.993 1.00 53.31 O ATOM 542 CB LEU A 37 -1.035 -13.171 -24.723 1.00 71.04 C ATOM 543 CG LEU A 37 -0.113 -14.342 -25.115 1.00 45.01 C ATOM 544 CD1 LEU A 37 -0.030 -15.372 -23.989 1.00 73.25 C ATOM 545 CD2 LEU A 37 -0.571 -15.000 -26.415 1.00 10.31 C ATOM 0 H LEU A 37 -2.821 -13.956 -26.296 1.00 13.52 H new ATOM 0 HA LEU A 37 -2.375 -14.340 -23.519 1.00 21.25 H new ATOM 0 HB2 LEU A 37 -1.117 -12.498 -25.577 1.00 71.04 H new ATOM 0 HB3 LEU A 37 -0.556 -12.611 -23.920 1.00 71.04 H new ATOM 0 HG LEU A 37 0.884 -13.934 -25.280 1.00 45.01 H new ATOM 0 HD11 LEU A 37 0.627 -16.188 -24.290 1.00 73.25 H new ATOM 0 HD12 LEU A 37 0.368 -14.899 -23.091 1.00 73.25 H new ATOM 0 HD13 LEU A 37 -1.025 -15.765 -23.781 1.00 73.25 H new ATOM 0 HD21 LEU A 37 0.101 -15.822 -26.663 1.00 10.31 H new ATOM 0 HD22 LEU A 37 -1.584 -15.384 -26.291 1.00 10.31 H new ATOM 0 HD23 LEU A 37 -0.557 -14.265 -27.220 1.00 10.31 H new ATOM 557 N ARG A 38 -4.068 -12.626 -22.701 1.00 2.14 N ATOM 558 CA ARG A 38 -4.771 -11.591 -21.940 1.00 45.54 C ATOM 559 C ARG A 38 -4.836 -12.012 -20.472 1.00 2.05 C ATOM 560 O ARG A 38 -5.006 -13.194 -20.179 1.00 21.04 O ATOM 561 CB ARG A 38 -6.191 -11.374 -22.500 1.00 41.41 C ATOM 562 CG ARG A 38 -6.225 -10.949 -23.969 1.00 14.00 C ATOM 563 CD ARG A 38 -5.596 -9.573 -24.186 1.00 71.31 C ATOM 564 NE ARG A 38 -5.466 -9.244 -25.612 1.00 2.14 N ATOM 565 CZ ARG A 38 -5.878 -8.097 -26.163 1.00 52.02 C ATOM 566 NH1 ARG A 38 -6.493 -7.185 -25.422 1.00 34.34 N ATOM 567 NH2 ARG A 38 -5.676 -7.869 -27.456 1.00 41.24 N ATOM 0 H ARG A 38 -4.345 -13.577 -22.456 1.00 2.14 H new ATOM 0 HA ARG A 38 -4.230 -10.649 -22.027 1.00 45.54 H new ATOM 0 HB2 ARG A 38 -6.760 -12.297 -22.387 1.00 41.41 H new ATOM 0 HB3 ARG A 38 -6.694 -10.614 -21.901 1.00 41.41 H new ATOM 0 HG2 ARG A 38 -5.696 -11.688 -24.572 1.00 14.00 H new ATOM 0 HG3 ARG A 38 -7.258 -10.934 -24.317 1.00 14.00 H new ATOM 0 HD2 ARG A 38 -6.205 -8.815 -23.693 1.00 71.31 H new ATOM 0 HD3 ARG A 38 -4.612 -9.546 -23.717 1.00 71.31 H new ATOM 0 HE ARG A 38 -5.033 -9.937 -26.223 1.00 2.14 H new ATOM 0 HH11 ARG A 38 -6.653 -7.357 -24.429 1.00 34.34 H new ATOM 0 HH12 ARG A 38 -6.806 -6.311 -25.845 1.00 34.34 H new ATOM 0 HH21 ARG A 38 -5.206 -8.569 -28.030 1.00 41.24 H new ATOM 0 HH22 ARG A 38 -5.991 -6.994 -27.875 1.00 41.24 H new ATOM 581 N ARG A 39 -4.702 -11.050 -19.560 1.00 13.43 N ATOM 582 CA ARG A 39 -4.605 -11.353 -18.128 1.00 31.22 C ATOM 583 C ARG A 39 -5.973 -11.633 -17.517 1.00 12.54 C ATOM 584 O ARG A 39 -6.104 -12.447 -16.608 1.00 64.51 O ATOM 585 CB ARG A 39 -3.958 -10.189 -17.365 1.00 71.22 C ATOM 586 CG ARG A 39 -2.619 -9.725 -17.932 1.00 25.23 C ATOM 587 CD ARG A 39 -1.884 -8.822 -16.949 1.00 12.21 C ATOM 588 NE ARG A 39 -2.694 -7.670 -16.543 1.00 64.14 N ATOM 589 CZ ARG A 39 -2.894 -7.296 -15.273 1.00 40.21 C ATOM 590 NH1 ARG A 39 -2.376 -8.005 -14.273 1.00 72.51 N ATOM 591 NH2 ARG A 39 -3.630 -6.223 -15.011 1.00 72.23 N ATOM 0 H ARG A 39 -4.658 -10.056 -19.784 1.00 13.43 H new ATOM 0 HA ARG A 39 -3.986 -12.246 -18.039 1.00 31.22 H new ATOM 0 HB2 ARG A 39 -4.648 -9.345 -17.362 1.00 71.22 H new ATOM 0 HB3 ARG A 39 -3.814 -10.487 -16.327 1.00 71.22 H new ATOM 0 HG2 ARG A 39 -2.001 -10.592 -18.165 1.00 25.23 H new ATOM 0 HG3 ARG A 39 -2.784 -9.190 -18.867 1.00 25.23 H new ATOM 0 HD2 ARG A 39 -1.607 -9.398 -16.066 1.00 12.21 H new ATOM 0 HD3 ARG A 39 -0.958 -8.471 -17.404 1.00 12.21 H new ATOM 0 HE ARG A 39 -3.135 -7.116 -17.277 1.00 64.14 H new ATOM 0 HH11 ARG A 39 -1.823 -8.839 -14.472 1.00 72.51 H new ATOM 0 HH12 ARG A 39 -2.532 -7.715 -13.308 1.00 72.51 H new ATOM 0 HH21 ARG A 39 -4.041 -5.687 -15.776 1.00 72.23 H new ATOM 0 HH22 ARG A 39 -3.785 -5.934 -14.045 1.00 72.23 H new ATOM 605 N THR A 40 -6.982 -10.938 -18.012 1.00 21.32 N ATOM 606 CA THR A 40 -8.316 -10.972 -17.412 1.00 31.44 C ATOM 607 C THR A 40 -9.005 -12.331 -17.586 1.00 32.23 C ATOM 608 O THR A 40 -9.361 -12.719 -18.702 1.00 70.14 O ATOM 609 CB THR A 40 -9.214 -9.865 -18.002 1.00 25.32 C ATOM 610 OG1 THR A 40 -9.149 -9.904 -19.436 1.00 2.42 O ATOM 611 CG2 THR A 40 -8.794 -8.484 -17.506 1.00 5.33 C ATOM 0 H THR A 40 -6.908 -10.338 -18.833 1.00 21.32 H new ATOM 0 HA THR A 40 -8.175 -10.801 -16.345 1.00 31.44 H new ATOM 0 HB THR A 40 -10.237 -10.046 -17.672 1.00 25.32 H new ATOM 0 HG1 THR A 40 -9.224 -10.832 -19.742 1.00 2.42 H new ATOM 0 HG21 THR A 40 -9.447 -7.727 -17.941 1.00 5.33 H new ATOM 0 HG22 THR A 40 -8.871 -8.449 -16.419 1.00 5.33 H new ATOM 0 HG23 THR A 40 -7.764 -8.288 -17.803 1.00 5.33 H new ATOM 619 N LEU A 41 -9.201 -13.040 -16.473 1.00 51.33 N ATOM 620 CA LEU A 41 -9.920 -14.313 -16.479 1.00 34.14 C ATOM 621 C LEU A 41 -11.428 -14.088 -16.457 1.00 43.22 C ATOM 622 O LEU A 41 -12.016 -13.839 -15.402 1.00 22.33 O ATOM 623 CB LEU A 41 -9.520 -15.201 -15.284 1.00 61.14 C ATOM 624 CG LEU A 41 -8.225 -16.011 -15.452 1.00 40.42 C ATOM 625 CD1 LEU A 41 -7.016 -15.094 -15.570 1.00 4.32 C ATOM 626 CD2 LEU A 41 -8.055 -16.994 -14.298 1.00 50.44 C ATOM 0 H LEU A 41 -8.870 -12.752 -15.552 1.00 51.33 H new ATOM 0 HA LEU A 41 -9.644 -14.826 -17.400 1.00 34.14 H new ATOM 0 HB2 LEU A 41 -9.417 -14.567 -14.404 1.00 61.14 H new ATOM 0 HB3 LEU A 41 -10.336 -15.895 -15.083 1.00 61.14 H new ATOM 0 HG LEU A 41 -8.299 -16.581 -16.378 1.00 40.42 H new ATOM 0 HD11 LEU A 41 -6.114 -15.695 -15.688 1.00 4.32 H new ATOM 0 HD12 LEU A 41 -7.135 -14.444 -16.437 1.00 4.32 H new ATOM 0 HD13 LEU A 41 -6.932 -14.485 -14.670 1.00 4.32 H new ATOM 0 HD21 LEU A 41 -7.133 -17.559 -14.434 1.00 50.44 H new ATOM 0 HD22 LEU A 41 -8.010 -16.446 -13.357 1.00 50.44 H new ATOM 0 HD23 LEU A 41 -8.901 -17.681 -14.277 1.00 50.44 H new ATOM 638 N THR A 42 -12.038 -14.143 -17.629 1.00 31.45 N ATOM 639 CA THR A 42 -13.489 -14.160 -17.743 1.00 23.21 C ATOM 640 C THR A 42 -13.991 -15.580 -17.469 1.00 63.23 C ATOM 641 O THR A 42 -13.181 -16.497 -17.279 1.00 44.05 O ATOM 642 CB THR A 42 -13.954 -13.683 -19.142 1.00 20.41 C ATOM 643 OG1 THR A 42 -15.387 -13.613 -19.204 1.00 73.40 O ATOM 644 CG2 THR A 42 -13.440 -14.616 -20.230 1.00 34.51 C ATOM 0 H THR A 42 -11.547 -14.177 -18.523 1.00 31.45 H new ATOM 0 HA THR A 42 -13.908 -13.470 -17.010 1.00 23.21 H new ATOM 0 HB THR A 42 -13.543 -12.687 -19.308 1.00 20.41 H new ATOM 0 HG1 THR A 42 -15.734 -14.411 -19.655 1.00 73.40 H new ATOM 0 HG21 THR A 42 -13.779 -14.261 -21.203 1.00 34.51 H new ATOM 0 HG22 THR A 42 -12.350 -14.634 -20.209 1.00 34.51 H new ATOM 0 HG23 THR A 42 -13.822 -15.622 -20.057 1.00 34.51 H new ATOM 652 N GLU A 43 -15.310 -15.769 -17.488 1.00 15.15 N ATOM 653 CA GLU A 43 -15.926 -17.052 -17.131 1.00 71.31 C ATOM 654 C GLU A 43 -15.274 -18.211 -17.886 1.00 12.12 C ATOM 655 O GLU A 43 -14.959 -19.243 -17.295 1.00 32.21 O ATOM 656 CB GLU A 43 -17.434 -17.022 -17.456 1.00 43.41 C ATOM 657 CG GLU A 43 -18.345 -16.913 -16.238 1.00 4.44 C ATOM 658 CD GLU A 43 -18.078 -15.674 -15.399 1.00 44.01 C ATOM 659 OE1 GLU A 43 -18.197 -14.550 -15.935 1.00 20.13 O ATOM 660 OE2 GLU A 43 -17.756 -15.820 -14.202 1.00 43.34 O ATOM 0 H GLU A 43 -15.979 -15.045 -17.749 1.00 15.15 H new ATOM 0 HA GLU A 43 -15.778 -17.205 -16.062 1.00 71.31 H new ATOM 0 HB2 GLU A 43 -17.633 -16.179 -18.118 1.00 43.41 H new ATOM 0 HB3 GLU A 43 -17.692 -17.927 -18.006 1.00 43.41 H new ATOM 0 HG2 GLU A 43 -19.383 -16.903 -16.569 1.00 4.44 H new ATOM 0 HG3 GLU A 43 -18.217 -17.799 -15.616 1.00 4.44 H new ATOM 667 N GLU A 44 -15.018 -18.009 -19.171 1.00 24.15 N ATOM 668 CA GLU A 44 -14.545 -19.077 -20.039 1.00 42.15 C ATOM 669 C GLU A 44 -13.132 -19.499 -19.625 1.00 51.42 C ATOM 670 O GLU A 44 -12.810 -20.695 -19.529 1.00 31.32 O ATOM 671 CB GLU A 44 -14.575 -18.613 -21.508 1.00 42.11 C ATOM 672 CG GLU A 44 -15.913 -17.995 -21.946 1.00 54.42 C ATOM 673 CD GLU A 44 -15.985 -16.481 -21.739 1.00 75.51 C ATOM 674 OE1 GLU A 44 -16.309 -16.038 -20.616 1.00 0.14 O ATOM 675 OE2 GLU A 44 -15.718 -15.725 -22.702 1.00 13.55 O ATOM 0 H GLU A 44 -15.131 -17.109 -19.637 1.00 24.15 H new ATOM 0 HA GLU A 44 -15.202 -19.941 -19.940 1.00 42.15 H new ATOM 0 HB2 GLU A 44 -13.782 -17.882 -21.663 1.00 42.11 H new ATOM 0 HB3 GLU A 44 -14.353 -19.465 -22.151 1.00 42.11 H new ATOM 0 HG2 GLU A 44 -16.079 -18.217 -23.000 1.00 54.42 H new ATOM 0 HG3 GLU A 44 -16.722 -18.468 -21.389 1.00 54.42 H new ATOM 682 N GLN A 45 -12.311 -18.499 -19.336 1.00 31.04 N ATOM 683 CA GLN A 45 -10.934 -18.720 -18.912 1.00 14.15 C ATOM 684 C GLN A 45 -10.907 -19.355 -17.529 1.00 53.01 C ATOM 685 O GLN A 45 -10.028 -20.156 -17.221 1.00 14.13 O ATOM 686 CB GLN A 45 -10.178 -17.392 -18.903 1.00 51.21 C ATOM 687 CG GLN A 45 -10.238 -16.662 -20.235 1.00 30.54 C ATOM 688 CD GLN A 45 -9.644 -17.476 -21.375 1.00 41.25 C ATOM 689 OE1 GLN A 45 -10.355 -18.196 -22.076 1.00 64.40 O ATOM 690 NE2 GLN A 45 -8.335 -17.384 -21.551 1.00 1.34 N ATOM 0 H GLN A 45 -12.578 -17.516 -19.388 1.00 31.04 H new ATOM 0 HA GLN A 45 -10.448 -19.398 -19.613 1.00 14.15 H new ATOM 0 HB2 GLN A 45 -10.592 -16.750 -18.125 1.00 51.21 H new ATOM 0 HB3 GLN A 45 -9.136 -17.576 -18.643 1.00 51.21 H new ATOM 0 HG2 GLN A 45 -11.276 -16.422 -20.467 1.00 30.54 H new ATOM 0 HG3 GLN A 45 -9.703 -15.716 -20.151 1.00 30.54 H new ATOM 0 HE21 GLN A 45 -7.781 -16.776 -20.948 1.00 1.34 H new ATOM 0 HE22 GLN A 45 -7.881 -17.922 -22.289 1.00 1.34 H new ATOM 699 N VAL A 46 -11.891 -19.007 -16.704 1.00 64.44 N ATOM 700 CA VAL A 46 -12.016 -19.597 -15.378 1.00 2.55 C ATOM 701 C VAL A 46 -12.315 -21.084 -15.523 1.00 12.42 C ATOM 702 O VAL A 46 -11.721 -21.920 -14.843 1.00 73.15 O ATOM 703 CB VAL A 46 -13.127 -18.908 -14.541 1.00 31.43 C ATOM 704 CG1 VAL A 46 -13.306 -19.608 -13.198 1.00 64.04 C ATOM 705 CG2 VAL A 46 -12.811 -17.425 -14.335 1.00 15.10 C ATOM 0 H VAL A 46 -12.611 -18.321 -16.931 1.00 64.44 H new ATOM 0 HA VAL A 46 -11.075 -19.452 -14.847 1.00 2.55 H new ATOM 0 HB VAL A 46 -14.063 -18.985 -15.095 1.00 31.43 H new ATOM 0 HG11 VAL A 46 -14.090 -19.108 -12.629 1.00 64.04 H new ATOM 0 HG12 VAL A 46 -13.586 -20.648 -13.364 1.00 64.04 H new ATOM 0 HG13 VAL A 46 -12.371 -19.569 -12.640 1.00 64.04 H new ATOM 0 HG21 VAL A 46 -13.603 -16.963 -13.746 1.00 15.10 H new ATOM 0 HG22 VAL A 46 -11.862 -17.325 -13.809 1.00 15.10 H new ATOM 0 HG23 VAL A 46 -12.743 -16.930 -15.304 1.00 15.10 H new ATOM 715 N GLN A 47 -13.214 -21.400 -16.450 1.00 74.22 N ATOM 716 CA GLN A 47 -13.549 -22.784 -16.763 1.00 73.34 C ATOM 717 C GLN A 47 -12.306 -23.527 -17.234 1.00 25.01 C ATOM 718 O GLN A 47 -12.095 -24.679 -16.875 1.00 54.32 O ATOM 719 CB GLN A 47 -14.625 -22.843 -17.852 1.00 71.34 C ATOM 720 CG GLN A 47 -15.895 -22.076 -17.512 1.00 23.23 C ATOM 721 CD GLN A 47 -16.720 -22.712 -16.406 1.00 21.44 C ATOM 722 OE1 GLN A 47 -16.196 -23.351 -15.495 1.00 4.54 O ATOM 723 NE2 GLN A 47 -18.026 -22.524 -16.471 1.00 3.44 N ATOM 0 H GLN A 47 -13.726 -20.711 -17.000 1.00 74.22 H new ATOM 0 HA GLN A 47 -13.934 -23.258 -15.860 1.00 73.34 H new ATOM 0 HB2 GLN A 47 -14.211 -22.446 -18.779 1.00 71.34 H new ATOM 0 HB3 GLN A 47 -14.882 -23.886 -18.038 1.00 71.34 H new ATOM 0 HG2 GLN A 47 -15.627 -21.062 -17.215 1.00 23.23 H new ATOM 0 HG3 GLN A 47 -16.509 -21.994 -18.409 1.00 23.23 H new ATOM 0 HE21 GLN A 47 -18.426 -21.988 -17.241 1.00 3.44 H new ATOM 0 HE22 GLN A 47 -18.634 -22.914 -15.751 1.00 3.44 H new ATOM 732 N GLU A 48 -11.491 -22.849 -18.041 1.00 35.04 N ATOM 733 CA GLU A 48 -10.224 -23.403 -18.508 1.00 64.51 C ATOM 734 C GLU A 48 -9.311 -23.756 -17.322 1.00 55.04 C ATOM 735 O GLU A 48 -8.822 -24.898 -17.207 1.00 73.40 O ATOM 736 CB GLU A 48 -9.548 -22.397 -19.456 1.00 43.20 C ATOM 737 CG GLU A 48 -8.038 -22.320 -19.311 1.00 42.23 C ATOM 738 CD GLU A 48 -7.380 -21.445 -20.362 1.00 41.42 C ATOM 739 OE1 GLU A 48 -7.339 -21.867 -21.540 1.00 51.14 O ATOM 740 OE2 GLU A 48 -6.869 -20.363 -20.015 1.00 52.21 O ATOM 0 H GLU A 48 -11.689 -21.910 -18.386 1.00 35.04 H new ATOM 0 HA GLU A 48 -10.414 -24.327 -19.054 1.00 64.51 H new ATOM 0 HB2 GLU A 48 -9.789 -22.666 -20.484 1.00 43.20 H new ATOM 0 HB3 GLU A 48 -9.969 -21.408 -19.278 1.00 43.20 H new ATOM 0 HG2 GLU A 48 -7.794 -21.934 -18.321 1.00 42.23 H new ATOM 0 HG3 GLU A 48 -7.622 -23.326 -19.372 1.00 42.23 H new ATOM 747 N VAL A 49 -9.101 -22.778 -16.438 1.00 34.21 N ATOM 748 CA VAL A 49 -8.273 -22.968 -15.251 1.00 32.22 C ATOM 749 C VAL A 49 -8.727 -24.196 -14.481 1.00 34.13 C ATOM 750 O VAL A 49 -7.940 -25.091 -14.208 1.00 25.13 O ATOM 751 CB VAL A 49 -8.320 -21.738 -14.307 1.00 3.23 C ATOM 752 CG1 VAL A 49 -7.507 -21.988 -13.038 1.00 62.33 C ATOM 753 CG2 VAL A 49 -7.816 -20.493 -15.023 1.00 71.11 C ATOM 0 H VAL A 49 -9.497 -21.842 -16.525 1.00 34.21 H new ATOM 0 HA VAL A 49 -7.248 -23.099 -15.597 1.00 32.22 H new ATOM 0 HB VAL A 49 -9.359 -21.577 -14.018 1.00 3.23 H new ATOM 0 HG11 VAL A 49 -7.557 -21.110 -12.395 1.00 62.33 H new ATOM 0 HG12 VAL A 49 -7.914 -22.849 -12.509 1.00 62.33 H new ATOM 0 HG13 VAL A 49 -6.468 -22.184 -13.304 1.00 62.33 H new ATOM 0 HG21 VAL A 49 -7.857 -19.641 -14.344 1.00 71.11 H new ATOM 0 HG22 VAL A 49 -6.787 -20.651 -15.346 1.00 71.11 H new ATOM 0 HG23 VAL A 49 -8.443 -20.294 -15.892 1.00 71.11 H new ATOM 763 N VAL A 50 -10.010 -24.228 -14.160 1.00 60.22 N ATOM 764 CA VAL A 50 -10.607 -25.335 -13.425 1.00 11.40 C ATOM 765 C VAL A 50 -10.518 -26.636 -14.223 1.00 72.34 C ATOM 766 O VAL A 50 -10.310 -27.707 -13.654 1.00 53.42 O ATOM 767 CB VAL A 50 -12.085 -25.028 -13.082 1.00 41.25 C ATOM 768 CG1 VAL A 50 -12.660 -26.082 -12.149 1.00 15.52 C ATOM 769 CG2 VAL A 50 -12.204 -23.627 -12.487 1.00 15.52 C ATOM 0 H VAL A 50 -10.669 -23.488 -14.401 1.00 60.22 H new ATOM 0 HA VAL A 50 -10.047 -25.458 -12.498 1.00 11.40 H new ATOM 0 HB VAL A 50 -12.671 -25.059 -14.001 1.00 41.25 H new ATOM 0 HG11 VAL A 50 -13.699 -25.841 -11.925 1.00 15.52 H new ATOM 0 HG12 VAL A 50 -12.609 -27.059 -12.629 1.00 15.52 H new ATOM 0 HG13 VAL A 50 -12.084 -26.102 -11.224 1.00 15.52 H new ATOM 0 HG21 VAL A 50 -13.247 -23.420 -12.249 1.00 15.52 H new ATOM 0 HG22 VAL A 50 -11.605 -23.566 -11.578 1.00 15.52 H new ATOM 0 HG23 VAL A 50 -11.844 -22.893 -13.209 1.00 15.52 H new ATOM 779 N ALA A 51 -10.654 -26.530 -15.543 1.00 31.45 N ATOM 780 CA ALA A 51 -10.598 -27.690 -16.428 1.00 42.34 C ATOM 781 C ALA A 51 -9.274 -28.425 -16.266 1.00 31.41 C ATOM 782 O ALA A 51 -9.246 -29.647 -16.111 1.00 25.24 O ATOM 783 CB ALA A 51 -10.805 -27.275 -17.881 1.00 44.10 C ATOM 0 H ALA A 51 -10.805 -25.644 -16.026 1.00 31.45 H new ATOM 0 HA ALA A 51 -11.405 -28.368 -16.149 1.00 42.34 H new ATOM 0 HB1 ALA A 51 -10.759 -28.156 -18.521 1.00 44.10 H new ATOM 0 HB2 ALA A 51 -11.780 -26.799 -17.988 1.00 44.10 H new ATOM 0 HB3 ALA A 51 -10.024 -26.573 -18.174 1.00 44.10 H new ATOM 789 N LYS A 52 -8.176 -27.675 -16.296 1.00 53.45 N ATOM 790 CA LYS A 52 -6.855 -28.270 -16.078 1.00 42.14 C ATOM 791 C LYS A 52 -6.634 -28.551 -14.580 1.00 3.33 C ATOM 792 O LYS A 52 -6.085 -29.592 -14.199 1.00 33.40 O ATOM 793 CB LYS A 52 -5.748 -27.362 -16.651 1.00 40.33 C ATOM 794 CG LYS A 52 -5.683 -25.966 -16.030 1.00 30.34 C ATOM 795 CD LYS A 52 -4.639 -25.072 -16.707 1.00 44.14 C ATOM 796 CE LYS A 52 -5.052 -24.688 -18.125 1.00 31.32 C ATOM 797 NZ LYS A 52 -4.025 -23.857 -18.809 1.00 11.24 N ATOM 0 H LYS A 52 -8.170 -26.669 -16.466 1.00 53.45 H new ATOM 0 HA LYS A 52 -6.808 -29.221 -16.608 1.00 42.14 H new ATOM 0 HB2 LYS A 52 -4.785 -27.853 -16.510 1.00 40.33 H new ATOM 0 HB3 LYS A 52 -5.900 -27.260 -17.726 1.00 40.33 H new ATOM 0 HG2 LYS A 52 -6.663 -25.494 -16.102 1.00 30.34 H new ATOM 0 HG3 LYS A 52 -5.449 -26.054 -14.969 1.00 30.34 H new ATOM 0 HD2 LYS A 52 -4.495 -24.169 -16.114 1.00 44.14 H new ATOM 0 HD3 LYS A 52 -3.681 -25.591 -16.736 1.00 44.14 H new ATOM 0 HE2 LYS A 52 -5.230 -25.593 -18.706 1.00 31.32 H new ATOM 0 HE3 LYS A 52 -5.994 -24.141 -18.091 1.00 31.32 H new ATOM 0 HZ1 LYS A 52 -4.494 -23.175 -19.439 1.00 11.24 H new ATOM 0 HZ2 LYS A 52 -3.464 -23.344 -18.099 1.00 11.24 H new ATOM 0 HZ3 LYS A 52 -3.398 -24.470 -19.368 1.00 11.24 H new ATOM 811 N LEU A 53 -7.120 -27.636 -13.742 1.00 5.45 N ATOM 812 CA LEU A 53 -6.955 -27.711 -12.284 1.00 72.44 C ATOM 813 C LEU A 53 -7.564 -29.002 -11.735 1.00 43.14 C ATOM 814 O LEU A 53 -7.086 -29.558 -10.748 1.00 30.51 O ATOM 815 CB LEU A 53 -7.614 -26.469 -11.642 1.00 61.32 C ATOM 816 CG LEU A 53 -7.310 -26.175 -10.155 1.00 62.23 C ATOM 817 CD1 LEU A 53 -8.080 -27.104 -9.216 1.00 3.31 C ATOM 818 CD2 LEU A 53 -5.812 -26.263 -9.879 1.00 15.34 C ATOM 0 H LEU A 53 -7.642 -26.817 -14.053 1.00 5.45 H new ATOM 0 HA LEU A 53 -5.893 -27.723 -12.037 1.00 72.44 H new ATOM 0 HB2 LEU A 53 -7.318 -25.596 -12.223 1.00 61.32 H new ATOM 0 HB3 LEU A 53 -8.694 -26.571 -11.749 1.00 61.32 H new ATOM 0 HG LEU A 53 -7.645 -25.157 -9.956 1.00 62.23 H new ATOM 0 HD11 LEU A 53 -7.835 -26.861 -8.182 1.00 3.31 H new ATOM 0 HD12 LEU A 53 -9.151 -26.976 -9.375 1.00 3.31 H new ATOM 0 HD13 LEU A 53 -7.804 -28.138 -9.421 1.00 3.31 H new ATOM 0 HD21 LEU A 53 -5.623 -26.052 -8.826 1.00 15.34 H new ATOM 0 HD22 LEU A 53 -5.456 -27.265 -10.118 1.00 15.34 H new ATOM 0 HD23 LEU A 53 -5.285 -25.534 -10.495 1.00 15.34 H new ATOM 830 N THR A 54 -8.598 -29.496 -12.407 1.00 2.31 N ATOM 831 CA THR A 54 -9.308 -30.680 -11.941 1.00 74.25 C ATOM 832 C THR A 54 -8.521 -31.962 -12.217 1.00 12.24 C ATOM 833 O THR A 54 -9.040 -33.062 -12.014 1.00 11.50 O ATOM 834 CB THR A 54 -10.726 -30.786 -12.564 1.00 54.25 C ATOM 835 OG1 THR A 54 -10.676 -30.513 -13.972 1.00 2.43 O ATOM 836 CG2 THR A 54 -11.694 -29.819 -11.889 1.00 33.32 C ATOM 0 H THR A 54 -8.962 -29.097 -13.272 1.00 2.31 H new ATOM 0 HA THR A 54 -9.414 -30.568 -10.862 1.00 74.25 H new ATOM 0 HB THR A 54 -11.084 -31.804 -12.407 1.00 54.25 H new ATOM 0 HG1 THR A 54 -10.646 -29.544 -14.117 1.00 2.43 H new ATOM 0 HG21 THR A 54 -12.680 -29.914 -12.344 1.00 33.32 H new ATOM 0 HG22 THR A 54 -11.761 -30.054 -10.827 1.00 33.32 H new ATOM 0 HG23 THR A 54 -11.334 -28.798 -12.013 1.00 33.32 H new ATOM 844 N ASP A 55 -7.275 -31.831 -12.682 1.00 13.25 N ATOM 845 CA ASP A 55 -6.378 -32.984 -12.761 1.00 1.54 C ATOM 846 C ASP A 55 -5.456 -32.999 -11.540 1.00 20.51 C ATOM 847 O ASP A 55 -4.400 -32.359 -11.538 1.00 75.23 O ATOM 848 CB ASP A 55 -5.544 -32.972 -14.051 1.00 3.22 C ATOM 849 CG ASP A 55 -4.838 -34.302 -14.281 1.00 40.30 C ATOM 850 OD1 ASP A 55 -5.478 -35.230 -14.819 1.00 74.12 O ATOM 851 OD2 ASP A 55 -3.648 -34.435 -13.918 1.00 52.23 O ATOM 0 H ASP A 55 -6.871 -30.952 -13.004 1.00 13.25 H new ATOM 0 HA ASP A 55 -6.989 -33.886 -12.775 1.00 1.54 H new ATOM 0 HB2 ASP A 55 -6.191 -32.753 -14.900 1.00 3.22 H new ATOM 0 HB3 ASP A 55 -4.805 -32.173 -13.999 1.00 3.22 H new ATOM 856 N PRO A 56 -5.847 -33.727 -10.472 1.00 62.43 N ATOM 857 CA PRO A 56 -5.114 -33.716 -9.199 1.00 43.13 C ATOM 858 C PRO A 56 -3.727 -34.336 -9.335 1.00 2.34 C ATOM 859 O PRO A 56 -2.815 -34.022 -8.569 1.00 53.10 O ATOM 860 CB PRO A 56 -6.002 -34.553 -8.265 1.00 74.10 C ATOM 861 CG PRO A 56 -6.784 -35.436 -9.179 1.00 74.41 C ATOM 862 CD PRO A 56 -7.018 -34.629 -10.426 1.00 55.11 C ATOM 0 HA PRO A 56 -4.937 -32.705 -8.832 1.00 43.13 H new ATOM 0 HB2 PRO A 56 -5.403 -35.137 -7.567 1.00 74.10 H new ATOM 0 HB3 PRO A 56 -6.658 -33.919 -7.669 1.00 74.10 H new ATOM 0 HG2 PRO A 56 -6.236 -36.351 -9.402 1.00 74.41 H new ATOM 0 HG3 PRO A 56 -7.728 -35.733 -8.723 1.00 74.41 H new ATOM 0 HD2 PRO A 56 -7.073 -35.263 -11.311 1.00 55.11 H new ATOM 0 HD3 PRO A 56 -7.953 -34.072 -10.375 1.00 55.11 H new ATOM 870 N GLU A 57 -3.576 -35.199 -10.333 1.00 53.21 N ATOM 871 CA GLU A 57 -2.316 -35.884 -10.574 1.00 31.20 C ATOM 872 C GLU A 57 -1.235 -34.867 -10.929 1.00 11.32 C ATOM 873 O GLU A 57 -0.158 -34.852 -10.328 1.00 40.10 O ATOM 874 CB GLU A 57 -2.476 -36.919 -11.698 1.00 11.23 C ATOM 875 CG GLU A 57 -1.299 -37.880 -11.820 1.00 74.52 C ATOM 876 CD GLU A 57 -1.034 -38.638 -10.529 1.00 43.42 C ATOM 877 OE1 GLU A 57 -1.901 -39.441 -10.115 1.00 15.41 O ATOM 878 OE2 GLU A 57 0.031 -38.421 -9.909 1.00 10.41 O ATOM 0 H GLU A 57 -4.317 -35.441 -10.991 1.00 53.21 H new ATOM 0 HA GLU A 57 -2.018 -36.411 -9.667 1.00 31.20 H new ATOM 0 HB2 GLU A 57 -3.386 -37.493 -11.524 1.00 11.23 H new ATOM 0 HB3 GLU A 57 -2.606 -36.396 -12.645 1.00 11.23 H new ATOM 0 HG2 GLU A 57 -1.496 -38.591 -12.622 1.00 74.52 H new ATOM 0 HG3 GLU A 57 -0.406 -37.322 -12.101 1.00 74.52 H new ATOM 885 N SER A 58 -1.539 -34.007 -11.898 1.00 43.04 N ATOM 886 CA SER A 58 -0.620 -32.953 -12.304 1.00 14.11 C ATOM 887 C SER A 58 -0.480 -31.906 -11.200 1.00 64.34 C ATOM 888 O SER A 58 0.632 -31.539 -10.823 1.00 15.34 O ATOM 889 CB SER A 58 -1.102 -32.295 -13.603 1.00 53.34 C ATOM 890 OG SER A 58 -1.183 -33.247 -14.654 1.00 0.11 O ATOM 0 H SER A 58 -2.417 -34.022 -12.416 1.00 43.04 H new ATOM 0 HA SER A 58 0.358 -33.400 -12.481 1.00 14.11 H new ATOM 0 HB2 SER A 58 -2.079 -31.839 -13.444 1.00 53.34 H new ATOM 0 HB3 SER A 58 -0.419 -31.494 -13.885 1.00 53.34 H new ATOM 0 HG SER A 58 -1.997 -33.783 -14.548 1.00 0.11 H new ATOM 896 N SER A 59 -1.615 -31.450 -10.669 1.00 11.31 N ATOM 897 CA SER A 59 -1.633 -30.383 -9.672 1.00 64.13 C ATOM 898 C SER A 59 -0.737 -30.726 -8.470 1.00 74.10 C ATOM 899 O SER A 59 0.147 -29.947 -8.098 1.00 53.43 O ATOM 900 CB SER A 59 -3.072 -30.117 -9.216 1.00 5.10 C ATOM 901 OG SER A 59 -3.133 -29.018 -8.329 1.00 31.55 O ATOM 0 H SER A 59 -2.538 -31.807 -10.916 1.00 11.31 H new ATOM 0 HA SER A 59 -1.234 -29.479 -10.132 1.00 64.13 H new ATOM 0 HB2 SER A 59 -3.701 -29.922 -10.084 1.00 5.10 H new ATOM 0 HB3 SER A 59 -3.471 -31.005 -8.726 1.00 5.10 H new ATOM 0 HG SER A 59 -4.008 -29.002 -7.887 1.00 31.55 H new ATOM 907 N ALA A 60 -0.932 -31.912 -7.896 1.00 52.35 N ATOM 908 CA ALA A 60 -0.164 -32.340 -6.724 1.00 44.05 C ATOM 909 C ALA A 60 1.318 -32.523 -7.061 1.00 65.01 C ATOM 910 O ALA A 60 2.155 -32.692 -6.172 1.00 55.43 O ATOM 911 CB ALA A 60 -0.745 -33.629 -6.152 1.00 33.33 C ATOM 0 H ALA A 60 -1.615 -32.595 -8.222 1.00 52.35 H new ATOM 0 HA ALA A 60 -0.238 -31.555 -5.971 1.00 44.05 H new ATOM 0 HB1 ALA A 60 -0.164 -33.935 -5.282 1.00 33.33 H new ATOM 0 HB2 ALA A 60 -1.781 -33.462 -5.857 1.00 33.33 H new ATOM 0 HB3 ALA A 60 -0.706 -34.413 -6.908 1.00 33.33 H new ATOM 917 N GLN A 61 1.632 -32.493 -8.350 1.00 51.35 N ATOM 918 CA GLN A 61 3.000 -32.661 -8.827 1.00 31.01 C ATOM 919 C GLN A 61 3.662 -31.296 -9.052 1.00 42.21 C ATOM 920 O GLN A 61 4.887 -31.178 -9.002 1.00 61.11 O ATOM 921 CB GLN A 61 2.989 -33.479 -10.130 1.00 62.35 C ATOM 922 CG GLN A 61 4.368 -33.872 -10.650 1.00 12.53 C ATOM 923 CD GLN A 61 5.149 -34.724 -9.663 1.00 33.44 C ATOM 924 OE1 GLN A 61 5.929 -34.214 -8.860 1.00 35.13 O ATOM 925 NE2 GLN A 61 4.936 -36.030 -9.705 1.00 62.21 N ATOM 0 H GLN A 61 0.948 -32.352 -9.093 1.00 51.35 H new ATOM 0 HA GLN A 61 3.580 -33.196 -8.074 1.00 31.01 H new ATOM 0 HB2 GLN A 61 2.405 -34.385 -9.969 1.00 62.35 H new ATOM 0 HB3 GLN A 61 2.476 -32.903 -10.900 1.00 62.35 H new ATOM 0 HG2 GLN A 61 4.256 -34.419 -11.586 1.00 12.53 H new ATOM 0 HG3 GLN A 61 4.937 -32.970 -10.874 1.00 12.53 H new ATOM 0 HE21 GLN A 61 4.282 -36.418 -10.384 1.00 62.21 H new ATOM 0 HE22 GLN A 61 5.426 -36.648 -9.058 1.00 62.21 H new ATOM 934 N ILE A 62 2.839 -30.263 -9.266 1.00 4.23 N ATOM 935 CA ILE A 62 3.343 -28.927 -9.596 1.00 32.12 C ATOM 936 C ILE A 62 4.194 -28.360 -8.458 1.00 0.54 C ATOM 937 O ILE A 62 5.311 -27.889 -8.677 1.00 12.44 O ATOM 938 CB ILE A 62 2.192 -27.924 -9.882 1.00 60.44 C ATOM 939 CG1 ILE A 62 1.164 -28.514 -10.860 1.00 42.11 C ATOM 940 CG2 ILE A 62 2.750 -26.610 -10.424 1.00 4.10 C ATOM 941 CD1 ILE A 62 1.734 -28.922 -12.200 1.00 43.34 C ATOM 0 H ILE A 62 1.822 -30.327 -9.216 1.00 4.23 H new ATOM 0 HA ILE A 62 3.948 -29.047 -10.495 1.00 32.12 H new ATOM 0 HB ILE A 62 1.681 -27.726 -8.940 1.00 60.44 H new ATOM 0 HG12 ILE A 62 0.699 -29.385 -10.397 1.00 42.11 H new ATOM 0 HG13 ILE A 62 0.375 -27.780 -11.024 1.00 42.11 H new ATOM 0 HG21 ILE A 62 1.930 -25.919 -10.619 1.00 4.10 H new ATOM 0 HG22 ILE A 62 3.427 -26.172 -9.690 1.00 4.10 H new ATOM 0 HG23 ILE A 62 3.292 -26.800 -11.350 1.00 4.10 H new ATOM 0 HD11 ILE A 62 0.939 -29.327 -12.826 1.00 43.34 H new ATOM 0 HD12 ILE A 62 2.173 -28.052 -12.689 1.00 43.34 H new ATOM 0 HD13 ILE A 62 2.502 -29.681 -12.053 1.00 43.34 H new ATOM 953 N ASP A 63 3.646 -28.406 -7.249 1.00 4.21 N ATOM 954 CA ASP A 63 4.325 -27.874 -6.065 1.00 24.12 C ATOM 955 C ASP A 63 4.783 -29.003 -5.152 1.00 32.11 C ATOM 956 O ASP A 63 5.403 -28.763 -4.114 1.00 51.03 O ATOM 957 CB ASP A 63 3.397 -26.927 -5.286 1.00 63.41 C ATOM 958 CG ASP A 63 3.090 -25.641 -6.041 1.00 3.22 C ATOM 959 OD1 ASP A 63 2.195 -25.651 -6.911 1.00 1.22 O ATOM 960 OD2 ASP A 63 3.747 -24.610 -5.766 1.00 51.45 O ATOM 0 H ASP A 63 2.728 -28.808 -7.059 1.00 4.21 H new ATOM 0 HA ASP A 63 5.198 -27.317 -6.405 1.00 24.12 H new ATOM 0 HB2 ASP A 63 2.463 -27.443 -5.064 1.00 63.41 H new ATOM 0 HB3 ASP A 63 3.859 -26.679 -4.330 1.00 63.41 H new ATOM 965 N GLY A 64 4.474 -30.236 -5.539 1.00 4.34 N ATOM 966 CA GLY A 64 4.795 -31.384 -4.706 1.00 4.15 C ATOM 967 C GLY A 64 3.861 -31.502 -3.516 1.00 21.32 C ATOM 968 O GLY A 64 4.055 -32.345 -2.638 1.00 74.55 O ATOM 0 H GLY A 64 4.006 -30.463 -6.416 1.00 4.34 H new ATOM 0 HA2 GLY A 64 4.737 -32.293 -5.304 1.00 4.15 H new ATOM 0 HA3 GLY A 64 5.823 -31.300 -4.353 1.00 4.15 H new ATOM 972 N VAL A 65 2.843 -30.650 -3.491 1.00 53.23 N ATOM 973 CA VAL A 65 1.857 -30.639 -2.420 1.00 5.12 C ATOM 974 C VAL A 65 0.532 -30.093 -2.943 1.00 22.24 C ATOM 975 O VAL A 65 0.509 -29.111 -3.687 1.00 34.45 O ATOM 976 CB VAL A 65 2.338 -29.790 -1.211 1.00 20.52 C ATOM 977 CG1 VAL A 65 2.643 -28.351 -1.629 1.00 63.22 C ATOM 978 CG2 VAL A 65 1.311 -29.824 -0.078 1.00 11.54 C ATOM 0 H VAL A 65 2.679 -29.948 -4.213 1.00 53.23 H new ATOM 0 HA VAL A 65 1.722 -31.665 -2.077 1.00 5.12 H new ATOM 0 HB VAL A 65 3.264 -30.231 -0.843 1.00 20.52 H new ATOM 0 HG11 VAL A 65 2.977 -27.783 -0.761 1.00 63.22 H new ATOM 0 HG12 VAL A 65 3.427 -28.351 -2.386 1.00 63.22 H new ATOM 0 HG13 VAL A 65 1.743 -27.892 -2.038 1.00 63.22 H new ATOM 0 HG21 VAL A 65 1.670 -29.222 0.757 1.00 11.54 H new ATOM 0 HG22 VAL A 65 0.363 -29.421 -0.434 1.00 11.54 H new ATOM 0 HG23 VAL A 65 1.167 -30.853 0.252 1.00 11.54 H new ATOM 988 N VAL A 66 -0.562 -30.746 -2.578 1.00 30.32 N ATOM 989 CA VAL A 66 -1.889 -30.313 -3.000 1.00 1.42 C ATOM 990 C VAL A 66 -2.489 -29.339 -1.974 1.00 32.13 C ATOM 991 O VAL A 66 -2.974 -29.740 -0.908 1.00 51.15 O ATOM 992 CB VAL A 66 -2.829 -31.529 -3.247 1.00 14.41 C ATOM 993 CG1 VAL A 66 -2.885 -32.447 -2.030 1.00 5.23 C ATOM 994 CG2 VAL A 66 -4.228 -31.069 -3.651 1.00 34.45 C ATOM 0 H VAL A 66 -0.558 -31.579 -1.990 1.00 30.32 H new ATOM 0 HA VAL A 66 -1.789 -29.785 -3.948 1.00 1.42 H new ATOM 0 HB VAL A 66 -2.412 -32.103 -4.074 1.00 14.41 H new ATOM 0 HG11 VAL A 66 -3.550 -33.285 -2.237 1.00 5.23 H new ATOM 0 HG12 VAL A 66 -1.885 -32.822 -1.811 1.00 5.23 H new ATOM 0 HG13 VAL A 66 -3.260 -31.890 -1.171 1.00 5.23 H new ATOM 0 HG21 VAL A 66 -4.863 -31.939 -3.817 1.00 34.45 H new ATOM 0 HG22 VAL A 66 -4.653 -30.456 -2.856 1.00 34.45 H new ATOM 0 HG23 VAL A 66 -4.168 -30.483 -4.568 1.00 34.45 H new ATOM 1004 N SER A 67 -2.401 -28.052 -2.289 1.00 53.53 N ATOM 1005 CA SER A 67 -2.916 -26.984 -1.435 1.00 63.30 C ATOM 1006 C SER A 67 -3.453 -25.847 -2.305 1.00 25.11 C ATOM 1007 O SER A 67 -3.197 -25.825 -3.504 1.00 45.11 O ATOM 1008 CB SER A 67 -1.805 -26.475 -0.507 1.00 44.10 C ATOM 1009 OG SER A 67 -1.241 -27.539 0.249 1.00 1.41 O ATOM 0 H SER A 67 -1.968 -27.716 -3.149 1.00 53.53 H new ATOM 0 HA SER A 67 -3.729 -27.370 -0.820 1.00 63.30 H new ATOM 0 HB2 SER A 67 -1.027 -25.992 -1.098 1.00 44.10 H new ATOM 0 HB3 SER A 67 -2.208 -25.720 0.167 1.00 44.10 H new ATOM 0 HG SER A 67 -0.535 -27.188 0.831 1.00 1.41 H new ATOM 1015 N LYS A 68 -4.150 -24.884 -1.692 1.00 41.35 N ATOM 1016 CA LYS A 68 -4.820 -23.795 -2.426 1.00 53.40 C ATOM 1017 C LYS A 68 -3.906 -23.136 -3.471 1.00 61.41 C ATOM 1018 O LYS A 68 -4.388 -22.618 -4.484 1.00 72.23 O ATOM 1019 CB LYS A 68 -5.328 -22.723 -1.450 1.00 10.32 C ATOM 1020 CG LYS A 68 -6.117 -21.601 -2.130 1.00 71.13 C ATOM 1021 CD LYS A 68 -6.460 -20.462 -1.171 1.00 22.42 C ATOM 1022 CE LYS A 68 -5.208 -19.798 -0.610 1.00 22.41 C ATOM 1023 NZ LYS A 68 -5.527 -18.585 0.184 1.00 5.02 N ATOM 0 H LYS A 68 -4.268 -24.834 -0.680 1.00 41.35 H new ATOM 0 HA LYS A 68 -5.659 -24.248 -2.955 1.00 53.40 H new ATOM 0 HB2 LYS A 68 -5.960 -23.197 -0.699 1.00 10.32 H new ATOM 0 HB3 LYS A 68 -4.477 -22.290 -0.923 1.00 10.32 H new ATOM 0 HG2 LYS A 68 -5.536 -21.207 -2.964 1.00 71.13 H new ATOM 0 HG3 LYS A 68 -7.037 -22.010 -2.547 1.00 71.13 H new ATOM 0 HD2 LYS A 68 -7.064 -19.718 -1.691 1.00 22.42 H new ATOM 0 HD3 LYS A 68 -7.066 -20.847 -0.351 1.00 22.42 H new ATOM 0 HE2 LYS A 68 -4.671 -20.510 0.017 1.00 22.41 H new ATOM 0 HE3 LYS A 68 -4.542 -19.529 -1.430 1.00 22.41 H new ATOM 0 HZ1 LYS A 68 -4.647 -18.166 0.546 1.00 5.02 H new ATOM 0 HZ2 LYS A 68 -6.017 -17.894 -0.419 1.00 5.02 H new ATOM 0 HZ3 LYS A 68 -6.141 -18.844 0.982 1.00 5.02 H new ATOM 1037 N ASP A 69 -2.595 -23.158 -3.222 1.00 15.13 N ATOM 1038 CA ASP A 69 -1.613 -22.560 -4.135 1.00 73.13 C ATOM 1039 C ASP A 69 -1.789 -23.083 -5.561 1.00 2.11 C ATOM 1040 O ASP A 69 -1.442 -22.399 -6.527 1.00 71.50 O ATOM 1041 CB ASP A 69 -0.180 -22.835 -3.650 1.00 3.14 C ATOM 1042 CG ASP A 69 0.151 -22.127 -2.343 1.00 33.44 C ATOM 1043 OD1 ASP A 69 -0.244 -22.633 -1.268 1.00 3.03 O ATOM 1044 OD2 ASP A 69 0.810 -21.064 -2.377 1.00 53.11 O ATOM 0 H ASP A 69 -2.185 -23.585 -2.392 1.00 15.13 H new ATOM 0 HA ASP A 69 -1.785 -21.484 -4.140 1.00 73.13 H new ATOM 0 HB2 ASP A 69 -0.046 -23.909 -3.519 1.00 3.14 H new ATOM 0 HB3 ASP A 69 0.525 -22.517 -4.418 1.00 3.14 H new ATOM 1049 N GLU A 70 -2.329 -24.294 -5.684 1.00 14.54 N ATOM 1050 CA GLU A 70 -2.608 -24.889 -6.984 1.00 21.21 C ATOM 1051 C GLU A 70 -3.560 -23.996 -7.784 1.00 20.22 C ATOM 1052 O GLU A 70 -3.294 -23.667 -8.941 1.00 62.31 O ATOM 1053 CB GLU A 70 -3.199 -26.297 -6.805 1.00 43.43 C ATOM 1054 CG GLU A 70 -4.557 -26.325 -6.100 1.00 54.45 C ATOM 1055 CD GLU A 70 -5.033 -27.731 -5.764 1.00 72.43 C ATOM 1056 OE1 GLU A 70 -5.457 -28.459 -6.688 1.00 33.23 O ATOM 1057 OE2 GLU A 70 -4.991 -28.113 -4.572 1.00 53.25 O ATOM 0 H GLU A 70 -2.583 -24.884 -4.891 1.00 14.54 H new ATOM 0 HA GLU A 70 -1.675 -24.976 -7.541 1.00 21.21 H new ATOM 0 HB2 GLU A 70 -3.302 -26.762 -7.785 1.00 43.43 H new ATOM 0 HB3 GLU A 70 -2.495 -26.904 -6.236 1.00 43.43 H new ATOM 0 HG2 GLU A 70 -4.494 -25.741 -5.182 1.00 54.45 H new ATOM 0 HG3 GLU A 70 -5.298 -25.840 -6.735 1.00 54.45 H new ATOM 1064 N ILE A 71 -4.641 -23.564 -7.134 1.00 21.23 N ATOM 1065 CA ILE A 71 -5.651 -22.731 -7.774 1.00 21.42 C ATOM 1066 C ILE A 71 -5.018 -21.418 -8.220 1.00 5.33 C ATOM 1067 O ILE A 71 -5.103 -21.029 -9.387 1.00 63.22 O ATOM 1068 CB ILE A 71 -6.836 -22.441 -6.807 1.00 25.30 C ATOM 1069 CG1 ILE A 71 -7.598 -23.738 -6.458 1.00 51.32 C ATOM 1070 CG2 ILE A 71 -7.784 -21.401 -7.401 1.00 34.21 C ATOM 1071 CD1 ILE A 71 -8.695 -23.550 -5.425 1.00 41.44 C ATOM 0 H ILE A 71 -4.837 -23.781 -6.157 1.00 21.23 H new ATOM 0 HA ILE A 71 -6.042 -23.267 -8.639 1.00 21.42 H new ATOM 0 HB ILE A 71 -6.421 -22.035 -5.885 1.00 25.30 H new ATOM 0 HG12 ILE A 71 -8.037 -24.146 -7.369 1.00 51.32 H new ATOM 0 HG13 ILE A 71 -6.887 -24.477 -6.088 1.00 51.32 H new ATOM 0 HG21 ILE A 71 -8.603 -21.216 -6.706 1.00 34.21 H new ATOM 0 HG22 ILE A 71 -7.241 -20.472 -7.577 1.00 34.21 H new ATOM 0 HG23 ILE A 71 -8.185 -21.771 -8.344 1.00 34.21 H new ATOM 0 HD11 ILE A 71 -9.183 -24.506 -5.234 1.00 41.44 H new ATOM 0 HD12 ILE A 71 -8.262 -23.172 -4.499 1.00 41.44 H new ATOM 0 HD13 ILE A 71 -9.429 -22.837 -5.800 1.00 41.44 H new ATOM 1083 N GLU A 72 -4.353 -20.765 -7.273 1.00 15.22 N ATOM 1084 CA GLU A 72 -3.712 -19.472 -7.502 1.00 53.51 C ATOM 1085 C GLU A 72 -2.723 -19.541 -8.668 1.00 55.15 C ATOM 1086 O GLU A 72 -2.698 -18.661 -9.533 1.00 64.43 O ATOM 1087 CB GLU A 72 -2.982 -19.019 -6.228 1.00 52.51 C ATOM 1088 CG GLU A 72 -3.819 -19.165 -4.962 1.00 33.15 C ATOM 1089 CD GLU A 72 -3.117 -18.631 -3.724 1.00 43.24 C ATOM 1090 OE1 GLU A 72 -2.138 -19.255 -3.279 1.00 15.35 O ATOM 1091 OE2 GLU A 72 -3.541 -17.583 -3.188 1.00 52.10 O ATOM 0 H GLU A 72 -4.242 -21.117 -6.322 1.00 15.22 H new ATOM 0 HA GLU A 72 -4.488 -18.750 -7.757 1.00 53.51 H new ATOM 0 HB2 GLU A 72 -2.066 -19.600 -6.118 1.00 52.51 H new ATOM 0 HB3 GLU A 72 -2.686 -17.976 -6.340 1.00 52.51 H new ATOM 0 HG2 GLU A 72 -4.763 -18.637 -5.094 1.00 33.15 H new ATOM 0 HG3 GLU A 72 -4.060 -20.217 -4.811 1.00 33.15 H new ATOM 1098 N LYS A 73 -1.915 -20.597 -8.690 1.00 41.33 N ATOM 1099 CA LYS A 73 -0.890 -20.755 -9.717 1.00 45.24 C ATOM 1100 C LYS A 73 -1.523 -20.971 -11.091 1.00 24.45 C ATOM 1101 O LYS A 73 -1.126 -20.338 -12.071 1.00 4.23 O ATOM 1102 CB LYS A 73 0.042 -21.925 -9.376 1.00 73.41 C ATOM 1103 CG LYS A 73 1.195 -22.088 -10.363 1.00 61.01 C ATOM 1104 CD LYS A 73 2.144 -23.226 -9.985 1.00 25.10 C ATOM 1105 CE LYS A 73 2.928 -22.947 -8.702 1.00 44.05 C ATOM 1106 NZ LYS A 73 2.095 -23.089 -7.480 1.00 4.13 N ATOM 0 H LYS A 73 -1.950 -21.356 -8.009 1.00 41.33 H new ATOM 0 HA LYS A 73 -0.303 -19.837 -9.748 1.00 45.24 H new ATOM 0 HB2 LYS A 73 0.448 -21.777 -8.375 1.00 73.41 H new ATOM 0 HB3 LYS A 73 -0.539 -22.847 -9.351 1.00 73.41 H new ATOM 0 HG2 LYS A 73 0.791 -22.273 -11.358 1.00 61.01 H new ATOM 0 HG3 LYS A 73 1.757 -21.155 -10.415 1.00 61.01 H new ATOM 0 HD2 LYS A 73 1.570 -24.145 -9.862 1.00 25.10 H new ATOM 0 