USER MOD reduce.3.24.130724 H: found=0, std=0, add=987, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 987 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 69 GLN :FLIP amide:sc= 1.72 F(o=1.3,f=3.3) USER MOD Set 1.2: A 70 TYR OH : rot 60:sc= 1.02 USER MOD Set 1.3: A 124 ASN :FLIP amide:sc= 0.576 F(o=2,f=3.3) USER MOD Set 2.1: A 25 GLN : amide:sc= 0 K(o=-0.91,f=-1.9) USER MOD Set 2.2: A 80 ASN :FLIP amide:sc= -0.914 F(o=-3!,f=-0.91) USER MOD Set 3.1: A 22 MET CE :methyl -158:sc= -0.124 (180deg=-1.14) USER MOD Set 3.2: A 71 THR OG1 : rot -32:sc= 0.0206 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS :FLIP no HD1:sc= -0.218 F(o=-0.75,f=-0.22) 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 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 7 HIS : no HD1:sc= -0.0685 X(o=-0.068,f=-0.56) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 9 MET CE :methyl -159:sc= -0.14 (180deg=-0.706) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.0301 X(o=-0.03,f=-0.12) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.0764 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -29:sc= 0.529 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 132:sc= 0.89 (180deg=-0.61) USER MOD Single : A 36 THR OG1 : rot -82:sc= 1.24 USER MOD Single : A 37 SER OG : rot -39:sc= 0.747 USER MOD Single : A 38 CYS SG : rot -94:sc= -4.87! USER MOD Single : A 39 ASN : amide:sc= -0.192 K(o=-0.19,f=-2.9!) USER MOD Single : A 41 ASN : amide:sc= -0.391 X(o=-0.39,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -1.09 X(o=-1.1,f=-1.1) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 73 ASN : amide:sc= -1.04 K(o=-1,f=-2.8!) USER MOD Single : A 75 LYS NZ :NH3+ 171:sc= 1.05 (180deg=0.941) USER MOD Single : A 77 TYR OH : rot 180:sc= -0.0308 USER MOD Single : A 78 LYS NZ :NH3+ 141:sc= 0.884 (180deg=-1.42!) USER MOD Single : A 84 ASN :FLIP amide:sc= -0.0975 F(o=-1.8!,f=-0.097) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.0911 X(o=-0.091,f=-0.11) USER MOD Single : A 91 TYR OH : rot -48:sc= 0.0779 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 51:sc= -1.66! USER MOD Single : A 101 MET CE :methyl -141:sc= -0.0131 (180deg=-1.93!) USER MOD Single : A 103 LYS NZ :NH3+ -118:sc= 1.58 (180deg=0.493) USER MOD Single : A 104 ASN : amide:sc= -0.381 X(o=-0.38,f=-0.86) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00847) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.272 K(o=-0.27,f=-0.86) USER MOD Single : A 117 SER OG : rot 180:sc= 0.00242 USER MOD Single : A 118 LYS NZ :NH3+ -112:sc= 1.25 (180deg=-0.236) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= 0.776 K(o=0.78,f=-0.46) USER MOD Single : A 126 ASN : amide:sc= 0.552 K(o=0.55,f=-1.1) USER MOD Single : A 128 ASN : amide:sc= 0.953 K(o=0.95,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.775 -45.879 -44.090 1.00 73.24 N ATOM 2 CA MET A 1 14.791 -47.240 -43.502 1.00 53.02 C ATOM 3 C MET A 1 13.704 -47.379 -42.440 1.00 61.40 C ATOM 4 O MET A 1 12.814 -48.226 -42.549 1.00 10.15 O ATOM 5 CB MET A 1 16.164 -47.540 -42.883 1.00 60.25 C ATOM 6 CG MET A 1 16.251 -48.894 -42.186 1.00 75.42 C ATOM 7 SD MET A 1 17.864 -49.189 -41.424 1.00 33.20 S ATOM 8 CE MET A 1 17.614 -50.818 -40.712 1.00 63.14 C ATOM 0 H1 MET A 1 15.521 -45.803 -44.810 1.00 73.24 H new ATOM 0 H2 MET A 1 13.850 -45.702 -44.530 1.00 73.24 H new ATOM 0 H3 MET A 1 14.943 -45.176 -43.342 1.00 73.24 H new ATOM 0 HA MET A 1 14.597 -47.957 -44.300 1.00 53.02 H new ATOM 0 HB2 MET A 1 16.921 -47.497 -43.666 1.00 60.25 H new ATOM 0 HB3 MET A 1 16.405 -46.757 -42.164 1.00 60.25 H new ATOM 0 HG2 MET A 1 15.477 -48.954 -41.421 1.00 75.42 H new ATOM 0 HG3 MET A 1 16.046 -49.683 -42.909 1.00 75.42 H new ATOM 0 HE1 MET A 1 18.525 -51.138 -40.206 1.00 63.14 H new ATOM 0 HE2 MET A 1 16.795 -50.780 -39.994 1.00 63.14 H new ATOM 0 HE3 MET A 1 17.371 -51.527 -41.503 1.00 63.14 H new ATOM 20 N ALA A 2 13.783 -46.546 -41.406 1.00 4.20 N ATOM 21 CA ALA A 2 12.844 -46.608 -40.292 1.00 23.41 C ATOM 22 C ALA A 2 11.894 -45.416 -40.308 1.00 34.04 C ATOM 23 O ALA A 2 12.224 -44.348 -40.834 1.00 4.43 O ATOM 24 CB ALA A 2 13.605 -46.668 -38.970 1.00 14.54 C ATOM 0 H ALA A 2 14.491 -45.817 -41.317 1.00 4.20 H new ATOM 0 HA ALA A 2 12.246 -47.513 -40.398 1.00 23.41 H new ATOM 0 HB1 ALA A 2 12.896 -46.714 -38.144 1.00 14.54 H new ATOM 0 HB2 ALA A 2 14.238 -47.555 -38.955 1.00 14.54 H new ATOM 0 HB3 ALA A 2 14.225 -45.778 -38.867 1.00 14.54 H new ATOM 30 N HIS A 3 10.707 -45.619 -39.751 1.00 52.43 N ATOM 31 CA HIS A 3 9.710 -44.564 -39.612 1.00 23.31 C ATOM 32 C HIS A 3 8.642 -45.008 -38.616 1.00 63.32 C ATOM 33 O HIS A 3 7.855 -45.914 -38.899 1.00 44.40 O ATOM 34 CB HIS A 3 9.086 -44.190 -40.973 1.00 42.32 C ATOM 35 CG HIS A 3 8.421 -45.319 -41.716 1.00 31.34 C ATOM 36 ND1 HIS A 3 8.604 -46.662 -41.664 1.00 43.53 N flip ATOM 37 CD2 HIS A 3 7.449 -45.110 -42.671 1.00 4.31 C flip ATOM 38 CE1 HIS A 3 7.750 -47.228 -42.575 1.00 23.24 C flip ATOM 39 NE2 HIS A 3 7.065 -46.270 -43.170 1.00 65.04 N flip ATOM 0 H HIS A 3 10.407 -46.521 -39.382 1.00 52.43 H new ATOM 0 HA HIS A 3 10.199 -43.666 -39.234 1.00 23.31 H new ATOM 0 HB2 HIS A 3 8.350 -43.402 -40.811 1.00 42.32 H new ATOM 0 HB3 HIS A 3 9.867 -43.771 -41.608 1.00 42.32 H new ATOM 0 HD2 HIS A 3 7.062 -44.146 -42.965 1.00 4.31 H new ATOM 0 HE1 HIS A 3 7.654 -48.285 -42.773 1.00 23.24 H new ATOM 0 HE2 HIS A 3 6.358 -46.403 -43.893 1.00 65.04 H new ATOM 48 N HIS A 4 8.637 -44.378 -37.443 1.00 71.22 N ATOM 49 CA HIS A 4 7.772 -44.788 -36.337 1.00 40.44 C ATOM 50 C HIS A 4 6.300 -44.714 -36.728 1.00 42.51 C ATOM 51 O HIS A 4 5.571 -45.702 -36.635 1.00 15.33 O ATOM 52 CB HIS A 4 8.034 -43.911 -35.106 1.00 22.12 C ATOM 53 CG HIS A 4 7.214 -44.294 -33.909 1.00 24.11 C ATOM 54 ND1 HIS A 4 6.314 -43.441 -33.302 1.00 5.22 N ATOM 55 CD2 HIS A 4 7.166 -45.448 -33.205 1.00 70.13 C ATOM 56 CE1 HIS A 4 5.751 -44.058 -32.279 1.00 43.14 C ATOM 57 NE2 HIS A 4 6.250 -45.275 -32.197 1.00 33.43 N ATOM 0 H HIS A 4 9.228 -43.574 -37.232 1.00 71.22 H new ATOM 0 HA HIS A 4 8.006 -45.825 -36.095 1.00 40.44 H new ATOM 0 HB2 HIS A 4 9.091 -43.971 -34.846 1.00 22.12 H new ATOM 0 HB3 HIS A 4 7.827 -42.872 -35.360 1.00 22.12 H new ATOM 0 HD2 HIS A 4 7.742 -46.341 -33.400 1.00 70.13 H new ATOM 0 HE1 HIS A 4 5.007 -43.636 -31.620 1.00 43.14 H new ATOM 0 HE2 HIS A 4 5.997 -45.974 -31.499 1.00 33.43 H new ATOM 66 N HIS A 5 5.876 -43.537 -37.168 1.00 33.03 N ATOM 67 CA HIS A 5 4.486 -43.304 -37.533 1.00 63.31 C ATOM 68 C HIS A 5 4.345 -41.983 -38.280 1.00 14.45 C ATOM 69 O HIS A 5 4.221 -40.919 -37.664 1.00 33.53 O ATOM 70 CB HIS A 5 3.593 -43.312 -36.279 1.00 65.22 C ATOM 71 CG HIS A 5 2.164 -42.933 -36.543 1.00 2.32 C ATOM 72 ND1 HIS A 5 1.499 -41.969 -35.816 1.00 51.22 N ATOM 73 CD2 HIS A 5 1.275 -43.389 -37.460 1.00 52.42 C ATOM 74 CE1 HIS A 5 0.267 -41.850 -36.271 1.00 32.40 C ATOM 75 NE2 HIS A 5 0.106 -42.697 -37.269 1.00 53.32 N ATOM 0 H HIS A 5 6.480 -42.723 -37.281 1.00 33.03 H new ATOM 0 HA HIS A 5 4.162 -44.109 -38.193 1.00 63.31 H new ATOM 0 HB2 HIS A 5 3.618 -44.307 -35.834 1.00 65.22 H new ATOM 0 HB3 HIS A 5 4.011 -42.624 -35.544 1.00 65.22 H new ATOM 0 HD2 HIS A 5 1.454 -44.154 -38.202 1.00 52.42 H new ATOM 0 HE1 HIS A 5 -0.484 -41.173 -35.891 1.00 32.40 H new ATOM 0 HE2 HIS A 5 -0.749 -42.818 -37.811 1.00 53.32 H new ATOM 84 N HIS A 6 4.384 -42.054 -39.610 1.00 75.12 N ATOM 85 CA HIS A 6 4.217 -40.871 -40.447 1.00 34.43 C ATOM 86 C HIS A 6 2.803 -40.316 -40.295 1.00 23.31 C ATOM 87 O HIS A 6 1.898 -40.651 -41.060 1.00 54.44 O ATOM 88 CB HIS A 6 4.517 -41.189 -41.919 1.00 42.00 C ATOM 89 CG HIS A 6 4.412 -39.997 -42.827 1.00 13.52 C ATOM 90 ND1 HIS A 6 3.319 -39.759 -43.632 1.00 32.33 N ATOM 91 CD2 HIS A 6 5.272 -38.976 -43.057 1.00 12.01 C ATOM 92 CE1 HIS A 6 3.510 -38.646 -44.315 1.00 63.32 C ATOM 93 NE2 HIS A 6 4.686 -38.150 -43.985 1.00 73.40 N ATOM 0 H HIS A 6 4.530 -42.920 -40.129 1.00 75.12 H new ATOM 0 HA HIS A 6 4.929 -40.115 -40.117 1.00 34.43 H new ATOM 0 HB2 HIS A 6 5.522 -41.605 -41.994 1.00 42.00 H new ATOM 0 HB3 HIS A 6 3.827 -41.959 -42.263 1.00 42.00 H new ATOM 0 HD2 HIS A 6 6.239 -38.837 -42.596 1.00 12.01 H new ATOM 0 HE1 HIS A 6 2.819 -38.214 -45.024 1.00 63.32 H new ATOM 0 HE2 HIS A 6 5.094 -37.293 -44.358 1.00 73.40 H new ATOM 102 N HIS A 7 2.621 -39.494 -39.273 1.00 62.42 N ATOM 103 CA HIS A 7 1.323 -38.907 -38.965 1.00 65.13 C ATOM 104 C HIS A 7 0.985 -37.786 -39.940 1.00 32.10 C ATOM 105 O HIS A 7 1.877 -37.151 -40.499 1.00 12.14 O ATOM 106 CB HIS A 7 1.303 -38.382 -37.524 1.00 65.21 C ATOM 107 CG HIS A 7 2.437 -37.453 -37.192 1.00 32.15 C ATOM 108 ND1 HIS A 7 3.614 -37.880 -36.613 1.00 30.24 N ATOM 109 CD2 HIS A 7 2.573 -36.115 -37.365 1.00 1.33 C ATOM 110 CE1 HIS A 7 4.420 -36.847 -36.440 1.00 0.14 C ATOM 111 NE2 HIS A 7 3.811 -35.767 -36.889 1.00 45.42 N ATOM 0 H HIS A 7 3.366 -39.215 -38.634 1.00 62.42 H new ATOM 0 HA HIS A 7 0.567 -39.686 -39.067 1.00 65.13 H new ATOM 0 HB2 HIS A 7 0.360 -37.863 -37.351 1.00 65.21 H new ATOM 0 HB3 HIS A 7 1.330 -39.230 -36.840 1.00 65.21 H new ATOM 0 HD2 HIS A 7 1.842 -35.448 -37.797 1.00 1.33 H new ATOM 0 HE1 HIS A 7 5.408 -36.881 -36.005 1.00 0.14 H new ATOM 0 HE2 HIS A 7 4.199 -34.824 -36.883 1.00 45.42 H new ATOM 120 N HIS A 8 -0.305 -37.550 -40.135 1.00 13.45 N ATOM 121 CA HIS A 8 -0.771 -36.495 -41.031 1.00 23.23 C ATOM 122 C HIS A 8 -1.031 -35.211 -40.250 1.00 74.33 C ATOM 123 O HIS A 8 -1.228 -35.244 -39.033 1.00 52.42 O ATOM 124 CB HIS A 8 -2.045 -36.935 -41.768 1.00 33.02 C ATOM 125 CG HIS A 8 -1.836 -38.082 -42.717 1.00 23.32 C ATOM 126 ND1 HIS A 8 -2.617 -39.220 -42.715 1.00 24.34 N ATOM 127 CD2 HIS A 8 -0.933 -38.255 -43.713 1.00 53.33 C ATOM 128 CE1 HIS A 8 -2.204 -40.037 -43.667 1.00 31.13 C ATOM 129 NE2 HIS A 8 -1.185 -39.475 -44.286 1.00 15.55 N ATOM 0 H HIS A 8 -1.053 -38.077 -39.683 1.00 13.45 H new ATOM 0 HA HIS A 8 0.008 -36.304 -41.770 1.00 23.23 H new ATOM 0 HB2 HIS A 8 -2.799 -37.217 -41.033 1.00 33.02 H new ATOM 0 HB3 HIS A 8 -2.443 -36.086 -42.323 1.00 33.02 H new ATOM 0 HD2 HIS A 8 -0.158 -37.560 -44.002 1.00 53.33 H new ATOM 0 HE1 HIS A 8 -2.629 -41.002 -43.899 1.00 31.13 H new ATOM 0 HE2 HIS A 8 -0.668 -39.882 -45.065 1.00 15.55 H new ATOM 138 N MET A 9 -1.024 -34.085 -40.959 1.00 13.43 N ATOM 139 CA MET A 9 -1.254 -32.778 -40.350 1.00 15.14 C ATOM 140 C MET A 9 -2.738 -32.580 -40.058 1.00 73.11 C ATOM 141 O MET A 9 -3.591 -33.259 -40.639 1.00 44.24 O ATOM 142 CB MET A 9 -0.750 -31.657 -41.274 1.00 12.04 C ATOM 143 CG MET A 9 0.742 -31.726 -41.577 1.00 32.20 C ATOM 144 SD MET A 9 1.294 -30.394 -42.667 1.00 63.45 S ATOM 145 CE MET A 9 0.294 -30.700 -44.124 1.00 61.35 C ATOM 0 H MET A 9 -0.860 -34.052 -41.965 1.00 13.43 H new ATOM 0 HA MET A 9 -0.701 -32.737 -39.412 1.00 15.14 H new ATOM 0 HB2 MET A 9 -1.303 -31.698 -42.212 1.00 12.04 H new ATOM 0 HB3 MET A 9 -0.973 -30.694 -40.814 1.00 12.04 H new ATOM 0 HG2 MET A 9 1.301 -31.680 -40.642 1.00 32.20 H new ATOM 0 HG3 MET A 9 0.971 -32.686 -42.039 1.00 32.20 H new ATOM 0 HE1 MET A 9 0.759 -30.229 -44.990 1.00 61.35 H new ATOM 0 HE2 MET A 9 0.217 -31.774 -44.293 1.00 61.35 H new ATOM 0 HE3 MET A 9 -0.702 -30.284 -43.975 1.00 61.35 H new ATOM 155 N GLY A 10 -3.038 -31.652 -39.159 1.00 21.04 N ATOM 156 CA GLY A 10 -4.416 -31.366 -38.811 1.00 12.25 C ATOM 157 C GLY A 10 -4.545 -30.759 -37.429 1.00 70.45 C ATOM 158 O GLY A 10 -3.642 -30.886 -36.598 1.00 34.22 O ATOM 0 H GLY A 10 -2.347 -31.089 -38.662 1.00 21.04 H new ATOM 0 HA2 GLY A 10 -4.840 -30.683 -39.547 1.00 12.25 H new ATOM 0 HA3 GLY A 10 -4.999 -32.286 -38.857 1.00 12.25 H new ATOM 162 N THR A 11 -5.664 -30.091 -37.185 1.00 23.34 N ATOM 163 CA THR A 11 -5.947 -29.488 -35.890 1.00 5.34 C ATOM 164 C THR A 11 -7.386 -29.790 -35.474 1.00 73.25 C ATOM 165 O THR A 11 -8.336 -29.344 -36.117 1.00 41.22 O ATOM 166 CB THR A 11 -5.708 -27.959 -35.934 1.00 3.23 C ATOM 167 OG1 THR A 11 -4.351 -27.699 -36.329 1.00 31.45 O ATOM 168 CG2 THR A 11 -5.982 -27.308 -34.579 1.00 54.52 C ATOM 0 H THR A 11 -6.400 -29.952 -37.878 1.00 23.34 H new ATOM 0 HA THR A 11 -5.269 -29.918 -35.152 1.00 5.34 H new ATOM 0 HB THR A 11 -6.399 -27.528 -36.659 1.00 3.23 H new ATOM 0 HG1 THR A 11 -4.199 -26.731 -36.359 1.00 31.45 H new ATOM 0 HG21 THR A 11 -5.804 -26.235 -34.648 1.00 54.52 H new ATOM 0 HG22 THR A 11 -7.019 -27.486 -34.293 1.00 54.52 H new ATOM 0 HG23 THR A 11 -5.319 -27.738 -33.828 1.00 54.52 H new ATOM 176 N LEU A 12 -7.536 -30.548 -34.393 1.00 74.23 N ATOM 177 CA LEU A 12 -8.848 -31.012 -33.935 1.00 43.44 C ATOM 178 C LEU A 12 -9.478 -29.998 -32.981 1.00 71.21 C ATOM 179 O LEU A 12 -10.338 -30.346 -32.173 1.00 3.42 O ATOM 180 CB LEU A 12 -8.725 -32.383 -33.243 1.00 12.22 C ATOM 181 CG LEU A 12 -8.321 -33.566 -34.151 1.00 24.24 C ATOM 182 CD1 LEU A 12 -9.270 -33.681 -35.344 1.00 50.32 C ATOM 183 CD2 LEU A 12 -6.868 -33.445 -34.617 1.00 34.25 C ATOM 0 H LEU A 12 -6.759 -30.859 -33.810 1.00 74.23 H new ATOM 0 HA LEU A 12 -9.494 -31.116 -34.807 1.00 43.44 H new ATOM 0 HB2 LEU A 12 -7.991 -32.299 -32.442 1.00 12.22 H new ATOM 0 HB3 LEU A 12 -9.681 -32.619 -32.776 1.00 12.22 H new ATOM 0 HG LEU A 12 -8.401 -34.479 -33.561 1.00 24.24 H new ATOM 0 HD11 LEU A 12 -8.967 -34.520 -35.970 1.00 50.32 H new ATOM 0 HD12 LEU A 12 -10.287 -33.844 -34.986 1.00 50.32 H new ATOM 0 HD13 LEU A 12 -9.234 -32.761 -35.928 1.00 50.32 H new ATOM 0 HD21 LEU A 12 -6.618 -34.294 -35.254 1.00 34.25 H new ATOM 0 HD22 LEU A 12 -6.742 -32.520 -35.180 1.00 34.25 H new ATOM 0 HD23 LEU A 12 -6.207 -33.435 -33.750 1.00 34.25 H new ATOM 195 N GLU A 13 -9.053 -28.739 -33.107 1.00 14.14 N ATOM 196 CA GLU A 13 -9.536 -27.654 -32.256 1.00 12.15 C ATOM 197 C GLU A 13 -9.223 -27.940 -30.785 1.00 4.31 C ATOM 198 O GLU A 13 -10.033 -28.517 -30.054 1.00 75.42 O ATOM 199 CB GLU A 13 -11.039 -27.418 -32.472 1.00 73.01 C ATOM 200 CG GLU A 13 -11.622 -26.289 -31.629 1.00 3.41 C ATOM 201 CD GLU A 13 -13.060 -25.973 -32.000 1.00 32.20 C ATOM 202 OE1 GLU A 13 -13.307 -24.894 -32.587 1.00 74.13 O ATOM 203 OE2 GLU A 13 -13.949 -26.804 -31.723 1.00 51.23 O1- ATOM 0 H GLU A 13 -8.366 -28.445 -33.801 1.00 14.14 H new ATOM 0 HA GLU A 13 -9.014 -26.739 -32.536 1.00 12.15 H new ATOM 0 HB2 GLU A 13 -11.213 -27.197 -33.525 1.00 73.01 H new ATOM 0 HB3 GLU A 13 -11.576 -28.339 -32.247 1.00 73.01 H new ATOM 0 HG2 GLU A 13 -11.573 -26.564 -30.575 1.00 3.41 H new ATOM 0 HG3 GLU A 13 -11.012 -25.394 -31.754 1.00 3.41 H new ATOM 210 N ALA A 14 -8.020 -27.557 -30.380 1.00 44.53 N ATOM 211 CA ALA A 14 -7.544 -27.746 -29.017 1.00 21.22 C ATOM 212 C ALA A 14 -6.363 -26.818 -28.768 1.00 50.53 C ATOM 213 O ALA A 14 -5.217 -27.151 -29.082 1.00 52.13 O ATOM 214 CB ALA A 14 -7.154 -29.201 -28.774 1.00 0.11 C ATOM 0 H ALA A 14 -7.342 -27.103 -30.993 1.00 44.53 H new ATOM 0 HA ALA A 14 -8.345 -27.502 -28.319 1.00 21.22 H new ATOM 0 HB1 ALA A 14 -6.802 -29.317 -27.749 1.00 0.11 H new ATOM 0 HB2 ALA A 14 -8.021 -29.842 -28.934 1.00 0.11 H new ATOM 0 HB3 ALA A 14 -6.360 -29.485 -29.465 1.00 0.11 H new ATOM 220 N GLN A 15 -6.658 -25.638 -28.240 1.00 4.44 N ATOM 221 CA GLN A 15 -5.650 -24.604 -28.046 1.00 35.21 C ATOM 222 C GLN A 15 -4.749 -24.957 -26.867 1.00 15.42 C ATOM 223 O GLN A 15 -5.125 -24.783 -25.705 1.00 13.51 O ATOM 224 CB GLN A 15 -6.326 -23.236 -27.843 1.00 23.33 C ATOM 225 CG GLN A 15 -7.364 -22.904 -28.916 1.00 20.14 C ATOM 226 CD GLN A 15 -6.813 -23.016 -30.330 1.00 2.31 C ATOM 227 OE1 GLN A 15 -6.858 -24.083 -30.944 1.00 15.13 O ATOM 228 NE2 GLN A 15 -6.303 -21.917 -30.860 1.00 70.34 N ATOM 0 H GLN A 15 -7.595 -25.372 -27.936 1.00 4.44 H new ATOM 0 HA GLN A 15 -5.026 -24.543 -28.938 1.00 35.21 H new ATOM 0 HB2 GLN A 15 -6.807 -23.219 -26.865 1.00 23.33 H new ATOM 0 HB3 GLN A 15 -5.561 -22.459 -27.835 1.00 23.33 H new ATOM 0 HG2 GLN A 15 -8.216 -23.575 -28.810 1.00 20.14 H new ATOM 0 HG3 GLN A 15 -7.734 -21.891 -28.755 1.00 20.14 H new ATOM 0 HE21 GLN A 15 -6.283 -21.052 -30.320 1.00 70.34 H new ATOM 0 HE22 GLN A 15 -5.929 -21.934 -31.809 1.00 70.34 H new ATOM 237 N THR A 16 -3.575 -25.497 -27.179 1.00 54.35 N ATOM 238 CA THR A 16 -2.608 -25.887 -26.164 1.00 70.15 C ATOM 239 C THR A 16 -2.087 -24.663 -25.404 1.00 32.44 C ATOM 240 O THR A 16 -2.177 -23.533 -25.896 1.00 63.23 O ATOM 241 CB THR A 16 -1.426 -26.673 -26.784 1.00 55.41 C ATOM 242 OG1 THR A 16 -0.512 -27.087 -25.759 1.00 33.34 O ATOM 243 CG2 THR A 16 -0.687 -25.840 -27.826 1.00 42.31 C ATOM 0 H THR A 16 -3.271 -25.675 -28.136 1.00 54.35 H new ATOM 0 HA THR A 16 -3.121 -26.542 -25.460 1.00 70.15 H new ATOM 0 HB THR A 16 -1.838 -27.552 -27.280 1.00 55.41 H new ATOM 0 HG1 THR A 16 0.230 -27.584 -26.163 1.00 33.34 H new ATOM 0 HG21 THR A 16 0.136 -26.422 -28.240 1.00 42.31 H new ATOM 0 HG22 THR A 16 -1.375 -25.564 -28.625 1.00 42.31 H new ATOM 0 HG23 THR A 16 -0.293 -24.938 -27.358 1.00 42.31 H new ATOM 251 N GLN A 17 -1.540 -24.912 -24.208 1.00 5.12 N ATOM 252 CA GLN A 17 -1.072 -23.856 -23.301 1.00 31.24 C ATOM 253 C GLN A 17 -2.261 -23.092 -22.695 1.00 21.02 C ATOM 254 O GLN A 17 -2.092 -22.058 -22.050 1.00 15.31 O ATOM 255 CB GLN A 17 -0.096 -22.900 -24.023 1.00 44.40 C ATOM 256 CG GLN A 17 0.529 -21.837 -23.123 1.00 20.35 C ATOM 257 CD GLN A 17 1.490 -20.919 -23.858 1.00 71.40 C ATOM 258 OE1 GLN A 17 2.164 -21.329 -24.805 1.00 24.53 O ATOM 259 NE2 GLN A 17 1.547 -19.667 -23.435 1.00 70.42 N ATOM 0 H GLN A 17 -1.409 -25.854 -23.841 1.00 5.12 H new ATOM 0 HA GLN A 17 -0.527 -24.326 -22.482 1.00 31.24 H new ATOM 0 HB2 GLN A 17 0.701 -23.489 -24.476 1.00 44.40 H new ATOM 0 HB3 GLN A 17 -0.627 -22.404 -24.835 1.00 44.40 H new ATOM 0 HG2 GLN A 17 -0.264 -21.238 -22.675 1.00 20.35 H new ATOM 0 HG3 GLN A 17 1.059 -22.328 -22.306 1.00 20.35 H new ATOM 0 HE21 GLN A 17 0.972 -19.368 -22.647 1.00 70.42 H new ATOM 0 HE22 GLN A 17 2.166 -19.000 -23.897 1.00 70.42 H new ATOM 268 N GLY A 18 -3.466 -23.627 -22.891 1.00 22.20 N ATOM 269 CA GLY A 18 -4.655 -23.034 -22.304 1.00 74.21 C ATOM 270 C GLY A 18 -4.625 -23.102 -20.783 1.00 24.32 C ATOM 271 O GLY A 18 -4.681 -24.194 -20.215 1.00 62.33 O ATOM 0 H GLY A 18 -3.638 -24.464 -23.448 1.00 22.20 H new ATOM 0 HA2 GLY A 18 -4.737 -21.994 -22.620 1.00 74.21 H new ATOM 0 HA3 GLY A 18 -5.540 -23.551 -22.674 1.00 74.21 H new ATOM 275 N PRO A 19 -4.511 -21.949 -20.093 1.00 54.21 N ATOM 276 CA PRO A 19 -4.435 -21.907 -18.634 1.00 75.33 C ATOM 277 C PRO A 19 -5.814 -22.010 -17.979 1.00 4.25 C ATOM 278 O PRO A 19 -6.830 -21.650 -18.582 1.00 21.34 O ATOM 279 CB PRO A 19 -3.797 -20.541 -18.366 1.00 30.43 C ATOM 280 CG PRO A 19 -4.263 -19.681 -19.494 1.00 41.32 C ATOM 281 CD PRO A 19 -4.447 -20.595 -20.686 1.00 21.44 C ATOM 0 HA PRO A 19 -3.872 -22.743 -18.219 1.00 75.33 H new ATOM 0 HB2 PRO A 19 -4.112 -20.138 -17.404 1.00 30.43 H new ATOM 0 HB3 PRO A 19 -2.709 -20.609 -18.342 1.00 30.43 H new ATOM 0 HG2 PRO A 19 -5.198 -19.182 -19.240 1.00 41.32 H new ATOM 0 HG3 PRO A 19 -3.534 -18.900 -19.713 1.00 41.32 H new ATOM 0 HD2 PRO A 19 -5.358 -20.356 -21.235 1.00 21.44 H new ATOM 0 HD3 PRO A 19 -3.619 -20.506 -21.389 1.00 21.44 H new ATOM 289 N GLY A 20 -5.843 -22.499 -16.744 1.00 0.13 N ATOM 290 CA GLY A 20 -7.097 -22.657 -16.032 1.00 11.40 C ATOM 291 C GLY A 20 -6.904 -23.243 -14.647 1.00 30.41 C ATOM 292 O GLY A 20 -5.950 -22.893 -13.945 1.00 31.00 O ATOM 0 H GLY A 20 -5.017 -22.790 -16.222 1.00 0.13 H new ATOM 0 HA2 GLY A 20 -7.589 -21.688 -15.948 1.00 11.40 H new ATOM 0 HA3 GLY A 20 -7.760 -23.303 -16.608 1.00 11.40 H new ATOM 296 N SER A 21 -7.806 -24.142 -14.260 1.00 65.42 N ATOM 297 CA SER A 21 -7.766 -24.777 -12.949 1.00 70.35 C ATOM 298 C SER A 21 -6.811 -25.975 -12.950 1.00 61.03 C ATOM 299 O SER A 21 -6.333 -26.395 -14.003 1.00 35.42 O ATOM 300 CB SER A 21 -9.179 -25.223 -12.543 1.00 2.21 C ATOM 301 OG SER A 21 -10.070 -24.120 -12.524 1.00 14.23 O ATOM 0 H SER A 21 -8.582 -24.449 -14.846 1.00 65.42 H new ATOM 0 HA SER A 21 -7.397 -24.052 -12.224 1.00 70.35 H new ATOM 0 HB2 SER A 21 -9.542 -25.977 -13.241 1.00 2.21 H new ATOM 0 HB3 SER A 21 -9.149 -25.689 -11.558 1.00 2.21 H new ATOM 0 HG SER A 21 -10.964 -24.426 -12.265 1.00 14.23 H new ATOM 307 N MET A 22 -6.537 -26.509 -11.760 1.00 71.32 N ATOM 308 CA MET A 22 -5.665 -27.678 -11.608 1.00 14.44 C ATOM 309 C MET A 22 -6.386 -28.956 -12.024 1.00 34.21 C ATOM 310 O MET A 22 -5.755 -29.989 -12.251 1.00 25.22 O ATOM 311 CB MET A 22 -5.187 -27.805 -10.153 1.00 32.01 C ATOM 312 CG MET A 22 -4.189 -26.732 -9.737 1.00 64.35 C ATOM 313 SD MET A 22 -2.612 -26.869 -10.606 1.00 62.34 S ATOM 314 CE MET A 22 -2.055 -28.490 -10.071 1.00 41.55 C ATOM 0 H MET A 22 -6.908 -26.149 -10.881 1.00 71.32 H new ATOM 0 HA MET A 22 -4.802 -27.537 -12.259 1.00 14.44 H new ATOM 0 HB2 MET A 22 -6.052 -27.760 -9.491 1.00 32.01 H new ATOM 0 HB3 MET A 22 -4.731 -28.785 -10.015 1.00 32.01 H new ATOM 0 HG2 MET A 22 -4.619 -25.749 -9.927 1.00 64.35 H new ATOM 0 HG3 MET A 22 -4.014 -26.801 -8.663 1.00 64.35 H new ATOM 0 HE1 MET A 22 -0.973 -28.559 -10.187 1.00 41.55 H new ATOM 0 HE2 MET A 22 -2.318 -28.638 -9.024 1.00 41.55 H new ATOM 0 HE3 MET A 22 -2.535 -29.258 -10.678 1.00 41.55 H new ATOM 324 N ILE A 23 -7.710 -28.882 -12.104 1.00 11.52 N ATOM 325 CA ILE A 23 -8.519 -30.027 -12.497 1.00 62.20 C ATOM 326 C ILE A 23 -8.601 -30.094 -14.019 1.00 11.52 C ATOM 327 O ILE A 23 -9.225 -29.240 -14.656 1.00 51.53 O ATOM 328 CB ILE A 23 -9.944 -29.956 -11.895 1.00 4.53 C ATOM 329 CG1 ILE A 23 -9.885 -29.588 -10.398 1.00 14.53 C ATOM 330 CG2 ILE A 23 -10.664 -31.288 -12.090 1.00 3.25 C ATOM 331 CD1 ILE A 23 -9.079 -30.555 -9.553 1.00 12.43 C ATOM 0 H ILE A 23 -8.246 -28.038 -11.901 1.00 11.52 H new ATOM 0 HA ILE A 23 -8.041 -30.927 -12.110 1.00 62.20 H new ATOM 0 HB ILE A 23 -10.502 -29.177 -12.415 1.00 4.53 H new ATOM 0 HG12 ILE A 23 -9.457 -28.591 -10.297 1.00 14.53 H new ATOM 0 HG13 ILE A 23 -10.901 -29.540 -10.006 1.00 14.53 H new ATOM 0 HG21 ILE A 23 -11.665 -31.226 -11.663 1.00 3.25 H new ATOM 0 HG22 ILE A 23 -10.737 -31.510 -13.155 1.00 3.25 H new ATOM 0 HG23 ILE A 23 -10.105 -32.080 -11.592 1.00 3.25 H new ATOM 0 HD11 ILE A 23 -9.087 -30.225 -8.514 1.00 12.43 H new ATOM 0 HD12 ILE A 23 -9.518 -31.550 -9.621 1.00 12.43 H new ATOM 0 HD13 ILE A 23 -8.052 -30.586 -9.916 1.00 12.43 H new ATOM 343 N GLU A 24 -7.971 -31.113 -14.589 1.00 63.12 N ATOM 344 CA GLU A 24 -7.801 -31.217 -16.033 1.00 10.03 C ATOM 345 C GLU A 24 -9.029 -31.863 -16.680 1.00 51.50 C ATOM 346 O GLU A 24 -9.304 -33.042 -16.467 1.00 10.23 O ATOM 347 CB GLU A 24 -6.537 -32.040 -16.324 1.00 41.42 C ATOM 348 CG GLU A 24 -6.091 -32.044 -17.782 1.00 40.21 C ATOM 349 CD GLU A 24 -4.797 -32.821 -17.986 1.00 32.25 C ATOM 350 OE1 GLU A 24 -3.773 -32.458 -17.365 1.00 35.10 O ATOM 351 OE2 GLU A 24 -4.791 -33.798 -18.761 1.00 70.14 O1- ATOM 0 H GLU A 24 -7.565 -31.888 -14.066 1.00 63.12 H new ATOM 0 HA GLU A 24 -7.693 -30.220 -16.459 1.00 10.03 H new ATOM 0 HB2 GLU A 24 -5.722 -31.654 -15.712 1.00 41.42 H new ATOM 0 HB3 GLU A 24 -6.712 -33.069 -16.011 1.00 41.42 H new ATOM 0 HG2 GLU A 24 -6.876 -32.481 -18.399 1.00 40.21 H new ATOM 0 HG3 GLU A 24 -5.953 -31.017 -18.121 1.00 40.21 H new ATOM 358 N GLN A 25 -9.774 -31.085 -17.458 1.00 3.42 N ATOM 359 CA GLN A 25 -10.950 -31.607 -18.152 1.00 70.21 C ATOM 360 C GLN A 25 -10.522 -32.279 -19.458 1.00 62.55 C ATOM 361 O GLN A 25 -9.704 -31.732 -20.203 1.00 71.41 O ATOM 362 CB GLN A 25 -11.972 -30.487 -18.427 1.00 35.52 C ATOM 363 CG GLN A 25 -11.499 -29.437 -19.427 1.00 35.52 C ATOM 364 CD GLN A 25 -12.517 -28.331 -19.663 1.00 34.41 C ATOM 365 OE1 GLN A 25 -13.725 -28.532 -19.529 1.00 41.35 O ATOM 366 NE2 GLN A 25 -12.033 -27.161 -20.047 1.00 13.53 N ATOM 0 H GLN A 25 -9.588 -30.096 -17.625 1.00 3.42 H new ATOM 0 HA GLN A 25 -11.433 -32.346 -17.513 1.00 70.21 H new ATOM 0 HB2 GLN A 25 -12.894 -30.935 -18.798 1.00 35.52 H new ATOM 0 HB3 GLN A 25 -12.214 -29.993 -17.486 1.00 35.52 H new ATOM 0 HG2 GLN A 25 -10.569 -28.995 -19.068 1.00 35.52 H new ATOM 0 HG3 GLN A 25 -11.275 -29.924 -20.376 1.00 35.52 H new ATOM 0 HE21 GLN A 25 -11.026 -27.034 -20.147 1.00 13.53 H new ATOM 0 HE22 GLN A 25 -12.667 -26.386 -20.243 1.00 13.53 H new ATOM 375 N ILE A 26 -11.067 -33.463 -19.734 1.00 73.45 N ATOM 376 CA ILE A 26 -10.673 -34.232 -20.918 1.00 30.23 C ATOM 377 C ILE A 26 -11.890 -34.740 -21.685 1.00 44.22 C ATOM 378 O ILE A 26 -13.024 -34.690 -21.188 1.00 73.54 O ATOM 379 CB ILE A 26 -9.765 -35.440 -20.556 1.00 32.02 C ATOM 380 CG1 ILE A 