HD3 LYS A 73 2.844 -23.395 -10.803 1.00 25.10 H new ATOM 0 HE2 LYS A 73 3.774 -23.631 -8.642 1.00 44.05 H new ATOM 0 HE3 LYS A 73 3.337 -21.937 -8.743 1.00 44.05 H new ATOM 0 HZ1 LYS A 73 2.703 -23.328 -6.671 1.00 4.13 H new ATOM 0 HZ2 LYS A 73 1.602 -22.193 -7.290 1.00 4.13 H new ATOM 0 HZ3 LYS A 73 1.395 -23.845 -7.623 1.00 4.13 H new ATOM 1120 N PHE A 74 -2.516 -21.856 -11.155 1.00 11.22 N ATOM 1121 CA PHE A 74 -3.205 -22.146 -12.410 1.00 22.20 C ATOM 1122 C PHE A 74 -3.950 -20.910 -12.919 1.00 73.02 C ATOM 1123 O PHE A 74 -4.172 -20.756 -14.121 1.00 45.14 O ATOM 1124 CB PHE A 74 -4.160 -23.341 -12.243 1.00 10.05 C ATOM 1125 CG PHE A 74 -3.459 -24.684 -12.213 1.00 14.54 C ATOM 1126 CD1 PHE A 74 -2.368 -24.906 -11.382 1.00 44.33 C ATOM 1127 CD2 PHE A 74 -3.896 -25.728 -13.017 1.00 44.31 C ATOM 1128 CE1 PHE A 74 -1.731 -26.132 -11.356 1.00 1.45 C ATOM 1129 CE2 PHE A 74 -3.259 -26.956 -12.996 1.00 73.32 C ATOM 1130 CZ PHE A 74 -2.178 -27.158 -12.164 1.00 62.40 C ATOM 0 H PHE A 74 -2.861 -22.384 -10.353 1.00 11.22 H new ATOM 0 HA PHE A 74 -2.458 -22.416 -13.156 1.00 22.20 H new ATOM 0 HB2 PHE A 74 -4.725 -23.216 -11.320 1.00 10.05 H new ATOM 0 HB3 PHE A 74 -4.880 -23.336 -13.061 1.00 10.05 H new ATOM 0 HD1 PHE A 74 -2.012 -24.108 -10.747 1.00 44.33 H new ATOM 0 HD2 PHE A 74 -4.745 -25.580 -13.668 1.00 44.31 H new ATOM 0 HE1 PHE A 74 -0.884 -26.287 -10.704 1.00 1.45 H new ATOM 0 HE2 PHE A 74 -3.608 -27.756 -13.631 1.00 73.32 H new ATOM 0 HZ PHE A 74 -1.682 -28.117 -12.145 1.00 62.40 H new ATOM 1140 N ILE A 75 -4.342 -20.037 -11.997 1.00 65.43 N ATOM 1141 CA ILE A 75 -4.899 -18.738 -12.362 1.00 31.44 C ATOM 1142 C ILE A 75 -3.820 -17.875 -13.019 1.00 22.43 C ATOM 1143 O ILE A 75 -4.009 -17.341 -14.116 1.00 22.03 O ATOM 1144 CB ILE A 75 -5.475 -18.008 -11.120 1.00 14.34 C ATOM 1145 CG1 ILE A 75 -6.704 -18.759 -10.590 1.00 51.04 C ATOM 1146 CG2 ILE A 75 -5.823 -16.552 -11.441 1.00 31.23 C ATOM 1147 CD1 ILE A 75 -7.240 -18.220 -9.282 1.00 30.54 C ATOM 0 H ILE A 75 -4.285 -20.204 -10.992 1.00 65.43 H new ATOM 0 HA ILE A 75 -5.713 -18.903 -13.068 1.00 31.44 H new ATOM 0 HB ILE A 75 -4.709 -17.998 -10.345 1.00 14.34 H new ATOM 0 HG12 ILE A 75 -7.494 -18.716 -11.340 1.00 51.04 H new ATOM 0 HG13 ILE A 75 -6.446 -19.810 -10.459 1.00 51.04 H new ATOM 0 HG21 ILE A 75 -6.224 -16.069 -10.550 1.00 31.23 H new ATOM 0 HG22 ILE A 75 -4.925 -16.026 -11.766 1.00 31.23 H new ATOM 0 HG23 ILE A 75 -6.568 -16.523 -12.236 1.00 31.23 H new ATOM 0 HD11 ILE A 75 -8.107 -18.805 -8.976 1.00 30.54 H new ATOM 0 HD12 ILE A 75 -6.467 -18.289 -8.516 1.00 30.54 H new ATOM 0 HD13 ILE A 75 -7.532 -17.178 -9.410 1.00 30.54 H new ATOM 1159 N ALA A 76 -2.668 -17.772 -12.355 1.00 52.44 N ATOM 1160 CA ALA A 76 -1.543 -16.996 -12.876 1.00 4.04 C ATOM 1161 C ALA A 76 -1.077 -17.553 -14.225 1.00 21.11 C ATOM 1162 O ALA A 76 -0.533 -16.823 -15.058 1.00 25.25 O ATOM 1163 CB ALA A 76 -0.395 -16.979 -11.870 1.00 5.44 C ATOM 0 H ALA A 76 -2.490 -18.217 -11.455 1.00 52.44 H new ATOM 0 HA ALA A 76 -1.876 -15.970 -13.033 1.00 4.04 H new ATOM 0 HB1 ALA A 76 0.434 -16.397 -12.274 1.00 5.44 H new ATOM 0 HB2 ALA A 76 -0.735 -16.528 -10.938 1.00 5.44 H new ATOM 0 HB3 ALA A 76 -0.063 -18.000 -11.679 1.00 5.44 H new ATOM 1169 N ASP A 77 -1.323 -18.848 -14.430 1.00 61.03 N ATOM 1170 CA ASP A 77 -1.002 -19.535 -15.688 1.00 42.01 C ATOM 1171 C ASP A 77 -1.651 -18.834 -16.878 1.00 61.43 C ATOM 1172 O ASP A 77 -1.120 -18.845 -17.991 1.00 2.14 O ATOM 1173 CB ASP A 77 -1.474 -20.998 -15.622 1.00 63.45 C ATOM 1174 CG ASP A 77 -1.311 -21.742 -16.942 1.00 43.21 C ATOM 1175 OD1 ASP A 77 -0.157 -22.033 -17.325 1.00 31.32 O ATOM 1176 OD2 ASP A 77 -2.336 -22.041 -17.601 1.00 14.33 O ATOM 0 H ASP A 77 -1.751 -19.453 -13.729 1.00 61.03 H new ATOM 0 HA ASP A 77 0.079 -19.508 -15.824 1.00 42.01 H new ATOM 0 HB2 ASP A 77 -0.912 -21.519 -14.847 1.00 63.45 H new ATOM 0 HB3 ASP A 77 -2.523 -21.022 -15.326 1.00 63.45 H new ATOM 1181 N VAL A 78 -2.792 -18.206 -16.631 1.00 0.21 N ATOM 1182 CA VAL A 78 -3.540 -17.524 -17.683 1.00 54.41 C ATOM 1183 C VAL A 78 -3.111 -16.053 -17.772 1.00 22.23 C ATOM 1184 O VAL A 78 -3.886 -15.182 -18.156 1.00 42.11 O ATOM 1185 CB VAL A 78 -5.066 -17.646 -17.427 1.00 74.43 C ATOM 1186 CG1 VAL A 78 -5.883 -17.198 -18.642 1.00 55.44 C ATOM 1187 CG2 VAL A 78 -5.413 -19.081 -17.039 1.00 24.11 C ATOM 0 H VAL A 78 -3.223 -18.154 -15.708 1.00 0.21 H new ATOM 0 HA VAL A 78 -3.319 -18.000 -18.638 1.00 54.41 H new ATOM 0 HB VAL A 78 -5.326 -16.981 -16.604 1.00 74.43 H new ATOM 0 HG11 VAL A 78 -6.946 -17.299 -18.423 1.00 55.44 H new ATOM 0 HG12 VAL A 78 -5.656 -16.156 -18.869 1.00 55.44 H new ATOM 0 HG13 VAL A 78 -5.629 -17.820 -19.500 1.00 55.44 H new ATOM 0 HG21 VAL A 78 -6.485 -19.160 -16.861 1.00 24.11 H new ATOM 0 HG22 VAL A 78 -5.129 -19.755 -17.847 1.00 24.11 H new ATOM 0 HG23 VAL A 78 -4.873 -19.353 -16.132 1.00 24.11 H new ATOM 1197 N THR A 79 -1.847 -15.796 -17.411 1.00 30.41 N ATOM 1198 CA THR A 79 -1.245 -14.467 -17.538 1.00 54.12 C ATOM 1199 C THR A 79 -1.897 -13.462 -16.575 1.00 71.50 C ATOM 1200 O THR A 79 -1.693 -12.255 -16.681 1.00 33.50 O ATOM 1201 CB THR A 79 -1.347 -13.971 -19.012 1.00 72.30 C ATOM 1202 OG1 THR A 79 -0.824 -14.979 -19.891 1.00 53.21 O ATOM 1203 CG2 THR A 79 -0.586 -12.667 -19.242 1.00 22.22 C ATOM 0 H THR A 79 -1.218 -16.500 -17.025 1.00 30.41 H new ATOM 0 HA THR A 79 -0.192 -14.543 -17.266 1.00 54.12 H new ATOM 0 HB THR A 79 -2.400 -13.782 -19.220 1.00 72.30 H new ATOM 0 HG1 THR A 79 -0.889 -14.670 -20.819 1.00 53.21 H new ATOM 0 HG21 THR A 79 -0.689 -12.365 -20.284 1.00 22.22 H new ATOM 0 HG22 THR A 79 -0.994 -11.889 -18.597 1.00 22.22 H new ATOM 0 HG23 THR A 79 0.469 -12.815 -19.010 1.00 22.22 H new ATOM 1211 N LYS A 80 -2.623 -13.977 -15.584 1.00 61.35 N ATOM 1212 CA LYS A 80 -3.358 -13.122 -14.651 1.00 2.22 C ATOM 1213 C LYS A 80 -2.406 -12.240 -13.845 1.00 73.41 C ATOM 1214 O LYS A 80 -2.766 -11.124 -13.459 1.00 21.42 O ATOM 1215 CB LYS A 80 -4.228 -13.969 -13.712 1.00 2.02 C ATOM 1216 CG LYS A 80 -5.150 -13.153 -12.800 1.00 21.24 C ATOM 1217 CD LYS A 80 -5.937 -12.099 -13.579 1.00 33.52 C ATOM 1218 CE LYS A 80 -7.053 -11.475 -12.749 1.00 30.34 C ATOM 1219 NZ LYS A 80 -6.569 -10.933 -11.449 1.00 71.14 N ATOM 0 H LYS A 80 -2.718 -14.977 -15.406 1.00 61.35 H new ATOM 0 HA LYS A 80 -4.009 -12.471 -15.235 1.00 2.22 H new ATOM 0 HB2 LYS A 80 -4.836 -14.646 -14.312 1.00 2.02 H new ATOM 0 HB3 LYS A 80 -3.578 -14.587 -13.093 1.00 2.02 H new ATOM 0 HG2 LYS A 80 -5.844 -13.823 -12.293 1.00 21.24 H new ATOM 0 HG3 LYS A 80 -4.556 -12.665 -12.027 1.00 21.24 H new ATOM 0 HD2 LYS A 80 -5.257 -11.316 -13.915 1.00 33.52 H new ATOM 0 HD3 LYS A 80 -6.364 -12.555 -14.472 1.00 33.52 H new ATOM 0 HE2 LYS A 80 -7.520 -10.673 -13.321 1.00 30.34 H new ATOM 0 HE3 LYS A 80 -7.823 -12.224 -12.562 1.00 30.34 H new ATOM 0 HZ1 LYS A 80 -7.083 -11.391 -10.669 1.00 71.14 H new ATOM 0 HZ2 LYS A 80 -5.551 -11.122 -11.351 1.00 71.14 H new ATOM 0 HZ3 LYS A 80 -6.735 -9.907 -11.417 1.00 71.14 H new ATOM 1233 N ASP A 81 -1.191 -12.748 -13.610 1.00 15.43 N ATOM 1234 CA ASP A 81 -0.158 -12.034 -12.842 1.00 70.42 C ATOM 1235 C ASP A 81 -0.502 -12.001 -11.352 1.00 63.31 C ATOM 1236 O ASP A 81 0.263 -12.491 -10.517 1.00 51.31 O ATOM 1237 CB ASP A 81 0.048 -10.606 -13.384 1.00 15.35 C ATOM 1238 CG ASP A 81 0.938 -9.750 -12.492 1.00 71.41 C ATOM 1239 OD1 ASP A 81 2.179 -9.852 -12.599 1.00 21.22 O ATOM 1240 OD2 ASP A 81 0.396 -8.955 -11.693 1.00 53.32 O ATOM 0 H ASP A 81 -0.894 -13.664 -13.945 1.00 15.43 H new ATOM 0 HA ASP A 81 0.778 -12.580 -12.961 1.00 70.42 H new ATOM 0 HB2 ASP A 81 0.488 -10.662 -14.380 1.00 15.35 H new ATOM 0 HB3 ASP A 81 -0.922 -10.121 -13.491 1.00 15.35 H new ATOM 1245 N GLU A 82 -1.653 -11.428 -11.025 1.00 51.11 N ATOM 1246 CA GLU A 82 -2.120 -11.340 -9.647 1.00 23.24 C ATOM 1247 C GLU A 82 -3.427 -12.111 -9.475 1.00 62.30 C ATOM 1248 O GLU A 82 -4.486 -11.665 -9.927 1.00 24.41 O ATOM 1249 CB GLU A 82 -2.335 -9.878 -9.265 1.00 2.34 C ATOM 1250 CG GLU A 82 -2.919 -9.661 -7.870 1.00 51.23 C ATOM 1251 CD GLU A 82 -3.337 -8.217 -7.639 1.00 42.24 C ATOM 1252 OE1 GLU A 82 -3.934 -7.613 -8.558 1.00 14.04 O ATOM 1253 OE2 GLU A 82 -3.088 -7.682 -6.537 1.00 21.23 O ATOM 0 H GLU A 82 -2.288 -11.012 -11.706 1.00 51.11 H new ATOM 0 HA GLU A 82 -1.364 -11.779 -8.996 1.00 23.24 H new ATOM 0 HB2 GLU A 82 -1.380 -9.356 -9.329 1.00 2.34 H new ATOM 0 HB3 GLU A 82 -2.999 -9.419 -9.997 1.00 2.34 H new ATOM 0 HG2 GLU A 82 -3.782 -10.313 -7.734 1.00 51.23 H new ATOM 0 HG3 GLU A 82 -2.181 -9.948 -7.121 1.00 51.23 H new ATOM 1260 N PRO A 83 -3.358 -13.297 -8.855 1.00 41.20 N ATOM 1261 CA PRO A 83 -4.543 -14.058 -8.462 1.00 1.43 C ATOM 1262 C PRO A 83 -5.193 -13.444 -7.220 1.00 63.44 C ATOM 1263 O PRO A 83 -4.644 -13.525 -6.120 1.00 23.54 O ATOM 1264 CB PRO A 83 -4.006 -15.471 -8.155 1.00 4.40 C ATOM 1265 CG PRO A 83 -2.530 -15.437 -8.431 1.00 51.24 C ATOM 1266 CD PRO A 83 -2.119 -13.988 -8.495 1.00 42.23 C ATOM 0 HA PRO A 83 -5.310 -14.064 -9.237 1.00 1.43 H new ATOM 0 HB2 PRO A 83 -4.200 -15.743 -7.117 1.00 4.40 H new ATOM 0 HB3 PRO A 83 -4.500 -16.217 -8.778 1.00 4.40 H new ATOM 0 HG2 PRO A 83 -1.980 -15.958 -7.647 1.00 51.24 H new ATOM 0 HG3 PRO A 83 -2.303 -15.943 -9.370 1.00 51.24 H new ATOM 0 HD2 PRO A 83 -1.728 -13.639 -7.539 1.00 42.23 H new ATOM 0 HD3 PRO A 83 -1.338 -13.825 -9.238 1.00 42.23 H new ATOM 1274 N THR A 84 -6.339 -12.803 -7.404 1.00 62.44 N ATOM 1275 CA THR A 84 -7.043 -12.161 -6.300 1.00 64.50 C ATOM 1276 C THR A 84 -8.137 -13.073 -5.746 1.00 62.30 C ATOM 1277 O THR A 84 -8.488 -14.093 -6.357 1.00 22.53 O ATOM 1278 CB THR A 84 -7.663 -10.805 -6.722 1.00 74.30 C ATOM 1279 OG1 THR A 84 -8.206 -10.139 -5.576 1.00 4.04 O ATOM 1280 CG2 THR A 84 -8.762 -10.984 -7.766 1.00 32.20 C ATOM 0 H THR A 84 -6.802 -12.713 -8.308 1.00 62.44 H new ATOM 0 HA THR A 84 -6.304 -11.972 -5.522 1.00 64.50 H new ATOM 0 HB THR A 84 -6.868 -10.205 -7.164 1.00 74.30 H new ATOM 0 HG1 THR A 84 -8.595 -9.282 -5.849 1.00 4.04 H new ATOM 0 HG21 THR A 84 -9.171 -10.010 -8.035 1.00 32.20 H new ATOM 0 HG22 THR A 84 -8.346 -11.461 -8.654 1.00 32.20 H new ATOM 0 HG23 THR A 84 -9.555 -11.609 -7.356 1.00 32.20 H new ATOM 1288 N ALA A 85 -8.680 -12.686 -4.593 1.00 11.33 N ATOM 1289 CA ALA A 85 -9.710 -13.467 -3.915 1.00 53.25 C ATOM 1290 C ALA A 85 -10.879 -13.759 -4.851 1.00 55.44 C ATOM 1291 O ALA A 85 -11.492 -14.823 -4.779 1.00 52.34 O ATOM 1292 CB ALA A 85 -10.192 -12.739 -2.665 1.00 13.24 C ATOM 0 H ALA A 85 -8.420 -11.828 -4.106 1.00 11.33 H new ATOM 0 HA ALA A 85 -9.273 -14.420 -3.616 1.00 53.25 H new ATOM 0 HB1 ALA A 85 -10.960 -13.334 -2.171 1.00 13.24 H new ATOM 0 HB2 ALA A 85 -9.354 -12.591 -1.984 1.00 13.24 H new ATOM 0 HB3 ALA A 85 -10.608 -11.771 -2.945 1.00 13.24 H new ATOM 1298 N GLN A 86 -11.171 -12.811 -5.740 1.00 34.21 N ATOM 1299 CA GLN A 86 -12.242 -12.981 -6.717 1.00 11.51 C ATOM 1300 C GLN A 86 -11.914 -14.127 -7.667 1.00 50.40 C ATOM 1301 O GLN A 86 -12.758 -14.986 -7.929 1.00 71.31 O ATOM 1302 CB GLN A 86 -12.468 -11.685 -7.505 1.00 50.03 C ATOM 1303 CG GLN A 86 -13.542 -11.794 -8.583 1.00 41.24 C ATOM 1304 CD GLN A 86 -13.830 -10.467 -9.261 1.00 21.50 C ATOM 1305 OE1 GLN A 86 -12.946 -9.622 -9.398 1.00 41.43 O ATOM 1306 NE2 GLN A 86 -15.073 -10.264 -9.671 1.00 55.22 N ATOM 0 H GLN A 86 -10.681 -11.919 -5.803 1.00 34.21 H new ATOM 0 HA GLN A 86 -13.160 -13.221 -6.181 1.00 11.51 H new ATOM 0 HB2 GLN A 86 -12.745 -10.893 -6.810 1.00 50.03 H new ATOM 0 HB3 GLN A 86 -11.529 -11.387 -7.971 1.00 50.03 H new ATOM 0 HG2 GLN A 86 -13.226 -12.519 -9.333 1.00 41.24 H new ATOM 0 HG3 GLN A 86 -14.460 -12.176 -8.137 1.00 41.24 H new ATOM 0 HE21 GLN A 86 -15.778 -10.989 -9.540 1.00 55.22 H new ATOM 0 HE22 GLN A 86 -15.325 -9.383 -10.118 1.00 55.22 H new ATOM 1315 N ASP A 87 -10.673 -14.147 -8.155 1.00 24.32 N ATOM 1316 CA ASP A 87 -10.230 -15.185 -9.085 1.00 32.24 C ATOM 1317 C ASP A 87 -10.331 -16.550 -8.418 1.00 42.21 C ATOM 1318 O ASP A 87 -10.954 -17.473 -8.955 1.00 5.42 O ATOM 1319 CB ASP A 87 -8.777 -14.951 -9.540 1.00 62.23 C ATOM 1320 CG ASP A 87 -8.570 -13.633 -10.276 1.00 31.03 C ATOM 1321 OD1 ASP A 87 -9.411 -13.279 -11.127 1.00 14.52 O ATOM 1322 OD2 ASP A 87 -7.552 -12.956 -10.011 1.00 21.13 O ATOM 0 H ASP A 87 -9.958 -13.457 -7.922 1.00 24.32 H new ATOM 0 HA ASP A 87 -10.876 -15.146 -9.962 1.00 32.24 H new ATOM 0 HB2 ASP A 87 -8.124 -14.976 -8.668 1.00 62.23 H new ATOM 0 HB3 ASP A 87 -8.473 -15.771 -10.190 1.00 62.23 H new ATOM 1327 N ILE A 88 -9.745 -16.660 -7.224 1.00 41.24 N ATOM 1328 CA ILE A 88 -9.766 -17.918 -6.478 1.00 12.41 C ATOM 1329 C ILE A 88 -11.205 -18.337 -6.174 1.00 62.53 C ATOM 1330 O ILE A 88 -11.551 -19.512 -6.290 1.00 0.14 O ATOM 1331 CB ILE A 88 -8.934 -17.844 -5.159 1.00 4.11 C ATOM 1332 CG1 ILE A 88 -7.417 -17.863 -5.459 1.00 4.15 C ATOM 1333 CG2 ILE A 88 -9.298 -18.984 -4.203 1.00 3.10 C ATOM 1334 CD1 ILE A 88 -6.883 -16.591 -6.082 1.00 42.04 C ATOM 0 H ILE A 88 -9.253 -15.898 -6.756 1.00 41.24 H new ATOM 0 HA ILE A 88 -9.298 -18.671 -7.112 1.00 12.41 H new ATOM 0 HB ILE A 88 -9.181 -16.900 -4.672 1.00 4.11 H new ATOM 0 HG12 ILE A 88 -6.878 -18.051 -4.530 1.00 4.15 H new ATOM 0 HG13 ILE A 88 -7.202 -18.697 -6.127 1.00 4.15 H new ATOM 0 HG21 ILE A 88 -8.700 -18.902 -3.295 1.00 3.10 H new ATOM 0 HG22 ILE A 88 -10.356 -18.921 -3.948 1.00 3.10 H new ATOM 0 HG23 ILE A 88 -9.097 -19.941 -4.685 1.00 3.10 H new ATOM 0 HD11 ILE A 88 -5.812 -16.694 -6.258 1.00 42.04 H new ATOM 0 HD12 ILE A 88 -7.390 -16.409 -7.029 1.00 42.04 H new ATOM 0 HD13 ILE A 88 -7.061 -15.753 -5.408 1.00 42.04 H new ATOM 1346 N SER A 89 -12.045 -17.369 -5.816 1.00 54.03 N ATOM 1347 CA SER A 89 -13.443 -17.648 -5.500 1.00 31.54 C ATOM 1348 C SER A 89 -14.155 -18.246 -6.716 1.00 63.41 C ATOM 1349 O SER A 89 -14.859 -19.251 -6.603 1.00 50.42 O ATOM 1350 CB SER A 89 -14.154 -16.367 -5.038 1.00 55.52 C ATOM 1351 OG SER A 89 -15.480 -16.634 -4.613 1.00 41.44 O ATOM 0 H SER A 89 -11.783 -16.386 -5.738 1.00 54.03 H new ATOM 0 HA SER A 89 -13.477 -18.374 -4.687 1.00 31.54 H new ATOM 0 HB2 SER A 89 -13.593 -15.913 -4.221 1.00 55.52 H new ATOM 0 HB3 SER A 89 -14.171 -15.644 -5.854 1.00 55.52 H new ATOM 0 HG SER A 89 -15.905 -15.800 -4.324 1.00 41.44 H new ATOM 1357 N ARG A 90 -13.945 -17.633 -7.884 1.00 23.34 N ATOM 1358 CA ARG A 90 -14.562 -18.111 -9.118 1.00 54.03 C ATOM 1359 C ARG A 90 -14.133 -19.552 -9.396 1.00 24.50 C ATOM 1360 O ARG A 90 -14.969 -20.464 -9.489 1.00 24.11 O ATOM 1361 CB ARG A 90 -14.147 -17.221 -10.305 1.00 2.20 C ATOM 1362 CG ARG A 90 -14.659 -15.784 -10.235 1.00 50.34 C ATOM 1363 CD ARG A 90 -14.074 -14.935 -11.364 1.00 62.12 C ATOM 1364 NE ARG A 90 -14.639 -13.587 -11.396 1.00 24.24 N ATOM 1365 CZ ARG A 90 -14.220 -12.612 -12.211 1.00 75.25 C ATOM 1366 NH1 ARG A 90 -13.207 -12.815 -13.047 1.00 2.51 N ATOM 1367 NH2 ARG A 90 -14.821 -11.430 -12.184 1.00 40.20 N ATOM 0 H ARG A 90 -13.355 -16.809 -7.998 1.00 23.34 H new ATOM 0 HA ARG A 90 -15.645 -18.069 -8.999 1.00 54.03 H new ATOM 0 HB2 ARG A 90 -13.059 -17.202 -10.364 1.00 2.20 H new ATOM 0 HB3 ARG A 90 -14.508 -17.677 -11.227 1.00 2.20 H new ATOM 0 HG2 ARG A 90 -15.747 -15.779 -10.299 1.00 50.34 H new ATOM 0 HG3 ARG A 90 -14.394 -15.347 -9.272 1.00 50.34 H new ATOM 0 HD2 ARG A 90 -12.993 -14.870 -11.244 1.00 62.12 H new ATOM 0 HD3 ARG A 90 -14.260 -15.427 -12.319 1.00 62.12 H new ATOM 0 HE ARG A 90 -15.403 -13.376 -10.754 1.00 24.24 H new ATOM 0 HH11 ARG A 90 -12.740 -13.722 -13.072 1.00 2.51 H new ATOM 0 HH12 ARG A 90 -12.896 -12.064 -13.664 1.00 2.51 H new ATOM 0 HH21 ARG A 90 -15.599 -11.268 -11.544 1.00 40.20 H new ATOM 0 HH22 ARG A 90 -14.506 -10.683 -12.803 1.00 40.20 H new ATOM 1381 N VAL A 91 -12.821 -19.753 -9.459 1.00 13.22 N ATOM 1382 CA VAL A 91 -12.251 -21.053 -9.788 1.00 73.33 C ATOM 1383 C VAL A 91 -12.741 -22.117 -8.807 1.00 11.43 C ATOM 1384 O VAL A 91 -13.283 -23.160 -9.214 1.00 41.13 O ATOM 1385 CB VAL A 91 -10.702 -20.996 -9.784 1.00 22.24 C ATOM 1386 CG1 VAL A 91 -10.098 -22.367 -10.070 1.00 73.11 C ATOM 1387 CG2 VAL A 91 -10.206 -19.964 -10.798 1.00 44.15 C ATOM 0 H VAL A 91 -12.128 -19.025 -9.285 1.00 13.22 H new ATOM 0 HA VAL A 91 -12.582 -21.321 -10.791 1.00 73.33 H new ATOM 0 HB VAL A 91 -10.377 -20.692 -8.789 1.00 22.24 H new ATOM 0 HG11 VAL A 91 -9.010 -22.295 -10.061 1.00 73.11 H new ATOM 0 HG12 VAL A 91 -10.421 -23.074 -9.306 1.00 73.11 H new ATOM 0 HG13 VAL A 91 -10.430 -22.714 -11.049 1.00 73.11 H new ATOM 0 HG21 VAL A 91 -9.116 -19.935 -10.784 1.00 44.15 H new ATOM 0 HG22 VAL A 91 -10.549 -20.240 -11.795 1.00 44.15 H new ATOM 0 HG23 VAL A 91 -10.599 -18.981 -10.538 1.00 44.15 H new ATOM 1397 N ALA A 92 -12.581 -21.823 -7.517 1.00 14.51 N ATOM 1398 CA ALA A 92 -12.990 -22.730 -6.453 1.00 51.41 C ATOM 1399 C ALA A 92 -14.472 -23.062 -6.566 1.00 45.24 C ATOM 1400 O ALA A 92 -14.880 -24.200 -6.341 1.00 41.04 O ATOM 1401 CB ALA A 92 -12.677 -22.134 -5.082 1.00 45.23 C ATOM 0 H ALA A 92 -12.166 -20.953 -7.184 1.00 14.51 H new ATOM 0 HA ALA A 92 -12.423 -23.655 -6.561 1.00 51.41 H new ATOM 0 HB1 ALA A 92 -12.991 -22.829 -4.303 1.00 45.23 H new ATOM 0 HB2 ALA A 92 -11.605 -21.956 -4.999 1.00 45.23 H new ATOM 0 HB3 ALA A 92 -13.211 -21.191 -4.964 1.00 45.23 H new ATOM 1407 N SER A 93 -15.265 -22.064 -6.937 1.00 15.05 N ATOM 1408 CA SER A 93 -16.696 -22.250 -7.115 1.00 62.23 C ATOM 1409 C SER A 93 -16.969 -23.220 -8.265 1.00 73.41 C ATOM 1410 O SER A 93 -17.872 -24.055 -8.178 1.00 13.21 O ATOM 1411 CB SER A 93 -17.379 -20.897 -7.373 1.00 70.15 C ATOM 1412 OG SER A 93 -18.793 -21.025 -7.452 1.00 11.51 O ATOM 0 H SER A 93 -14.938 -21.115 -7.120 1.00 15.05 H new ATOM 0 HA SER A 93 -17.110 -22.678 -6.202 1.00 62.23 H new ATOM 0 HB2 SER A 93 -17.121 -20.202 -6.574 1.00 70.15 H new ATOM 0 HB3 SER A 93 -17.000 -20.470 -8.302 1.00 70.15 H new ATOM 0 HG SER A 93 -19.193 -20.145 -7.615 1.00 11.51 H new ATOM 1418 N ARG A 94 -16.186 -23.110 -9.343 1.00 41.15 N ATOM 1419 CA ARG A 94 -16.390 -23.973 -10.513 1.00 3.43 C ATOM 1420 C ARG A 94 -16.044 -25.428 -10.195 1.00 32.51 C ATOM 1421 O ARG A 94 -16.869 -26.322 -10.390 1.00 40.31 O ATOM 1422 CB ARG A 94 -15.525 -23.512 -11.688 1.00 52.53 C ATOM 1423 CG ARG A 94 -15.518 -22.014 -11.918 1.00 61.23 C ATOM 1424 CD ARG A 94 -16.921 -21.432 -12.114 1.00 13.22 C ATOM 1425 NE ARG A 94 -17.241 -21.210 -13.529 1.00 3.54 N ATOM 1426 CZ ARG A 94 -18.082 -20.263 -13.957 1.00 23.02 C ATOM 1427 NH1 ARG A 94 -18.788 -19.555 -13.079 1.00 3.12 N ATOM 1428 NH2 ARG A 94 -18.244 -20.051 -15.258 1.00 21.02 N ATOM 0 H ARG A 94 -15.418 -22.445 -9.431 1.00 41.15 H new ATOM 0 HA ARG A 94 -17.444 -23.902 -10.781 1.00 3.43 H new ATOM 0 HB2 ARG A 94 -14.501 -23.845 -11.521 1.00 52.53 H new ATOM 0 HB3 ARG A 94 -15.876 -24.004 -12.595 1.00 52.53 H new ATOM 0 HG2 ARG A 94 -15.043 -21.524 -11.068 1.00 61.23 H new ATOM 0 HG3 ARG A 94 -14.912 -21.790 -12.796 1.00 61.23 H new ATOM 0 HD2 ARG A 94 -17.656 -22.109 -11.680 1.00 13.22 H new ATOM 0 HD3 ARG A 94 -16.999 -20.488 -11.574 1.00 13.22 H new ATOM 0 HE ARG A 94 -16.798 -21.811 -14.224 1.00 3.54 H new ATOM 0 HH11 ARG A 94 -18.687 -19.735 -12.080 1.00 3.12 H new ATOM 0 HH12 ARG A 94 -19.430 -18.832 -13.405 1.00 3.12 H new ATOM 0 HH21 ARG A 94 -17.726 -20.612 -15.934 1.00 21.02 H new ATOM 0 HH22 ARG A 94 -18.887 -19.328 -15.581 1.00 21.02 H new ATOM 1442 N LEU A 95 -14.821 -25.663 -9.703 1.00 55.01 N ATOM 1443 CA LEU A 95 -14.411 -27.022 -9.315 1.00 15.52 C ATOM 1444 C LEU A 95 -15.355 -27.615 -8.269 1.00 70.41 C ATOM 1445 O LEU A 95 -15.771 -28.767 -8.399 1.00 61.13 O ATOM 1446 CB LEU A 95 -12.940 -27.079 -8.834 1.00 62.31 C ATOM 1447 CG LEU A 95 -12.453 -25.925 -7.927 1.00 10.41 C ATOM 1448 CD1 LEU A 95 -12.185 -26.395 -6.498 1.00 12.14 C ATOM 1449 CD2 LEU A 95 -11.200 -25.276 -8.512 1.00 73.21 C ATOM 0 H LEU A 95 -14.109 -24.946 -9.565 1.00 55.01 H new ATOM 0 HA LEU A 95 -14.477 -27.635 -10.214 1.00 15.52 H new ATOM 0 HB2 LEU A 95 -12.795 -28.016 -8.297 1.00 62.31 H new ATOM 0 HB3 LEU A 95 -12.297 -27.113 -9.713 1.00 62.31 H new ATOM 0 HG LEU A 95 -13.253 -25.186 -7.887 1.00 10.41 H new ATOM 0 HD11 LEU A 95 -11.845 -25.553 -5.896 1.00 12.14 H new ATOM 0 HD12 LEU A 95 -13.102 -26.800 -6.070 1.00 12.14 H new ATOM 0 HD13 LEU A 95 -11.417 -27.168 -6.507 1.00 12.14 H new ATOM 0 HD21 LEU A 95 -10.872 -24.466 -7.860 1.00 73.21 H new ATOM 0 HD22 LEU A 95 -10.408 -26.021 -8.592 1.00 73.21 H new ATOM 0 HD23 LEU A 95 -11.425 -24.877 -9.501 1.00 73.21 H new ATOM 1461 N ALA A 96 -15.712 -26.829 -7.256 1.00 40.45 N ATOM 1462 CA ALA A 96 -16.631 -27.296 -6.214 1.00 52.43 C ATOM 1463 C ALA A 96 -17.946 -27.773 -6.832 1.00 51.03 C ATOM 1464 O ALA A 96 -18.456 -28.844 -6.492 1.00 52.32 O ATOM 1465 CB ALA A 96 -16.888 -26.198 -5.187 1.00 5.15 C ATOM 0 H ALA A 96 -15.383 -25.871 -7.132 1.00 40.45 H new ATOM 0 HA ALA A 96 -16.166 -28.138 -5.702 1.00 52.43 H new ATOM 0 HB1 ALA A 96 -17.573 -26.567 -4.423 1.00 5.15 H new ATOM 0 HB2 ALA A 96 -15.946 -25.908 -4.721 1.00 5.15 H new ATOM 0 HB3 ALA A 96 -17.329 -25.333 -5.682 1.00 5.15 H new ATOM 1471 N ALA A 97 -18.460 -26.989 -7.779 1.00 43.02 N ATOM 1472 CA ALA A 97 -19.711 -27.296 -8.476 1.00 4.04 C ATOM 1473 C ALA A 97 -19.678 -28.681 -9.129 1.00 60.22 C ATOM 1474 O ALA A 97 -20.722 -29.229 -9.490 1.00 2.12 O ATOM 1475 CB ALA A 97 -20.008 -26.223 -9.515 1.00 52.53 C ATOM 0 H ALA A 97 -18.021 -26.121 -8.086 1.00 43.02 H new ATOM 0 HA ALA A 97 -20.509 -27.308 -7.734 1.00 4.04 H new ATOM 0 HB1 ALA A 97 -20.940 -26.461 -10.027 1.00 52.53 H new ATOM 0 HB2 ALA A 97 -20.102 -25.255 -9.022 1.00 52.53 H new ATOM 0 HB3 ALA A 97 -19.195 -26.184 -10.240 1.00 52.53 H new ATOM 1481 N GLY A 98 -18.475 -29.241 -9.277 1.00 10.24 N ATOM 1482 CA GLY A 98 -18.314 -30.534 -9.918 1.00 71.13 C ATOM 1483 C GLY A 98 -18.953 -31.666 -9.126 1.00 75.14 C ATOM 1484 O GLY A 98 -19.277 -32.712 -9.691 1.00 24.30 O ATOM 0 H GLY A 98 -17.604 -28.815 -8.960 1.00 10.24 H new ATOM 0 HA2 GLY A 98 -18.755 -30.499 -10.914 1.00 71.13 H new ATOM 0 HA3 GLY A 98 -17.252 -30.741 -10.047 1.00 71.13 H new ATOM 1488 N GLY A 99 -19.142 -31.467 -7.820 1.00 44.44 N ATOM 1489 CA GLY A 99 -19.870 -32.444 -7.020 1.00 11.31 C ATOM 1490 C GLY A 99 -19.107 -32.945 -5.806 1.00 2.41 C ATOM 1491 O GLY A 99 -19.613 -33.780 -5.056 1.00 24.34 O ATOM 0 H GLY A 99 -18.807 -30.653 -7.305 1.00 44.44 H new ATOM 0 HA2 GLY A 99 -20.808 -31.999 -6.688 1.00 11.31 H new ATOM 0 HA3 GLY A 99 -20.127 -33.295 -7.651 1.00 11.31 H new ATOM 1495 N TRP A 100 -17.894 -32.452 -5.605 1.00 33.12 N ATOM 1496 CA TRP A 100 -17.093 -32.850 -4.444 1.00 54.53 C ATOM 1497 C TRP A 100 -17.253 -31.788 -3.329 1.00 63.43 C ATOM 1498 O TRP A 100 -17.936 -30.792 -3.569 1.00 14.14 O ATOM 1499 CB TRP A 100 -15.633 -33.156 -4.872 1.00 53.11 C ATOM 1500 CG TRP A 100 -14.932 -32.099 -5.679 1.00 53.11 C ATOM 1501 CD1 TRP A 100 -15.308 -31.598 -6.893 1.00 62.25 C ATOM 1502 CD2 TRP A 100 -13.681 -31.469 -5.360 1.00 74.21 C ATOM 1503 NE1 TRP A 100 -14.391 -30.676 -7.326 1.00 50.24 N ATOM 1504 CE2 TRP A 100 -13.383 -30.579 -6.406 1.00 71.24 C ATOM 1505 CE3 TRP A 100 -12.794 -31.561 -4.284 1.00 61.55 C ATOM 1506 CZ2 TRP A 100 -12.237 -29.792 -6.412 1.00 14.04 C ATOM 1507 CZ3 TRP A 100 -11.653 -30.780 -4.289 1.00 44.10 C ATOM 1508 CH2 TRP A 100 -11.382 -29.904 -5.348 1.00 25.43 C ATOM 0 H TRP A 100 -17.440 -31.780 -6.223 1.00 33.12 H new ATOM 0 HA TRP A 100 -17.451 -33.786 -4.016 1.00 54.53 H new ATOM 0 HB2 TRP A 100 -15.046 -33.343 -3.972 1.00 53.11 H new ATOM 0 HB3 TRP A 100 -15.634 -34.081 -5.449 1.00 53.11 H new ATOM 0 HD1 TRP A 100 -16.198 -31.886 -7.433 1.00 62.25 H new ATOM 0 HE1 TRP A 100 -14.451 -30.146 -8.196 1.00 50.24 H new ATOM 0 HE3 TRP A 100 -12.996 -32.231 -3.462 1.00 61.55 H new ATOM 0 HZ2 TRP A 100 -12.028 -29.116 -7.228 1.00 14.04 H new ATOM 0 HZ3 TRP A 100 -10.960 -30.846 -3.463 1.00 44.10 H new ATOM 0 HH2 TRP A 100 -10.483 -29.306 -5.325 1.00 25.43 H new ATOM 1519 N PRO A 101 -16.591 -31.921 -2.131 1.00 54.45 N ATOM 1520 CA PRO A 101 -17.040 -31.341 -0.864 1.00 61.44 C ATOM 1521 C PRO A 101 -18.394 -30.612 -0.901 1.00 74.42 C ATOM 1522 O PRO A 101 -19.390 -31.185 -1.351 1.00 34.13 O ATOM 1523 CB PRO A 101 -15.840 -30.445 -0.576 1.00 45.13 C ATOM 1524 CG PRO A 101 -14.664 -31.301 -1.006 1.00 52.13 C ATOM 1525 CD PRO A 101 -15.232 -32.409 -1.898 1.00 25.12 C ATOM 0 HA PRO A 101 -17.275 -32.074 -0.092 1.00 61.44 H new ATOM 0 HB2 PRO A 101 -15.888 -29.513 -1.139 1.00 45.13 H new ATOM 0 HB3 PRO A 101 -15.780 -30.177 0.479 1.00 45.13 H new ATOM 0 HG2 PRO A 101 -13.929 -30.706 -1.548 1.00 52.13 H new ATOM 0 HG3 PRO A 101 -14.155 -31.724 -0.140 1.00 52.13 H new ATOM 0 HD2 PRO A 101 -14.670 -32.519 -2.825 1.00 25.12 H new ATOM 0 HD3 PRO A 101 -15.223 -33.380 -1.403 1.00 25.12 H new ATOM 1533 N LEU A 102 -18.455 -29.377 -0.398 1.00 10.31 N ATOM 1534 CA LEU A 102 -19.741 -28.705 -0.219 1.00 74.21 C ATOM 1535 C LEU A 102 -20.284 -28.193 -1.553 1.00 33.31 C ATOM 1536 O LEU A 102 -20.046 -27.044 -1.935 1.00 3.42 O ATOM 1537 CB LEU A 102 -19.624 -27.546 0.792 1.00 54.21 C ATOM 1538 CG LEU A 102 -19.401 -27.956 2.263 1.00 73.13 C ATOM 1539 CD1 LEU A 102 -18.034 -28.609 2.459 1.00 1.32 C ATOM 1540 CD2 LEU A 102 -19.558 -26.747 3.187 1.00 12.44 C ATOM 0 H LEU A 102 -17.643 -28.830 -0.112 1.00 10.31 H new ATOM 0 HA LEU A 102 -20.443 -29.438 0.178 1.00 74.21 H new ATOM 0 HB2 LEU A 102 -18.799 -26.903 0.485 1.00 54.21 H new ATOM 0 HB3 LEU A 102 -20.533 -26.947 0.736 1.00 54.21 H new ATOM 0 HG LEU A 102 -20.161 -28.693 2.522 1.00 73.13 H new ATOM 0 HD11 LEU A 102 -17.910 -28.885 3.506 1.00 1.32 H new ATOM 0 HD12 LEU A 102 -17.965 -29.502 1.837 1.00 1.32 H new ATOM 0 HD13 LEU A 102 -17.251 -27.906 2.174 1.00 1.32 H new ATOM 0 HD21 LEU A 102 -19.397 -27.055 4.220 1.00 12.44 H new ATOM 0 HD22 LEU A 102 -18.826 -25.986 2.917 1.00 12.44 H new ATOM 0 HD23 LEU A 102 -20.563 -26.337 3.083 1.00 12.44 H new ATOM 1552 N ALA A 103 -21.023 -29.072 -2.234 1.00 35.13 N ATOM 1553 CA ALA A 103 -21.660 -28.769 -3.513 1.00 1.22 C ATOM 1554 C ALA A 103 -22.293 -30.041 -4.082 1.00 44.52 C ATOM 1555 O ALA A 103 -22.419 -31.046 -3.380 1.00 71.31 O ATOM 1556 CB ALA A 103 -20.655 -28.188 -4.503 1.00 34.24 C ATOM 0 H ALA A 103 -21.196 -30.023 -1.908 1.00 35.13 H new ATOM 0 HA ALA A 103 -22.435 -28.021 -3.348 1.00 1.22 H new ATOM 0 HB1 ALA A 103 -21.157 -27.972 -5.446 1.00 34.24 H new ATOM 0 HB2 ALA A 103 -20.234 -27.268 -4.097 1.00 34.24 H new ATOM 0 HB3 ALA A 103 -19.855 -28.908 -4.674 1.00 34.24 H new ATOM 1562 N GLY A 104 -22.698 -29.987 -5.347 1.00 1.03 N ATOM 1563 CA GLY A 104 -23.271 -31.150 -6.010 1.00 34.40 C ATOM 1564 C GLY A 104 -23.740 -30.812 -7.396 1.00 2.44 C ATOM 1565 O GLY A 104 -23.329 -31.437 -8.375 1.00 60.53 O ATOM 0 H GLY A 104 -22.640 -29.153 -5.931 1.00 1.03 H new ATOM 0 HA2 GLY A 104 -22.528 -31.946 -6.059 1.00 34.40 H new ATOM 0 HA3 GLY A 104 -24.107 -31.530 -5.423 1.00 34.40 H new ATOM 1569 N VAL A 105 -24.591 -29.808 -7.476 1.00 75.25 N ATOM 1570 CA VAL A 105 -25.078 -29.316 -8.746 1.00 23.35 C ATOM 1571 C VAL A 105 -25.678 -27.925 -8.546 1.00 14.03 C ATOM 1572 O VAL A 105 -26.690 -27.754 -7.856 1.00 43.04 O ATOM 1573 CB VAL A 105 -26.097 -30.299 -9.390 1.00 43.11 C ATOM 1574 CG1 VAL A 105 -27.389 -30.414 -8.581 1.00 54.52 C ATOM 1575 CG2 VAL A 105 -26.373 -29.905 -10.832 1.00 71.45 C ATOM 0 H VAL A 105 -24.962 -29.313 -6.665 1.00 75.25 H new ATOM 0 HA VAL A 105 -24.244 -29.243 -9.444 1.00 23.35 H new ATOM 0 HB VAL A 105 -25.645 -31.291 -9.383 1.00 43.11 H new ATOM 0 HG11 VAL A 105 -28.066 -31.112 -9.074 1.00 54.52 H new ATOM 0 HG12 VAL A 105 -27.160 -30.777 -7.579 1.00 54.52 H new ATOM 0 HG13 VAL A 105 -27.864 -29.435 -8.513 1.00 54.52 H new ATOM 0 HG21 VAL A 105 -27.088 -30.602 -11.269 1.00 71.45 H new ATOM 0 HG22 VAL A 105 -26.785 -28.896 -10.861 1.00 71.45 H new ATOM 0 HG23 VAL A 105 -25.444 -29.933 -11.401 1.00 71.45 H new ATOM 1585 N ASP A 106 -25.014 -26.924 -9.110 1.00 34.34 N ATOM 1586 CA ASP A 106 -25.353 -25.528 -8.850 1.00 34.40 C ATOM 1587 C ASP A 106 -25.264 -24.712 -10.132 1.00 44.13 C ATOM 1588 O ASP A 106 -24.184 -24.260 -10.511 1.00 12.44 O ATOM 1589 CB ASP A 106 -24.406 -24.932 -7.789 1.00 3.44 C ATOM 1590 CG ASP A 106 -24.523 -25.610 -6.430 1.00 44.43 C ATOM 1591 OD1 ASP A 106 -23.928 -26.694 -6.241 1.00 25.55 O ATOM 1592 OD2 ASP A 106 -25.223 -25.068 -5.546 1.00 61.24 O ATOM 0 H ASP A 106 -24.233 -27.053 -9.754 1.00 34.34 H new ATOM 0 HA ASP A 106 -26.376 -25.490 -8.475 1.00 34.40 H new ATOM 0 HB2 ASP A 106 -23.378 -25.015 -8.142 1.00 3.44 H new ATOM 0 HB3 ASP A 106 -24.620 -23.869 -7.677 1.00 3.44 H new ATOM 1597 N SER A 107 -26.398 -24.539 -10.802 1.00 25.45 N ATOM 1598 CA SER A 107 -26.463 -23.730 -12.015 1.00 20.22 C ATOM 1599 C SER A 107 -26.022 -22.295 -11.715 1.00 62.13 C ATOM 1600 O SER A 107 -25.430 -21.621 -12.560 1.00 71.25 O ATOM 1601 CB SER A 107 -27.892 -23.750 -12.582 1.00 31.03 C ATOM 1602 OG SER A 107 -27.999 -22.980 -13.768 1.00 63.21 O ATOM 0 H SER A 107 -27.289 -24.950 -10.524 1.00 25.45 H new ATOM 0 HA SER A 107 -25.787 -24.149 -12.760 1.00 20.22 H new ATOM 0 HB2 SER A 107 -28.187 -24.779 -12.789 1.00 31.03 H new ATOM 0 HB3 SER A 107 -28.585 -23.364 -11.834 1.00 31.03 H new ATOM 0 HG SER A 107 -28.920 -23.017 -14.100 1.00 63.21 H new ATOM 1608 N THR A 108 -26.293 -21.855 -10.489 1.00 52.43 N ATOM 1609 CA THR A 108 -25.935 -20.516 -10.035 1.00 65.30 C ATOM 1610 C THR A 108 -24.420 -20.297 -10.070 1.00 75.14 C ATOM 1611 O THR A 108 -23.954 -19.162 -10.195 1.00 15.14 O ATOM 1612 CB THR A 108 -26.469 -20.263 -8.601 1.00 33.03 C ATOM 1613 OG1 THR A 108 -26.161 -18.928 -8.174 1.00 25.35 O ATOM 1614 CG2 THR A 108 -25.886 -21.266 -7.607 1.00 32.14 C ATOM 0 H THR A 108 -26.767 -22.418 -9.783 1.00 52.43 H new ATOM 0 HA THR A 108 -26.399 -19.806 -10.720 1.00 65.30 H new ATOM 0 HB THR A 108 -27.551 -20.390 -8.628 1.00 33.03 H new ATOM 0 HG1 THR A 108 -26.507 -18.786 -7.268 1.00 25.35 H new ATOM 0 HG21 THR A 108 -26.280 -21.062 -6.611 1.00 32.14 H new ATOM 0 HG22 THR A 108 -26.162 -22.277 -7.906 1.00 32.14 H new ATOM 0 HG23 THR A 108 -24.800 -21.175 -7.593 1.00 32.14 H new ATOM 1622 N ALA A 109 -23.657 -21.384 -9.978 1.00 54.00 N ATOM 1623 CA ALA A 109 -22.198 -21.301 -9.966 1.00 24.21 C ATOM 1624 C ALA A 109 -21.633 -21.353 -11.380 1.00 11.04 C ATOM 1625 O ALA A 109 -20.414 -21.358 -11.576 1.00 23.33 O ATOM 1626 CB ALA A 109 -21.613 -22.421 -9.115 1.00 14.02 C ATOM 0 H ALA A 109 -24.025 -22.333 -9.911 1.00 54.00 H new ATOM 0 HA ALA A 109 -21.916 -20.343 -9.528 1.00 24.21 H new ATOM 0 HB1 ALA A 109 -20.525 -22.348 -9.115 1.00 14.02 H new ATOM 0 HB2 ALA A 109 -21.983 -22.333 -8.094 1.00 14.02 H new ATOM 0 HB3 ALA A 109 -21.911 -23.385 -9.527 1.00 14.02 H new ATOM 1632 N LEU A 110 -22.526 -21.381 -12.360 1.00 1.22 N ATOM 1633 CA LEU A 110 -22.162 -21.463 -13.752 1.00 62.21 C ATOM 1634 C LEU A 110 -22.816 -20.313 -14.505 1.00 32.34 C ATOM 1635 O LEU A 110 -23.547 -19.508 -13.925 1.00 74.23 O ATOM 1636 CB LEU A 110 -22.616 -22.810 -14.349 1.00 35.40 C ATOM 1637 CG LEU A 110 -21.750 -24.045 -14.014 1.00 12.11 C ATOM 1638 CD1 LEU A 110 -20.278 -23.780 -14.310 1.00 12.33 C ATOM 1639 CD2 LEU A 110 -21.942 -24.488 -12.565 1.00 71.20 C ATOM 0 H LEU A 110 -23.533 -21.347 -12.200 1.00 1.22 H new ATOM 0 HA LEU A 110 -21.078 -21.395 -13.845 1.00 62.21 H new ATOM 0 HB2 LEU A 110 -23.634 -23.006 -14.011 1.00 35.40 H new ATOM 0 HB3 LEU A 110 -22.655 -22.706 -15.433 1.00 35.40 H new ATOM 0 HG LEU A 110 -22.083 -24.860 -14.656 1.00 12.11 H new ATOM 0 HD11 LEU A 110 -19.692 -24.666 -14.065 1.00 12.33 H new ATOM 0 HD12 LEU A 110 -20.156 -23.546 -15.367 1.00 12.33 H new ATOM 0 HD13 LEU A 110 -19.932 -22.939 -13.710 1.00 12.33 H new ATOM 0 HD21 LEU A 110 -21.318 -25.359 -12.365 1.00 71.20 H new ATOM 0 HD22 LEU A 110 -21.658 -23.676 -11.896 1.00 71.20 H new ATOM 0 HD23 LEU A 110 -22.988 -24.746 -12.399 1.00 71.20 H new ATOM 1651 N ASN A 111 -22.549 -20.274 -15.793 1.00 2.03 N ATOM 1652 CA ASN A 111 -23.054 -19.239 -16.699 1.00 51.20 C ATOM 1653 C ASN A 111 -22.426 -19.456 -18.071 1.00 3.43 C ATOM 1654 O ASN A 111 -23.114 -19.776 -19.042 1.00 20.31 O ATOM 1655 CB ASN A 111 -22.725 -17.831 -16.173 1.00 51.14 C ATOM 1656 CG ASN A 111 -23.149 -16.724 -17.133 1.00 45.04 C ATOM 1657 OD1 ASN A 111 -22.380 -16.300 -17.994 1.00 64.14 O ATOM 1658 ND2 ASN A 111 -24.379 -16.252 -16.992 1.00 71.21 N ATOM 0 H ASN A 111 -21.965 -20.969 -16.258 1.00 2.03 H new ATOM 0 HA ASN A 111 -24.139 -19.313 -16.766 1.00 51.20 H new ATOM 0 HB2 ASN A 111 -23.220 -17.682 -15.214 1.00 51.14 H new ATOM 0 HB3 ASN A 111 -21.653 -17.757 -15.993 1.00 51.14 H new ATOM 0 HD21 ASN A 111 -24.715 -15.513 -17.609 1.00 71.21 H new ATOM 0 HD22 ASN A 111 -24.989 -16.628 -16.266 1.00 71.21 H new ATOM 1665 N ALA A 112 -21.106 -19.305 -18.126 1.00 65.35 N ATOM 1666 CA ALA A 112 -20.320 -19.660 -19.296 1.00 3.51 C ATOM 1667 C ALA A 112 -19.180 -20.570 -18.849 1.00 55.23 C ATOM 1668 O ALA A 112 -19.131 -21.737 -19.285 1.00 20.44 O ATOM 1669 CB ALA A 112 -19.785 -18.412 -19.992 1.00 24.13 C ATOM 1670 OXT ALA A 112 -18.394 -20.138 -17.978 1.00 0.00 O ATOM 0 H ALA A 112 -20.552 -18.931 -17.355 1.00 65.35 H new ATOM 0 HA ALA A 112 -20.947 -20.184 -20.018 1.00 3.51 H new ATOM 0 HB1 ALA A 112 -19.200 -18.704 -20.864 1.00 24.13 H new ATOM 0 HB2 ALA A 112 -20.619 -17.786 -20.308 1.00 24.13 H new ATOM 0 HB3 ALA A 112 -19.153 -17.853 -19.302 1.00 24.13 H new TER 1676 ALA A 112