26 -10.488 -36.402 -19.596 1.00 24.53 C ATOM 381 CG2 ILE A 26 -8.445 -34.961 -19.953 1.00 54.44 C ATOM 382 CD1 ILE A 26 -9.701 -37.659 -19.273 1.00 35.42 C ATOM 0 H ILE A 26 -11.780 -33.911 -19.158 1.00 73.45 H new ATOM 0 HA ILE A 26 -10.108 -33.546 -21.548 1.00 30.23 H new ATOM 0 HB ILE A 26 -9.543 -35.984 -21.474 1.00 32.02 H new ATOM 0 HG12 ILE A 26 -10.708 -35.875 -18.668 1.00 24.53 H new ATOM 0 HG13 ILE A 26 -11.444 -36.687 -20.035 1.00 24.53 H new ATOM 0 HG21 ILE A 26 -7.824 -35.822 -19.707 1.00 54.44 H new ATOM 0 HG22 ILE A 26 -7.923 -34.331 -20.674 1.00 54.44 H new ATOM 0 HG23 ILE A 26 -8.645 -34.387 -19.048 1.00 54.44 H new ATOM 0 HD11 ILE A 26 -10.278 -38.284 -18.592 1.00 35.42 H new ATOM 0 HD12 ILE A 26 -9.503 -38.211 -20.192 1.00 35.42 H new ATOM 0 HD13 ILE A 26 -8.756 -37.386 -18.803 1.00 35.42 H new ATOM 394 N GLY A 27 -11.643 -35.224 -22.897 1.00 62.23 N ATOM 395 CA GLY A 27 -12.698 -35.769 -23.729 1.00 35.05 C ATOM 396 C GLY A 27 -12.772 -37.282 -23.654 1.00 75.43 C ATOM 397 O GLY A 27 -11.962 -37.919 -22.977 1.00 55.43 O ATOM 0 H GLY A 27 -10.716 -35.248 -23.322 1.00 62.23 H new ATOM 0 HA2 GLY A 27 -13.654 -35.346 -23.422 1.00 35.05 H new ATOM 0 HA3 GLY A 27 -12.534 -35.467 -24.763 1.00 35.05 H new ATOM 401 N ASP A 28 -13.733 -37.850 -24.377 1.00 55.22 N ATOM 402 CA ASP A 28 -14.001 -39.293 -24.360 1.00 30.13 C ATOM 403 C ASP A 28 -12.773 -40.109 -24.764 1.00 31.43 C ATOM 404 O ASP A 28 -12.307 -40.970 -24.013 1.00 52.43 O ATOM 405 CB ASP A 28 -15.176 -39.599 -25.302 1.00 2.44 C ATOM 406 CG ASP A 28 -15.323 -41.078 -25.639 1.00 31.34 C ATOM 407 OD1 ASP A 28 -15.882 -41.836 -24.824 1.00 33.35 O ATOM 408 OD2 ASP A 28 -14.908 -41.480 -26.750 1.00 65.03 O1- ATOM 0 H ASP A 28 -14.352 -37.325 -24.994 1.00 55.22 H new ATOM 0 HA ASP A 28 -14.255 -39.580 -23.340 1.00 30.13 H new ATOM 0 HB2 ASP A 28 -16.100 -39.247 -24.843 1.00 2.44 H new ATOM 0 HB3 ASP A 28 -15.045 -39.036 -26.226 1.00 2.44 H new ATOM 413 N SER A 29 -12.230 -39.810 -25.939 1.00 43.14 N ATOM 414 CA SER A 29 -11.134 -40.595 -26.507 1.00 21.41 C ATOM 415 C SER A 29 -9.833 -40.422 -25.710 1.00 74.42 C ATOM 416 O SER A 29 -8.824 -41.062 -26.019 1.00 31.25 O ATOM 417 CB SER A 29 -10.917 -40.208 -27.978 1.00 13.32 C ATOM 418 OG SER A 29 -9.951 -41.047 -28.600 1.00 44.32 O ATOM 0 H SER A 29 -12.530 -39.028 -26.520 1.00 43.14 H new ATOM 0 HA SER A 29 -11.413 -41.647 -26.449 1.00 21.41 H new ATOM 0 HB2 SER A 29 -11.862 -40.277 -28.517 1.00 13.32 H new ATOM 0 HB3 SER A 29 -10.591 -39.170 -28.038 1.00 13.32 H new ATOM 0 HG SER A 29 -9.312 -41.364 -27.928 1.00 44.32 H new ATOM 424 N GLU A 30 -9.855 -39.573 -24.685 1.00 44.24 N ATOM 425 CA GLU A 30 -8.673 -39.319 -23.869 1.00 41.13 C ATOM 426 C GLU A 30 -8.692 -40.140 -22.584 1.00 44.35 C ATOM 427 O GLU A 30 -7.690 -40.185 -21.876 1.00 55.03 O ATOM 428 CB GLU A 30 -8.555 -37.827 -23.527 1.00 34.32 C ATOM 429 CG GLU A 30 -8.315 -36.933 -24.737 1.00 30.32 C ATOM 430 CD GLU A 30 -8.059 -35.486 -24.352 1.00 70.04 C ATOM 431 OE1 GLU A 30 -9.027 -34.764 -24.050 1.00 75.54 O ATOM 432 OE2 GLU A 30 -6.880 -35.072 -24.342 1.00 72.31 O1- ATOM 0 H GLU A 30 -10.682 -39.048 -24.400 1.00 44.24 H new ATOM 0 HA GLU A 30 -7.806 -39.620 -24.457 1.00 41.13 H new ATOM 0 HB2 GLU A 30 -9.468 -37.506 -23.026 1.00 34.32 H new ATOM 0 HB3 GLU A 30 -7.738 -37.690 -22.819 1.00 34.32 H new ATOM 0 HG2 GLU A 30 -7.462 -37.312 -25.300 1.00 30.32 H new ATOM 0 HG3 GLU A 30 -9.181 -36.982 -25.398 1.00 30.32 H new ATOM 439 N PHE A 31 -9.819 -40.788 -22.282 1.00 52.35 N ATOM 440 CA PHE A 31 -9.941 -41.570 -21.046 1.00 4.33 C ATOM 441 C PHE A 31 -8.833 -42.619 -20.957 1.00 54.44 C ATOM 442 O PHE A 31 -7.980 -42.565 -20.064 1.00 42.52 O ATOM 443 CB PHE A 31 -11.319 -42.248 -20.967 1.00 52.22 C ATOM 444 CG PHE A 31 -11.472 -43.177 -19.786 1.00 11.55 C ATOM 445 CD1 PHE A 31 -11.600 -44.548 -19.970 1.00 31.15 C ATOM 446 CD2 PHE A 31 -11.486 -42.680 -18.489 1.00 33.32 C ATOM 447 CE1 PHE A 31 -11.737 -45.399 -18.889 1.00 3.32 C ATOM 448 CE2 PHE A 31 -11.623 -43.527 -17.406 1.00 65.25 C ATOM 449 CZ PHE A 31 -11.749 -44.887 -17.605 1.00 11.43 C ATOM 0 H PHE A 31 -10.654 -40.789 -22.868 1.00 52.35 H new ATOM 0 HA PHE A 31 -9.840 -40.886 -20.203 1.00 4.33 H new ATOM 0 HB2 PHE A 31 -12.090 -41.479 -20.915 1.00 52.22 H new ATOM 0 HB3 PHE A 31 -11.491 -42.810 -21.885 1.00 52.22 H new ATOM 0 HD1 PHE A 31 -11.592 -44.954 -20.971 1.00 31.15 H new ATOM 0 HD2 PHE A 31 -11.388 -41.617 -18.325 1.00 33.32 H new ATOM 0 HE1 PHE A 31 -11.835 -46.463 -19.048 1.00 3.32 H new ATOM 0 HE2 PHE A 31 -11.631 -43.125 -16.404 1.00 65.25 H new ATOM 0 HZ PHE A 31 -11.857 -45.550 -16.759 1.00 11.43 H new ATOM 459 N ASP A 32 -8.826 -43.541 -21.917 1.00 24.45 N ATOM 460 CA ASP A 32 -7.823 -44.607 -21.957 1.00 14.44 C ATOM 461 C ASP A 32 -6.420 -44.019 -21.927 1.00 54.45 C ATOM 462 O ASP A 32 -5.581 -44.420 -21.121 1.00 73.42 O ATOM 463 CB ASP A 32 -8.000 -45.468 -23.218 1.00 2.53 C ATOM 464 CG ASP A 32 -6.867 -46.473 -23.406 1.00 22.33 C ATOM 465 OD1 ASP A 32 -6.990 -47.618 -22.926 1.00 54.10 O ATOM 466 OD2 ASP A 32 -5.847 -46.118 -24.041 1.00 35.01 O1- ATOM 0 H ASP A 32 -9.503 -43.573 -22.679 1.00 24.45 H new ATOM 0 HA ASP A 32 -7.962 -45.237 -21.078 1.00 14.44 H new ATOM 0 HB2 ASP A 32 -8.948 -46.002 -23.159 1.00 2.53 H new ATOM 0 HB3 ASP A 32 -8.054 -44.819 -24.092 1.00 2.53 H new ATOM 471 N ASN A 33 -6.195 -43.041 -22.795 1.00 43.22 N ATOM 472 CA ASN A 33 -4.879 -42.439 -22.971 1.00 4.32 C ATOM 473 C ASN A 33 -4.363 -41.852 -21.656 1.00 12.24 C ATOM 474 O ASN A 33 -3.271 -42.188 -21.198 1.00 43.20 O ATOM 475 CB ASN A 33 -4.942 -41.345 -24.046 1.00 4.00 C ATOM 476 CG ASN A 33 -3.565 -40.949 -24.550 1.00 1.45 C ATOM 477 OD1 ASN A 33 -3.045 -41.537 -25.498 1.00 34.52 O ATOM 478 ND2 ASN A 33 -2.965 -39.952 -23.923 1.00 23.04 N ATOM 0 H ASN A 33 -6.917 -42.643 -23.396 1.00 43.22 H new ATOM 0 HA ASN A 33 -4.187 -43.219 -23.290 1.00 4.32 H new ATOM 0 HB2 ASN A 33 -5.545 -41.696 -24.883 1.00 4.00 H new ATOM 0 HB3 ASN A 33 -5.443 -40.467 -23.638 1.00 4.00 H new ATOM 0 HD21 ASN A 33 -2.039 -39.646 -24.221 1.00 23.04 H new ATOM 0 HD22 ASN A 33 -3.428 -39.489 -23.141 1.00 23.04 H new ATOM 485 N LYS A 34 -5.173 -40.994 -21.042 1.00 32.10 N ATOM 486 CA LYS A 34 -4.788 -40.301 -19.814 1.00 63.34 C ATOM 487 C LYS A 34 -4.573 -41.290 -18.667 1.00 13.43 C ATOM 488 O LYS A 34 -3.638 -41.141 -17.880 1.00 20.22 O ATOM 489 CB LYS A 34 -5.860 -39.268 -19.420 1.00 42.13 C ATOM 490 CG LYS A 34 -5.999 -38.092 -20.390 1.00 54.23 C ATOM 491 CD LYS A 34 -4.766 -37.186 -20.378 1.00 2.25 C ATOM 492 CE LYS A 34 -4.999 -35.894 -21.162 1.00 10.31 C ATOM 493 NZ LYS A 34 -5.247 -36.140 -22.603 1.00 61.25 N1+ ATOM 0 H LYS A 34 -6.107 -40.760 -21.377 1.00 32.10 H new ATOM 0 HA LYS A 34 -3.847 -39.784 -20.004 1.00 63.34 H new ATOM 0 HB2 LYS A 34 -6.822 -39.774 -19.343 1.00 42.13 H new ATOM 0 HB3 LYS A 34 -5.624 -38.879 -18.429 1.00 42.13 H new ATOM 0 HG2 LYS A 34 -6.159 -38.472 -21.399 1.00 54.23 H new ATOM 0 HG3 LYS A 34 -6.880 -37.507 -20.126 1.00 54.23 H new ATOM 0 HD2 LYS A 34 -4.504 -36.943 -19.348 1.00 2.25 H new ATOM 0 HD3 LYS A 34 -3.918 -37.722 -20.805 1.00 2.25 H new ATOM 0 HE2 LYS A 34 -5.850 -35.363 -20.736 1.00 10.31 H new ATOM 0 HE3 LYS A 34 -4.131 -35.245 -21.052 1.00 10.31 H new ATOM 0 HZ1 LYS A 34 -6.083 -35.601 -22.908 1.00 61.25 H new ATOM 0 HZ2 LYS A 34 -4.419 -35.837 -23.154 1.00 61.25 H new ATOM 0 HZ3 LYS A 34 -5.414 -37.155 -22.758 1.00 61.25 H new ATOM 507 N VAL A 35 -5.438 -42.298 -18.586 1.00 1.14 N ATOM 508 CA VAL A 35 -5.380 -43.271 -17.494 1.00 22.00 C ATOM 509 C VAL A 35 -4.170 -44.205 -17.617 1.00 74.14 C ATOM 510 O VAL A 35 -3.516 -44.516 -16.618 1.00 12.35 O ATOM 511 CB VAL A 35 -6.685 -44.106 -17.410 1.00 71.34 C ATOM 512 CG1 VAL A 35 -6.566 -45.211 -16.356 1.00 55.41 C ATOM 513 CG2 VAL A 35 -7.881 -43.203 -17.104 1.00 4.12 C ATOM 0 H VAL A 35 -6.185 -42.464 -19.260 1.00 1.14 H new ATOM 0 HA VAL A 35 -5.271 -42.696 -16.574 1.00 22.00 H new ATOM 0 HB VAL A 35 -6.844 -44.579 -18.379 1.00 71.34 H new ATOM 0 HG11 VAL A 35 -7.495 -45.780 -16.319 1.00 55.41 H new ATOM 0 HG12 VAL A 35 -5.743 -45.876 -16.618 1.00 55.41 H new ATOM 0 HG13 VAL A 35 -6.375 -44.764 -15.380 1.00 55.41 H new ATOM 0 HG21 VAL A 35 -8.787 -43.806 -17.049 1.00 4.12 H new ATOM 0 HG22 VAL A 35 -7.722 -42.699 -16.151 1.00 4.12 H new ATOM 0 HG23 VAL A 35 -7.987 -42.460 -17.894 1.00 4.12 H new ATOM 523 N THR A 36 -3.866 -44.650 -18.835 1.00 14.23 N ATOM 524 CA THR A 36 -2.803 -45.633 -19.041 1.00 5.43 C ATOM 525 C THR A 36 -1.425 -44.979 -19.175 1.00 53.41 C ATOM 526 O THR A 36 -0.413 -45.575 -18.804 1.00 51.32 O ATOM 527 CB THR A 36 -3.087 -46.514 -20.284 1.00 11.34 C ATOM 528 OG1 THR A 36 -3.274 -45.696 -21.451 1.00 35.24 O ATOM 529 CG2 THR A 36 -4.327 -47.377 -20.071 1.00 31.14 C ATOM 0 H THR A 36 -4.336 -44.349 -19.688 1.00 14.23 H new ATOM 0 HA THR A 36 -2.791 -46.263 -18.152 1.00 5.43 H new ATOM 0 HB THR A 36 -2.224 -47.164 -20.431 1.00 11.34 H new ATOM 0 HG1 THR A 36 -4.193 -45.356 -21.468 1.00 35.24 H new ATOM 0 HG21 THR A 36 -4.504 -47.985 -20.958 1.00 31.14 H new ATOM 0 HG22 THR A 36 -4.174 -48.027 -19.210 1.00 31.14 H new ATOM 0 HG23 THR A 36 -5.190 -46.736 -19.893 1.00 31.14 H new ATOM 537 N SER A 37 -1.386 -43.748 -19.684 1.00 74.54 N ATOM 538 CA SER A 37 -0.115 -43.078 -19.976 1.00 42.32 C ATOM 539 C SER A 37 0.501 -42.425 -18.729 1.00 73.45 C ATOM 540 O SER A 37 1.469 -41.669 -18.837 1.00 65.42 O ATOM 541 CB SER A 37 -0.316 -42.028 -21.083 1.00 1.24 C ATOM 542 OG SER A 37 0.920 -41.461 -21.503 1.00 11.40 O ATOM 0 H SER A 37 -2.215 -43.195 -19.903 1.00 74.54 H new ATOM 0 HA SER A 37 0.585 -43.841 -20.318 1.00 42.32 H new ATOM 0 HB2 SER A 37 -0.813 -42.490 -21.936 1.00 1.24 H new ATOM 0 HB3 SER A 37 -0.974 -41.238 -20.720 1.00 1.24 H new ATOM 0 HG SER A 37 1.502 -41.332 -20.725 1.00 11.40 H new ATOM 548 N CYS A 38 -0.046 -42.716 -17.549 1.00 31.04 N ATOM 549 CA CYS A 38 0.504 -42.182 -16.304 1.00 10.42 C ATOM 550 C CYS A 38 1.894 -42.767 -16.042 1.00 51.55 C ATOM 551 O CYS A 38 2.136 -43.941 -16.327 1.00 23.12 O ATOM 552 CB CYS A 38 -0.435 -42.497 -15.140 1.00 55.23 C ATOM 553 SG CYS A 38 -0.724 -44.261 -14.895 1.00 22.33 S ATOM 0 H CYS A 38 -0.864 -43.314 -17.429 1.00 31.04 H new ATOM 0 HA CYS A 38 0.598 -41.100 -16.396 1.00 10.42 H new ATOM 0 HB2 CYS A 38 -0.018 -42.076 -14.225 1.00 55.23 H new ATOM 0 HB3 CYS A 38 -1.391 -42.002 -15.312 1.00 55.23 H new ATOM 0 HG CYS A 38 -1.805 -44.615 -15.524 1.00 22.33 H new ATOM 559 N ASN A 39 2.796 -41.941 -15.504 1.00 72.42 N ATOM 560 CA ASN A 39 4.195 -42.327 -15.289 1.00 15.33 C ATOM 561 C ASN A 39 4.320 -43.570 -14.391 1.00 11.44 C ATOM 562 O ASN A 39 4.378 -44.697 -14.888 1.00 34.54 O ATOM 563 CB ASN A 39 4.995 -41.155 -14.686 1.00 42.12 C ATOM 564 CG ASN A 39 5.063 -39.935 -15.596 1.00 14.24 C ATOM 565 OD1 ASN A 39 4.164 -39.690 -16.403 1.00 23.53 O ATOM 566 ND2 ASN A 39 6.124 -39.152 -15.461 1.00 10.15 N ATOM 0 H ASN A 39 2.579 -40.990 -15.206 1.00 72.42 H new ATOM 0 HA ASN A 39 4.611 -42.581 -16.264 1.00 15.33 H new ATOM 0 HB2 ASN A 39 4.542 -40.866 -13.737 1.00 42.12 H new ATOM 0 HB3 ASN A 39 6.008 -41.492 -14.466 1.00 42.12 H new ATOM 0 HD21 ASN A 39 6.216 -38.314 -16.036 1.00 10.15 H new ATOM 0 HD22 ASN A 39 6.848 -39.387 -14.782 1.00 10.15 H new ATOM 573 N ASP A 40 4.356 -43.360 -13.071 1.00 2.41 N ATOM 574 CA ASP A 40 4.519 -44.458 -12.110 1.00 42.21 C ATOM 575 C ASP A 40 3.726 -44.174 -10.841 1.00 11.11 C ATOM 576 O ASP A 40 3.845 -43.094 -10.267 1.00 52.12 O ATOM 577 CB ASP A 40 5.996 -44.655 -11.727 1.00 54.20 C ATOM 578 CG ASP A 40 6.860 -45.175 -12.864 1.00 63.42 C ATOM 579 OD1 ASP A 40 7.379 -44.352 -13.649 1.00 24.22 O ATOM 580 OD2 ASP A 40 7.044 -46.406 -12.963 1.00 1.42 O1- ATOM 0 H ASP A 40 4.274 -42.438 -12.642 1.00 2.41 H new ATOM 0 HA ASP A 40 4.150 -45.364 -12.591 1.00 42.21 H new ATOM 0 HB2 ASP A 40 6.402 -43.705 -11.380 1.00 54.20 H new ATOM 0 HB3 ASP A 40 6.055 -45.351 -10.890 1.00 54.20 H new ATOM 585 N ASN A 41 2.912 -45.143 -10.422 1.00 20.22 N ATOM 586 CA ASN A 41 2.171 -45.070 -9.151 1.00 43.41 C ATOM 587 C ASN A 41 1.297 -43.813 -9.053 1.00 72.45 C ATOM 588 O ASN A 41 0.758 -43.509 -7.985 1.00 25.45 O ATOM 589 CB ASN A 41 3.147 -45.125 -7.962 1.00 53.22 C ATOM 590 CG ASN A 41 3.895 -46.447 -7.875 1.00 43.00 C ATOM 591 OD1 ASN A 41 3.469 -47.378 -7.188 1.00 12.13 O ATOM 592 ND2 ASN A 41 5.018 -46.542 -8.570 1.00 51.54 N ATOM 0 H ASN A 41 2.744 -46.000 -10.948 1.00 20.22 H new ATOM 0 HA ASN A 41 1.505 -45.932 -9.120 1.00 43.41 H new ATOM 0 HB2 ASN A 41 3.866 -44.311 -8.050 1.00 53.22 H new ATOM 0 HB3 ASN A 41 2.595 -44.964 -7.036 1.00 53.22 H new ATOM 0 HD21 ASN A 41 5.560 -47.406 -8.548 1.00 51.54 H new ATOM 0 HD22 ASN A 41 5.341 -45.752 -9.128 1.00 51.54 H new ATOM 599 N ILE A 42 1.138 -43.109 -10.170 1.00 4.44 N ATOM 600 CA ILE A 42 0.365 -41.871 -10.208 1.00 53.42 C ATOM 601 C ILE A 42 -1.097 -42.134 -9.855 1.00 61.41 C ATOM 602 O ILE A 42 -1.713 -43.065 -10.379 1.00 70.51 O ATOM 603 CB ILE A 42 0.459 -41.205 -11.608 1.00 60.24 C ATOM 604 CG1 ILE A 42 1.910 -40.778 -11.903 1.00 24.42 C ATOM 605 CG2 ILE A 42 -0.492 -40.008 -11.726 1.00 31.35 C ATOM 606 CD1 ILE A 42 2.442 -39.703 -10.979 1.00 11.11 C ATOM 0 H ILE A 42 1.538 -43.378 -11.069 1.00 4.44 H new ATOM 0 HA ILE A 42 0.787 -41.191 -9.468 1.00 53.42 H new ATOM 0 HB ILE A 42 0.153 -41.942 -12.350 1.00 60.24 H new ATOM 0 HG12 ILE A 42 2.556 -41.653 -11.833 1.00 24.42 H new ATOM 0 HG13 ILE A 42 1.969 -40.420 -12.931 1.00 24.42 H new ATOM 0 HG21 ILE A 42 -0.400 -39.566 -12.718 1.00 31.35 H new ATOM 0 HG22 ILE A 42 -1.518 -40.342 -11.571 1.00 31.35 H new ATOM 0 HG23 ILE A 42 -0.235 -39.264 -10.972 1.00 31.35 H new ATOM 0 HD11 ILE A 42 3.468 -39.461 -11.255 1.00 11.11 H new ATOM 0 HD12 ILE A 42 1.823 -38.810 -11.065 1.00 11.11 H new ATOM 0 HD13 ILE A 42 2.418 -40.063 -9.950 1.00 11.11 H new ATOM 618 N LEU A 43 -1.631 -41.329 -8.944 1.00 61.41 N ATOM 619 CA LEU A 43 -3.019 -41.443 -8.525 1.00 72.33 C ATOM 620 C LEU A 43 -3.899 -40.573 -9.426 1.00 70.42 C ATOM 621 O LEU A 43 -3.827 -39.337 -9.397 1.00 24.44 O ATOM 622 CB LEU A 43 -3.168 -41.030 -7.047 1.00 53.01 C ATOM 623 CG LEU A 43 -4.184 -41.844 -6.220 1.00 15.11 C ATOM 624 CD1 LEU A 43 -4.300 -41.278 -4.811 1.00 20.34 C ATOM 625 CD2 LEU A 43 -5.553 -41.890 -6.896 1.00 60.11 C ATOM 0 H LEU A 43 -1.115 -40.583 -8.478 1.00 61.41 H new ATOM 0 HA LEU A 43 -3.340 -42.481 -8.618 1.00 72.33 H new ATOM 0 HB2 LEU A 43 -2.192 -41.109 -6.568 1.00 53.01 H new ATOM 0 HB3 LEU A 43 -3.457 -39.980 -7.011 1.00 53.01 H new ATOM 0 HG LEU A 43 -3.815 -42.868 -6.157 1.00 15.11 H new ATOM 0 HD11 LEU A 43 -5.021 -41.864 -4.242 1.00 20.34 H new ATOM 0 HD12 LEU A 43 -3.328 -41.322 -4.320 1.00 20.34 H new ATOM 0 HD13 LEU A 43 -4.634 -40.242 -4.862 1.00 20.34 H new ATOM 0 HD21 LEU A 43 -6.242 -42.472 -6.284 1.00 60.11 H new ATOM 0 HD22 LEU A 43 -5.937 -40.876 -7.010 1.00 60.11 H new ATOM 0 HD23 LEU A 43 -5.459 -42.355 -7.878 1.00 60.11 H new ATOM 637 N ILE A 44 -4.711 -41.232 -10.237 1.00 53.43 N ATOM 638 CA ILE A 44 -5.617 -40.556 -11.154 1.00 3.43 C ATOM 639 C ILE A 44 -7.033 -40.524 -10.586 1.00 52.32 C ATOM 640 O ILE A 44 -7.664 -41.565 -10.420 1.00 63.21 O ATOM 641 CB ILE A 44 -5.621 -41.262 -12.532 1.00 54.14 C ATOM 642 CG1 ILE A 44 -4.253 -41.090 -13.214 1.00 72.45 C ATOM 643 CG2 ILE A 44 -6.749 -40.736 -13.419 1.00 35.25 C ATOM 644 CD1 ILE A 44 -4.135 -41.803 -14.543 1.00 52.24 C ATOM 0 H ILE A 44 -4.761 -42.250 -10.279 1.00 53.43 H new ATOM 0 HA ILE A 44 -5.266 -39.532 -11.282 1.00 3.43 H new ATOM 0 HB ILE A 44 -5.800 -42.326 -12.376 1.00 54.14 H new ATOM 0 HG12 ILE A 44 -4.065 -40.027 -13.365 1.00 72.45 H new ATOM 0 HG13 ILE A 44 -3.476 -41.459 -12.545 1.00 72.45 H new ATOM 0 HG21 ILE A 44 -6.726 -41.250 -14.380 1.00 35.25 H new ATOM 0 HG22 ILE A 44 -7.708 -40.916 -12.933 1.00 35.25 H new ATOM 0 HG23 ILE A 44 -6.618 -39.666 -13.577 1.00 35.25 H new ATOM 0 HD11 ILE A 44 -3.142 -41.633 -14.960 1.00 52.24 H new ATOM 0 HD12 ILE A 44 -4.290 -42.872 -14.397 1.00 52.24 H new ATOM 0 HD13 ILE A 44 -4.888 -41.418 -15.231 1.00 52.24 H new ATOM 656 N LEU A 45 -7.519 -39.326 -10.278 1.00 65.44 N ATOM 657 CA LEU A 45 -8.883 -39.145 -9.794 1.00 1.02 C ATOM 658 C LEU A 45 -9.772 -38.684 -10.945 1.00 41.11 C ATOM 659 O LEU A 45 -9.438 -37.729 -11.642 1.00 73.21 O ATOM 660 CB LEU A 45 -8.941 -38.120 -8.645 1.00 45.12 C ATOM 661 CG LEU A 45 -8.224 -38.518 -7.340 1.00 11.25 C ATOM 662 CD1 LEU A 45 -6.707 -38.501 -7.514 1.00 71.43 C ATOM 663 CD2 LEU A 45 -8.646 -37.600 -6.194 1.00 43.24 C ATOM 0 H LEU A 45 -6.984 -38.461 -10.356 1.00 65.44 H new ATOM 0 HA LEU A 45 -9.240 -40.100 -9.408 1.00 1.02 H new ATOM 0 HB2 LEU A 45 -8.511 -37.183 -9.000 1.00 45.12 H new ATOM 0 HB3 LEU A 45 -9.988 -37.923 -8.414 1.00 45.12 H new ATOM 0 HG LEU A 45 -8.519 -39.538 -7.093 1.00 11.25 H new ATOM 0 HD11 LEU A 45 -6.230 -38.786 -6.576 1.00 71.43 H new ATOM 0 HD12 LEU A 45 -6.422 -39.206 -8.295 1.00 71.43 H new ATOM 0 HD13 LEU A 45 -6.384 -37.499 -7.795 1.00 71.43 H new ATOM 0 HD21 LEU A 45 -8.129 -37.897 -5.281 1.00 43.24 H new ATOM 0 HD22 LEU A 45 -8.387 -36.570 -6.439 1.00 43.24 H new ATOM 0 HD23 LEU A 45 -9.723 -37.678 -6.043 1.00 43.24 H new ATOM 675 N VAL A 46 -10.889 -39.366 -11.150 1.00 52.30 N ATOM 676 CA VAL A 46 -11.826 -39.009 -12.214 1.00 52.42 C ATOM 677 C VAL A 46 -13.082 -38.378 -11.625 1.00 21.23 C ATOM 678 O VAL A 46 -13.869 -39.049 -10.954 1.00 14.33 O ATOM 679 CB VAL A 46 -12.219 -40.236 -13.073 1.00 13.25 C ATOM 680 CG1 VAL A 46 -13.243 -39.850 -14.140 1.00 25.32 C ATOM 681 CG2 VAL A 46 -10.983 -40.870 -13.711 1.00 72.45 C ATOM 0 H VAL A 46 -11.172 -40.173 -10.594 1.00 52.30 H new ATOM 0 HA VAL A 46 -11.321 -38.290 -12.860 1.00 52.42 H new ATOM 0 HB VAL A 46 -12.679 -40.974 -12.416 1.00 13.25 H new ATOM 0 HG11 VAL A 46 -13.503 -40.729 -14.730 1.00 25.32 H new ATOM 0 HG12 VAL A 46 -14.139 -39.458 -13.659 1.00 25.32 H new ATOM 0 HG13 VAL A 46 -12.818 -39.087 -14.793 1.00 25.32 H new ATOM 0 HG21 VAL A 46 -11.283 -41.730 -14.310 1.00 72.45 H new ATOM 0 HG22 VAL A 46 -10.487 -40.139 -14.349 1.00 72.45 H new ATOM 0 HG23 VAL A 46 -10.296 -41.194 -12.929 1.00 72.45 H new ATOM 691 N ASP A 47 -13.249 -37.089 -11.870 1.00 11.12 N ATOM 692 CA ASP A 47 -14.402 -36.337 -11.387 1.00 51.13 C ATOM 693 C ASP A 47 -15.579 -36.464 -12.349 1.00 54.22 C ATOM 694 O ASP A 47 -15.410 -36.358 -13.572 1.00 62.13 O ATOM 695 CB ASP A 47 -14.016 -34.858 -11.224 1.00 0.54 C ATOM 696 CG ASP A 47 -15.207 -33.940 -10.957 1.00 13.50 C ATOM 697 OD1 ASP A 47 -15.873 -33.520 -11.932 1.00 30.41 O ATOM 698 OD2 ASP A 47 -15.453 -33.595 -9.786 1.00 0.25 O1- ATOM 0 H ASP A 47 -12.589 -36.530 -12.411 1.00 11.12 H new ATOM 0 HA ASP A 47 -14.706 -36.746 -10.423 1.00 51.13 H new ATOM 0 HB2 ASP A 47 -13.305 -34.765 -10.403 1.00 0.54 H new ATOM 0 HB3 ASP A 47 -13.505 -34.523 -12.127 1.00 0.54 H new ATOM 703 N PHE A 48 -16.764 -36.712 -11.797 1.00 33.43 N ATOM 704 CA PHE A 48 -18.005 -36.640 -12.565 1.00 51.34 C ATOM 705 C PHE A 48 -18.680 -35.287 -12.336 1.00 61.52 C ATOM 706 O PHE A 48 -19.027 -34.939 -11.204 1.00 13.11 O ATOM 707 CB PHE A 48 -18.959 -37.789 -12.197 1.00 65.22 C ATOM 708 CG PHE A 48 -18.575 -39.113 -12.814 1.00 13.55 C ATOM 709 CD1 PHE A 48 -18.097 -40.153 -12.033 1.00 62.52 C ATOM 710 CD2 PHE A 48 -18.699 -39.313 -14.182 1.00 12.32 C ATOM 711 CE1 PHE A 48 -17.753 -41.363 -12.601 1.00 14.23 C ATOM 712 CE2 PHE A 48 -18.353 -40.523 -14.756 1.00 3.03 C ATOM 713 CZ PHE A 48 -17.881 -41.549 -13.966 1.00 0.02 C ATOM 0 H PHE A 48 -16.892 -36.965 -10.817 1.00 33.43 H new ATOM 0 HA PHE A 48 -17.760 -36.742 -13.622 1.00 51.34 H new ATOM 0 HB2 PHE A 48 -18.984 -37.896 -11.113 1.00 65.22 H new ATOM 0 HB3 PHE A 48 -19.968 -37.528 -12.515 1.00 65.22 H new ATOM 0 HD1 PHE A 48 -17.992 -40.015 -10.967 1.00 62.52 H new ATOM 0 HD2 PHE A 48 -19.070 -38.514 -14.806 1.00 12.32 H new ATOM 0 HE1 PHE A 48 -17.384 -42.165 -11.979 1.00 14.23 H new ATOM 0 HE2 PHE A 48 -18.453 -40.664 -15.822 1.00 3.03 H new ATOM 0 HZ PHE A 48 -17.612 -42.495 -14.411 1.00 0.02 H new ATOM 723 N TRP A 49 -18.853 -34.542 -13.426 1.00 62.40 N ATOM 724 CA TRP A 49 -19.407 -33.191 -13.391 1.00 3.51 C ATOM 725 C TRP A 49 -20.765 -33.152 -12.686 1.00 41.31 C ATOM 726 O TRP A 49 -21.763 -33.655 -13.207 1.00 63.54 O ATOM 727 CB TRP A 49 -19.536 -32.651 -14.824 1.00 40.21 C ATOM 728 CG TRP A 49 -20.046 -31.238 -14.906 1.00 42.53 C ATOM 729 CD1 TRP A 49 -19.379 -30.104 -14.543 1.00 65.23 C ATOM 730 CD2 TRP A 49 -21.326 -30.812 -15.392 1.00 72.13 C ATOM 731 NE1 TRP A 49 -20.167 -29.002 -14.767 1.00 33.30 N ATOM 732 CE2 TRP A 49 -21.364 -29.407 -15.287 1.00 34.35 C ATOM 733 CE3 TRP A 49 -22.441 -31.477 -15.904 1.00 22.14 C ATOM 734 CZ2 TRP A 49 -22.473 -28.661 -15.675 1.00 54.21 C ATOM 735 CZ3 TRP A 49 -23.542 -30.736 -16.290 1.00 74.34 C ATOM 736 CH2 TRP A 49 -23.551 -29.339 -16.173 1.00 43.42 C ATOM 0 H TRP A 49 -18.611 -34.861 -14.364 1.00 62.40 H new ATOM 0 HA TRP A 49 -18.726 -32.560 -12.820 1.00 3.51 H new ATOM 0 HB2 TRP A 49 -18.561 -32.702 -15.309 1.00 40.21 H new ATOM 0 HB3 TRP A 49 -20.207 -33.301 -15.386 1.00 40.21 H new ATOM 0 HD1 TRP A 49 -18.378 -30.077 -14.139 1.00 65.23 H new ATOM 0 HE1 TRP A 49 -19.901 -28.036 -14.576 1.00 33.30 H new ATOM 0 HE3 TRP A 49 -22.444 -32.553 -15.997 1.00 22.14 H new ATOM 0 HZ2 TRP A 49 -22.482 -27.585 -15.586 1.00 54.21 H new ATOM 0 HZ3 TRP A 49 -24.409 -31.241 -16.688 1.00 74.34 H new ATOM 0 HH2 TRP A 49 -24.427 -28.787 -16.482 1.00 43.42 H new ATOM 747 N ALA A 50 -20.780 -32.568 -11.491 1.00 41.34 N ATOM 748 CA ALA A 50 -22.013 -32.347 -10.747 1.00 51.22 C ATOM 749 C ALA A 50 -22.687 -31.058 -11.226 1.00 20.23 C ATOM 750 O ALA A 50 -22.151 -29.968 -11.022 1.00 33.32 O ATOM 751 CB ALA A 50 -21.720 -32.280 -9.250 1.00 54.33 C ATOM 0 H ALA A 50 -19.941 -32.237 -11.014 1.00 41.34 H new ATOM 0 HA ALA A 50 -22.692 -33.181 -10.925 1.00 51.22 H new ATOM 0 HB1 ALA A 50 -22.649 -32.115 -8.704 1.00 54.33 H new ATOM 0 HB2 ALA A 50 -21.270 -33.218 -8.925 1.00 54.33 H new ATOM 0 HB3 ALA A 50 -21.031 -31.459 -9.050 1.00 54.33 H new ATOM 757 N PRO A 51 -23.861 -31.165 -11.882 1.00 55.40 N ATOM 758 CA PRO A 51 -24.566 -30.004 -12.447 1.00 12.22 C ATOM 759 C PRO A 51 -25.032 -29.019 -11.371 1.00 34.03 C ATOM 760 O PRO A 51 -24.519 -27.901 -11.267 1.00 2.20 O ATOM 761 CB PRO A 51 -25.776 -30.624 -13.176 1.00 62.34 C ATOM 762 CG PRO A 51 -25.447 -32.074 -13.321 1.00 64.33 C ATOM 763 CD PRO A 51 -24.593 -32.420 -12.134 1.00 24.12 C ATOM 0 HA PRO A 51 -23.917 -29.421 -13.101 1.00 12.22 H new ATOM 0 HB2 PRO A 51 -26.694 -30.484 -12.605 1.00 62.34 H new ATOM 0 HB3 PRO A 51 -25.931 -30.157 -14.148 1.00 62.34 H new ATOM 0 HG2 PRO A 51 -26.353 -32.680 -13.341 1.00 64.33 H new ATOM 0 HG3 PRO A 51 -24.916 -32.263 -14.254 1.00 64.33 H new ATOM 0 HD2 PRO A 51 -25.195 -32.717 -11.275 1.00 24.12 H new ATOM 0 HD3 PRO A 51 -23.916 -33.247 -12.350 1.00 24.12 H new ATOM 771 N TRP A 52 -26.000 -29.441 -10.562 1.00 52.31 N ATOM 772 CA TRP A 52 -26.562 -28.588 -9.519 1.00 61.04 C ATOM 773 C TRP A 52 -26.228 -29.156 -8.145 1.00 61.45 C ATOM 774 O TRP A 52 -26.740 -30.206 -7.757 1.00 73.15 O ATOM 775 CB TRP A 52 -28.081 -28.460 -9.695 1.00 34.34 C ATOM 776 CG TRP A 52 -28.700 -27.423 -8.801 1.00 2.33 C ATOM 777 CD1 TRP A 52 -29.238 -27.616 -7.561 1.00 55.55 C ATOM 778 CD2 TRP A 52 -28.840 -26.026 -9.085 1.00 2.31 C ATOM 779 NE1 TRP A 52 -29.700 -26.426 -7.058 1.00 21.24 N ATOM 780 CE2 TRP A 52 -29.469 -25.435 -7.975 1.00 34.23 C ATOM 781 CE3 TRP A 52 -28.493 -25.220 -10.173 1.00 4.45 C ATOM 782 CZ2 TRP A 52 -29.758 -24.075 -7.922 1.00 10.31 C ATOM 783 CZ3 TRP A 52 -28.780 -23.869 -10.119 1.00 4.30 C ATOM 784 CH2 TRP A 52 -29.407 -23.309 -9.000 1.00 60.21 C ATOM 0 H TRP A 52 -26.413 -30.372 -10.609 1.00 52.31 H new ATOM 0 HA TRP A 52 -26.123 -27.594 -9.602 1.00 61.04 H new ATOM 0 HB2 TRP A 52 -28.299 -28.211 -10.733 1.00 34.34 H new ATOM 0 HB3 TRP A 52 -28.545 -29.426 -9.495 1.00 34.34 H new ATOM 0 HD1 TRP A 52 -29.292 -28.566 -7.051 1.00 55.55 H new ATOM 0 HE1 TRP A 52 -30.144 -26.300 -6.148 1.00 21.24 H new ATOM 0 HE3 TRP A 52 -28.009 -25.645 -11.040 1.00 4.45 H new ATOM 0 HZ2 TRP A 52 -30.242 -23.639 -7.060 1.00 10.31 H new ATOM 0 HZ3 TRP A 52 -28.516 -23.236 -10.953 1.00 4.30 H new ATOM 0 HH2 TRP A 52 -29.618 -22.250 -8.987 1.00 60.21 H new ATOM 795 N CYS A 53 -25.358 -28.465 -7.422 1.00 50.22 N ATOM 796 CA CYS A 53 -24.922 -28.912 -6.106 1.00 20.35 C ATOM 797 C CYS A 53 -24.265 -27.763 -5.353 1.00 44.23 C ATOM 798 O CYS A 53 -23.466 -27.020 -5.926 1.00 40.01 O ATOM 799 CB CYS A 53 -23.944 -30.083 -6.246 1.00 43.12 C ATOM 800 SG CYS A 53 -23.212 -30.643 -4.674 1.00 63.30 S ATOM 0 H CYS A 53 -24.938 -27.587 -7.727 1.00 50.22 H new ATOM 0 HA CYS A 53 -25.792 -29.247 -5.541 1.00 20.35 H new ATOM 0 HB2 CYS A 53 -24.464 -30.921 -6.710 1.00 43.12 H new ATOM 0 HB3 CYS A 53 -23.141 -29.791 -6.923 1.00 43.12 H new ATOM 805 N GLY A 54 -24.607 -27.620 -4.076 1.00 43.40 N ATOM 806 CA GLY A 54 -24.057 -26.549 -3.265 1.00 13.40 C ATOM 807 C GLY A 54 -22.593 -26.772 -2.917 1.00 4.44 C ATOM 808 O GLY A 54 -21.715 -26.169 -3.530 1.00 31.03 O ATOM 0 H GLY A 54 -25.260 -28.232 -3.586 1.00 43.40 H new ATOM 0 HA2 GLY A 54 -24.160 -25.604 -3.799 1.00 13.40 H new ATOM 0 HA3 GLY A 54 -24.636 -26.460 -2.346 1.00 13.40 H new ATOM 812 N PRO A 55 -22.300 -27.666 -1.949 1.00 11.55 N ATOM 813 CA PRO A 55 -20.929 -27.897 -1.458 1.00 25.30 C ATOM 814 C PRO A 55 -19.944 -28.234 -2.578 1.00 32.04 C ATOM 815 O PRO A 55 -18.753 -27.927 -2.487 1.00 53.41 O ATOM 816 CB PRO A 55 -21.082 -29.092 -0.501 1.00 54.22 C ATOM 817 CG PRO A 55 -22.510 -29.051 -0.071 1.00 31.01 C ATOM 818 CD PRO A 55 -23.280 -28.524 -1.253 1.00 51.53 C ATOM 0 HA PRO A 55 -20.520 -27.004 -0.987 1.00 25.30 H new ATOM 0 HB2 PRO A 55 -20.845 -30.032 -1.000 1.00 54.22 H new ATOM 0 HB3 PRO A 55 -20.409 -29.005 0.352 1.00 54.22 H new ATOM 0 HG2 PRO A 55 -22.861 -30.043 0.214 1.00 31.01 H new ATOM 0 HG3 PRO A 55 -22.638 -28.406 0.798 1.00 31.01 H new ATOM 0 HD2 PRO A 55 -23.633 -29.332 -1.894 1.00 51.53 H new ATOM 0 HD3 PRO A 55 -24.158 -27.958 -0.940 1.00 51.53 H new ATOM 826 N CYS A 56 -20.452 -28.850 -3.638 1.00 70.12 N ATOM 827 CA CYS A 56 -19.618 -29.314 -4.743 1.00 20.13 C ATOM 828 C CYS A 56 -18.770 -28.188 -5.339 1.00 71.35 C ATOM 829 O CYS A 56 -17.654 -28.429 -5.803 1.00 52.03 O ATOM 830 CB CYS A 56 -20.486 -29.959 -5.826 1.00 24.21 C ATOM 831 SG CYS A 56 -21.420 -31.408 -5.236 1.00 62.21 S ATOM 0 H CYS A 56 -21.447 -29.042 -3.757 1.00 70.12 H new ATOM 0 HA CYS A 56 -18.930 -30.058 -4.342 1.00 20.13 H new ATOM 0 HB2 CYS A 56 -21.186 -29.217 -6.210 1.00 24.21 H new ATOM 0 HB3 CYS A 56 -19.851 -30.260 -6.659 1.00 24.21 H new ATOM 836 N ARG A 57 -19.282 -26.957 -5.307 1.00 42.14 N ATOM 837 CA ARG A 57 -18.537 -25.816 -5.844 1.00 30.24 C ATOM 838 C ARG A 57 -17.323 -25.512 -4.967 1.00 54.23 C ATOM 839 O ARG A 57 -16.305 -25.025 -5.453 1.00 53.21 O ATOM 840 CB ARG A 57 -19.428 -24.572 -5.981 1.00 42.45 C ATOM 841 CG ARG A 57 -19.922 -23.993 -4.658 1.00 14.45 C ATOM 842 CD ARG A 57 -20.902 -22.845 -4.881 1.00 71.53 C ATOM 843 NE ARG A 57 -22.008 -23.250 -5.749 1.00 20.02 N ATOM 844 CZ ARG A 57 -23.292 -23.234 -5.396 1.00 74.44 C ATOM 845 NH1 ARG A 57 -23.657 -22.781 -4.205 1.00 35.42 N1+ ATOM 846 NH2 ARG A 57 -24.213 -23.659 -6.247 1.00 33.01 N ATOM 0 H ARG A 57 -20.197 -26.725 -4.921 1.00 42.14 H new ATOM 0 HA ARG A 57 -18.192 -26.085 -6.842 1.00 30.24 H new ATOM 0 HB2 ARG A 57 -18.872 -23.801 -6.515 1.00 42.45 H new ATOM 0 HB3 ARG A 57 -20.291 -24.826 -6.596 1.00 42.45 H new ATOM 0 HG2 ARG A 57 -20.405 -24.777 -4.074 1.00 14.45 H new ATOM 0 HG3 ARG A 57 -19.072 -23.639 -4.075 1.00 14.45 H new ATOM 0 HD2 ARG A 57 -21.295 -22.508 -3.922 1.00 71.53 H new ATOM 0 HD3 ARG A 57 -20.379 -21.999 -5.326 1.00 71.53 H new ATOM 0 HE ARG A 57 -21.779 -23.567 -6.691 1.00 20.02 H new ATOM 0 HH11 ARG A 57 -22.952 -22.441 -3.551 1.00 35.42 H new ATOM 0 HH12 ARG A 57 -24.643 -22.772 -3.943 1.00 35.42 H new ATOM 0 HH21 ARG A 57 -23.938 -23.997 -7.169 1.00 33.01 H new ATOM 0 HH22 ARG A 57 -25.197 -23.648 -5.980 1.00 33.01 H new ATOM 860 N SER A 58 -17.441 -25.797 -3.671 1.00 22.42 N ATOM 861 CA SER A 58 -16.322 -25.659 -2.742 1.00 70.35 C ATOM 862 C SER A 58 -15.332 -26.809 -2.948 1.00 50.02 C ATOM 863 O SER A 58 -14.124 -26.664 -2.727 1.00 63.20 O ATOM 864 CB SER A 58 -16.837 -25.643 -1.297 1.00 12.11 C ATOM 865 OG SER A 58 -17.836 -24.652 -1.124 1.00 40.31 O ATOM 0 H SER A 58 -18.305 -26.126 -3.240 1.00 22.42 H new ATOM 0 HA SER A 58 -15.809 -24.717 -2.935 1.00 70.35 H new ATOM 0 HB2 SER A 58 -17.243 -26.622 -1.041 1.00 12.11 H new ATOM 0 HB3 SER A 58 -16.009 -25.453 -0.614 1.00 12.11 H new ATOM 0 HG SER A 58 -18.150 -24.662 -0.196 1.00 40.31 H new ATOM 871 N LEU A 59 -15.853 -27.952 -3.385 1.00 35.33 N ATOM 872 CA LEU A 59 -15.024 -29.125 -3.646 1.00 33.30 C ATOM 873 C LEU A 59 -14.084 -28.883 -4.822 1.00 51.22 C ATOM 874 O LEU A 59 -13.004 -29.457 -4.867 1.00 44.13 O ATOM 875 CB LEU A 59 -15.884 -30.380 -3.897 1.00 34.51 C ATOM 876 CG LEU A 59 -16.277 -31.179 -2.639 1.00 64.10 C ATOM 877 CD1 LEU A 59 -15.038 -31.754 -1.954 1.00 21.22 C ATOM 878 CD2 LEU A 59 -17.079 -30.315 -1.668 1.00 63.33 C ATOM 0 H LEU A 59 -16.847 -28.091 -3.566 1.00 35.33 H new ATOM 0 HA LEU A 59 -14.423 -29.300 -2.754 1.00 33.30 H new ATOM 0 HB2 LEU A 59 -16.795 -30.077 -4.413 1.00 34.51 H new ATOM 0 HB3 LEU A 59 -15.341 -31.042 -4.571 1.00 34.51 H new ATOM 0 HG LEU A 59 -16.911 -32.009 -2.953 1.00 64.10 H new ATOM 0 HD11 LEU A 59 -15.339 -32.314 -1.069 1.00 21.22 H new ATOM 0 HD12 LEU A 59 -14.516 -32.418 -2.643 1.00 21.22 H new ATOM 0 HD13 LEU A 59 -14.374 -30.941 -1.661 1.00 21.22 H new ATOM 0 HD21 LEU A 59 -17.343 -30.904 -0.790 1.00 63.33 H new ATOM 0 HD22 LEU A 59 -16.479 -29.458 -1.363 1.00 63.33 H new ATOM 0 HD23 LEU A 59 -17.988 -29.966 -2.157 1.00 63.33 H new ATOM 890 N GLU A 60 -14.487 -28.032 -5.770 1.00 25.40 N ATOM 891 CA GLU A 60 -13.632 -27.725 -6.919 1.00 51.24 C ATOM 892 C GLU A 60 -12.274 -27.153 -6.449 1.00 31.13 C ATOM 893 O GLU A 60 -11.227 -27.728 -6.761 1.00 60.23 O ATOM 894 CB GLU A 60 -14.338 -26.781 -7.917 1.00 44.05 C ATOM 895 CG GLU A 60 -15.643 -27.342 -8.491 1.00 51.15 C ATOM 896 CD GLU A 60 -16.248 -26.460 -9.580 1.00 40.34 C ATOM 897 OE1 GLU A 60 -16.262 -26.878 -10.760 1.00 65.12 O ATOM 898 OE2 GLU A 60 -16.714 -25.343 -9.266 1.00 25.24 O1- ATOM 0 H GLU A 60 -15.386 -27.550 -5.766 1.00 25.40 H new ATOM 0 HA GLU A 60 -13.436 -28.655 -7.452 1.00 51.24 H new ATOM 0 HB2 GLU A 60 -14.550 -25.835 -7.419 1.00 44.05 H new ATOM 0 HB3 GLU A 60 -13.656 -26.563 -8.739 1.00 44.05 H new ATOM 0 HG2 GLU A 60 -15.456 -28.335 -8.899 1.00 51.15 H new ATOM 0 HG3 GLU A 60 -16.366 -27.460 -7.684 1.00 51.15 H new ATOM 905 N PRO A 61 -12.256 -26.031 -5.677 1.00 40.44 N ATOM 906 CA PRO A 61 -11.011 -25.490 -5.114 1.00 20.54 C ATOM 907 C PRO A 61 -10.384 -26.419 -4.066 1.00 64.23 C ATOM 908 O PRO A 61 -9.162 -26.455 -3.926 1.00 41.33 O ATOM 909 CB PRO A 61 -11.438 -24.154 -4.484 1.00 61.44 C ATOM 910 CG PRO A 61 -12.898 -24.297 -4.237 1.00 3.54 C ATOM 911 CD PRO A 61 -13.414 -25.184 -5.335 1.00 61.33 C ATOM 0 HA PRO A 61 -10.241 -25.377 -5.877 1.00 20.54 H new ATOM 0 HB2 PRO A 61 -10.897 -23.964 -3.557 1.00 61.44 H new ATOM 0 HB3 PRO A 61 -11.230 -23.318 -5.152 1.00 61.44 H new ATOM 0 HG2 PRO A 61 -13.088 -24.736 -3.258 1.00 3.54 H new ATOM 0 HG3 PRO A 61 -13.394 -23.327 -4.253 1.00 3.54 H new ATOM 0 HD2 PRO A 61 -14.262 -25.782 -5.001 1.00 61.33 H new ATOM 0 HD3 PRO A 61 -13.752 -24.603 -6.193 1.00 61.33 H new ATOM 919 N GLN A 62 -11.210 -27.173 -3.328 1.00 1.31 N ATOM 920 CA GLN A 62 -10.671 -28.139 -2.360 1.00 64.23 C ATOM 921 C GLN A 62 -9.857 -29.216 -3.082 1.00 72.30 C ATOM 922 O GLN A 62 -8.773 -29.603 -2.634 1.00 45.13 O ATOM 923 CB GLN A 62 -11.783 -28.782 -1.514 1.00 52.44 C ATOM 924 CG GLN A 62 -12.442 -27.820 -0.530 1.00 75.21 C ATOM 925 CD GLN A 62 -13.407 -28.512 0.417 1.00 5.22 C ATOM 926 OE1 GLN A 62 -13.026 -28.944 1.503 1.00 5.12 O ATOM 927 NE2 GLN A 62 -14.659 -28.631 0.007 1.00 34.41 N ATOM 0 H GLN A 62 -12.228 -27.136 -3.379 1.00 1.31 H new ATOM 0 HA GLN A 62 -10.017 -27.594 -1.680 1.00 64.23 H new ATOM 0 HB2 GLN A 62 -12.546 -29.185 -2.180 1.00 52.44 H new ATOM 0 HB3 GLN A 62 -11.365 -29.623 -0.961 1.00 52.44 H new ATOM 0 HG2 GLN A 62 -11.669 -27.317 0.051 1.00 75.21 H new ATOM 0 HG3 GLN A 62 -12.976 -27.049 -1.086 1.00 75.21 H new ATOM 0 HE21 GLN A 62 -14.936 -28.259 -0.901 1.00 34.41 H new ATOM 0 HE22 GLN A 62 -15.348 -29.095 0.599 1.00 34.41 H new ATOM 936 N LEU A 63 -10.375 -29.677 -4.218 1.00 4.32 N ATOM 937 CA LEU A 63 -9.667 -30.646 -5.045 1.00 24.11 C ATOM 938 C LEU A 63 -8.400 -30.013 -5.605 1.00 34.30 C ATOM 939 O LEU A 63 -7.377 -30.680 -5.752 1.00 14.04 O ATOM 940 CB LEU A 63 -10.559 -31.158 -6.190 1.00 72.32 C ATOM 941 CG LEU A 63 -11.724 -32.073 -5.770 1.00 45.24 C ATOM 942 CD1 LEU A 63 -12.545 -32.501 -6.986 1.00 73.33 C ATOM 943 CD2 LEU A 63 -11.204 -33.296 -5.014 1.00 74.14 C ATOM 0 H LEU A 63 -11.283 -29.394 -4.586 1.00 4.32 H new ATOM 0 HA LEU A 63 -9.400 -31.501 -4.423 1.00 24.11 H new ATOM 0 HB2 LEU A 63 -10.969 -30.298 -6.719 1.00 72.32 H new ATOM 0 HB3 LEU A 63 -9.933 -31.700 -6.899 1.00 72.32 H new ATOM 0 HG LEU A 63 -12.375 -31.508 -5.103 1.00 45.24 H new ATOM 0 HD11 LEU A 63 -13.362 -33.147 -6.664 1.00 73.33 H new ATOM 0 HD12 LEU A 63 -12.952 -31.618 -7.479 1.00 73.33 H new ATOM 0 HD13 LEU A 63 -11.907 -33.044 -7.683 1.00 73.33 H new ATOM 0 HD21 LEU A 63 -12.043 -33.930 -4.726 1.00 74.14 H new ATOM 0 HD22 LEU A 63 -10.527 -33.860 -5.656 1.00 74.14 H new ATOM 0 HD23 LEU A 63 -10.671 -32.972 -4.120 1.00 74.14 H new ATOM 955 N GLU A 64 -8.476 -28.715 -5.909 1.00 4.53 N ATOM 956 CA GLU A 64 -7.306 -27.970 -6.358 1.00 14.32 C ATOM 957 C GLU A 64 -6.252 -27.923 -5.263 1.00 63.35 C ATOM 958 O GLU A 64 -5.069 -27.987 -5.547 1.00 10.34 O ATOM 959 CB GLU A 64 -7.656 -26.541 -6.785 1.00 61.33 C ATOM 960 CG GLU A 64 -8.514 -26.457 -8.039 1.00 42.54 C ATOM 961 CD GLU A 64 -8.476 -25.070 -8.654 1.00 13.44 C ATOM 962 OE1 GLU A 64 -9.119 -24.148 -8.109 1.00 52.13 O ATOM 963 OE2 GLU A 64 -7.776 -24.886 -9.670 1.00 65.51 O1- ATOM 0 H GLU A 64 -9.332 -28.164 -5.852 1.00 4.53 H new ATOM 0 HA GLU A 64 -6.914 -28.496 -7.228 1.00 14.32 H new ATOM 0 HB2 GLU A 64 -8.180 -26.047 -5.966 1.00 61.33 H new ATOM 0 HB3 GLU A 64 -6.732 -25.987 -6.953 1.00 61.33 H new ATOM 0 HG2 GLU A 64 -8.165 -27.188 -8.768 1.00 42.54 H new ATOM 0 HG3 GLU A 64 -9.543 -26.718 -7.794 1.00 42.54 H new ATOM 970 N LYS A 65 -6.686 -27.803 -4.015 1.00 0.43 N ATOM 971 CA LYS A 65 -5.764 -27.799 -2.881 1.00 4.21 C ATOM 972 C LYS A 65 -4.952 -29.094 -2.869 1.00 63.22 C ATOM 973 O LYS A 65 -3.713 -29.076 -2.914 1.00 64.34 O ATOM 974 CB LYS A 65 -6.542 -27.648 -1.561 1.00 2.10 C ATOM 975 CG LYS A 65 -5.675 -27.669 -0.292 1.00 73.25 C ATOM 976 CD LYS A 65 -5.147 -26.284 0.105 1.00 53.43 C ATOM 977 CE LYS A 65 -4.068 -25.760 -0.841 1.00 74.54 C ATOM 978 NZ LYS A 65 -3.560 -24.427 -0.414 1.00 62.51 N1+ ATOM 0 H LYS A 65 -7.669 -27.707 -3.760 1.00 0.43 H new ATOM 0 HA LYS A 65 -5.084 -26.953 -2.981 1.00 4.21 H new ATOM 0 HB2 LYS A 65 -7.097 -26.710 -1.589 1.00 2.10 H new ATOM 0 HB3 LYS A 65 -7.276 -28.451 -1.495 1.00 2.10 H new ATOM 0 HG2 LYS A 65 -6.260 -28.077 0.532 1.00 73.25 H new ATOM 0 HG3 LYS A 65 -4.831 -28.341 -0.448 1.00 73.25 H new ATOM 0 HD2 LYS A 65 -5.977 -25.578 0.126 1.00 53.43 H new ATOM 0 HD3 LYS A 65 -4.743 -26.332 1.116 1.00 53.43 H new ATOM 0 HE2 LYS A 65 -3.241 -26.469 -0.878 1.00 74.54 H new ATOM 0 HE3 LYS A 65 -4.473 -25.689 -1.851 1.00 74.54 H new ATOM 0 HZ1 LYS A 65 -2.829 -24.104 -1.080 1.00 62.51 H new ATOM 0 HZ2 LYS A 65 -4.344 -23.744 -0.403 1.00 62.51 H new ATOM 0 HZ3 LYS A 65 -3.151 -24.500 0.539 1.00 62.51 H new ATOM 992 N LEU A 66 -5.666 -30.217 -2.841 1.00 12.42 N ATOM 993 CA LEU A 66 -5.030 -31.527 -2.787 1.00 2.43 C ATOM 994 C LEU A 66 -4.206 -31.763 -4.053 1.00 60.12 C ATOM 995 O LEU A 66 -3.127 -32.346 -4.004 1.00 51.14 O ATOM 996 CB LEU A 66 -6.080 -32.637 -2.603 1.00 45.35 C ATOM 997 CG LEU A 66 -7.159 -32.334 -1.546 1.00 74.51 C ATOM 998 CD1 LEU A 66 -8.152 -33.485 -1.432 1.00 61.45 C ATOM 999 CD2 LEU A 66 -6.521 -32.034 -0.191 1.00 41.11 C ATOM 0 H LEU A 66 -6.686 -30.244 -2.855 1.00 12.42 H new ATOM 0 HA LEU A 66 -4.361 -31.554 -1.927 1.00 2.43 H new ATOM 0 HB2 LEU A 66 -6.569 -32.818 -3.560 1.00 45.35 H new ATOM 0 HB3 LEU A 66 -5.569 -33.559 -2.327 1.00 45.35 H new ATOM 0 HG LEU A 66 -7.706 -31.448 -1.869 1.00 74.51 H new ATOM 0 HD11 LEU A 66 -8.903 -33.245 -0.679 1.00 61.45 H new ATOM 0 HD12 LEU A 66 -8.640 -33.641 -2.394 1.00 61.45 H new ATOM 0 HD13 LEU A 66 -7.624 -34.393 -1.141 1.00 61.45 H new ATOM 0 HD21 LEU A 66 -7.302 -31.823 0.540 1.00 41.11 H new ATOM 0 HD22 LEU A 66 -5.941 -32.896 0.137 1.00 41.11 H new ATOM 0 HD23 LEU A 66 -5.865 -31.168 -0.281 1.00 41.11 H new ATOM 1011 N ALA A 67 -4.715 -31.275 -5.184 1.00 43.32 N ATOM 1012 CA ALA A 67 -4.006 -31.385 -6.453 1.00 1.23 C ATOM 1013 C ALA A 67 -2.704 -30.591 -6.399 1.00 3.40 C ATOM 1014 O ALA A 67 -1.640 -31.132 -6.628 1.00 21.23 O ATOM 1015 CB ALA A 67 -4.887 -30.900 -7.602 1.00 34.31 C ATOM 0 H ALA A 67 -5.616 -30.800 -5.245 1.00 43.32 H new ATOM 0 HA ALA A 67 -3.765 -32.433 -6.629 1.00 1.23 H new ATOM 0 HB1 ALA A 67 -4.342 -30.989 -8.541 1.00 34.31 H new ATOM 0 HB2 ALA A 67 -5.791 -31.507 -7.648 1.00 34.31 H new ATOM 0 HB3 ALA A 67 -5.158 -29.857 -7.438 1.00 34.31 H new ATOM 1021 N GLN A 68 -2.799 -29.318 -6.042 1.00 30.24 N ATOM 1022 CA GLN A 68 -1.633 -28.431 -5.983 1.00 34.53 C ATOM 1023 C GLN A 68 -0.550 -29.014 -5.078 1.00 14.40 C ATOM 1024 O GLN A 68 0.637 -28.983 -5.414 1.00 34.01 O ATOM 1025 CB GLN A 68 -2.039 -27.033 -5.488 1.00 73.12 C ATOM 1026 CG GLN A 68 -2.886 -26.251 -6.490 1.00 63.23 C ATOM 1027 CD GLN A 68 -3.442 -24.954 -5.924 1.00 72.52 C ATOM 1028 OE1 GLN A 68 -3.686 -24.838 -4.723 1.00 74.13 O ATOM 1029 NE2 GLN A 68 -3.657 -23.971 -6.784 1.00 35.24 N ATOM 0 H GLN A 68 -3.678 -28.868 -5.786 1.00 30.24 H new ATOM 0 HA GLN A 68 -1.229 -28.342 -6.991 1.00 34.53 H new ATOM 0 HB2 GLN A 68 -2.595 -27.134 -4.556 1.00 73.12 H new ATOM 0 HB3 GLN A 68 -1.139 -26.461 -5.262 1.00 73.12 H new ATOM 0 HG2 GLN A 68 -2.282 -26.026 -7.369 1.00 63.23 H new ATOM 0 HG3 GLN A 68 -3.713 -26.878 -6.824 1.00 63.23 H new ATOM 0 HE21 GLN A 68 -3.443 -24.102 -7.773 1.00 35.24 H new ATOM 0 HE22 GLN A 68 -4.037 -23.082 -6.458 1.00 35.24 H new ATOM 1038 N GLN A 69 -0.967 -29.556 -3.937 1.00 23.22 N ATOM 1039 CA GLN A 69 -0.029 -30.128 -2.976 1.00 22.40 C ATOM 1040 C GLN A 69 0.544 -31.462 -3.478 1.00 3.21 C ATOM 1041 O GLN A 69 1.746 -31.716 -3.355 1.00 75.41 O ATOM 1042 CB GLN A 69 -0.719 -30.315 -1.614 1.00 11.52 C ATOM 1043 CG GLN A 69 0.216 -30.766 -0.493 1.00 32.44 C ATOM 1044 CD GLN A 69 -0.458 -30.766 0.871 1.00 50.30 C ATOM 1045 OE1 GLN A 69 -0.393 -29.639 1.561 1.00 65.51 O flip ATOM 1046 NE2 GLN A 69 -1.039 -31.764 1.298 1.00 31.30 N flip ATOM 0 H GLN A 69 -1.946 -29.611 -3.656 1.00 23.22 H new ATOM 0 HA GLN A 69 0.804 -29.434 -2.860 1.00 22.40 H new ATOM 0 HB2 GLN A 69 -1.187 -29.374 -1.325 1.00 11.52 H new ATOM 0 HB3 GLN A 69 -1.518 -31.048 -1.722 1.00 11.52 H new ATOM 0 HG2 GLN A 69 0.582 -31.769 -0.713 1.00 32.44 H new ATOM 0 HG3 GLN A 69 1.085 -30.109 -0.464 1.00 32.44 H new ATOM 0 HE21 GLN A 69 -1.069 -32.616 0.738 1.00 31.30 H new ATOM 0 HE22 GLN A 69 -1.491 -31.739 2.212 1.00 31.30 H new ATOM 1055 N TYR A 70 -0.314 -32.294 -4.069 1.00 14.41 N ATOM 1056 CA TYR A 70 0.043 -33.675 -4.433 1.00 60.14 C ATOM 1057 C TYR A 70 0.281 -33.862 -5.943 1.00 40.42 C ATOM 1058 O TYR A 70 0.490 -34.983 -6.393 1.00 75.22 O ATOM 1059 CB TYR A 70 -1.049 -34.646 -3.962 1.00 23.30 C ATOM 1060 CG TYR A 70 -1.337 -34.591 -2.469 1.00 14.04 C ATOM 1061 CD1 TYR A 70 -2.643 -34.490 -1.995 1.00 64.52 C ATOM 1062 CD2 TYR A 70 -0.306 -34.642 -1.535 1.00 13.23 C ATOM 1063 CE1 TYR A 70 -2.912 -34.440 -0.642 1.00 62.24 C ATOM 1064 CE2 TYR A 70 -0.571 -34.594 -0.178 1.00 4.24 C ATOM 1065 CZ TYR A 70 -1.875 -34.493 0.262 1.00 51.45 C ATOM 1066 OH TYR A 70 -2.143 -34.437 1.611 1.00 12.52 O ATOM 0 H TYR A 70 -1.271 -32.037 -4.310 1.00 14.41 H new ATOM 0 HA TYR A 70 0.985 -33.892 -3.930 1.00 60.14 H new ATOM 0 HB2 TYR A 70 -1.969 -34.430 -4.505 1.00 23.30 H new ATOM 0 HB3 TYR A 70 -0.754 -35.662 -4.226 1.00 23.30 H new ATOM 0 HD1 TYR A 70 -3.461 -34.450 -2.699 1.00 64.52 H new ATOM 0 HD2 TYR A 70 0.716 -34.720 -1.875 1.00 13.23 H new ATOM 0 HE1 TYR A 70 -3.931 -34.360 -0.294 1.00 62.24 H new ATOM 0 HE2 TYR A 70 0.240 -34.635 0.534 1.00 4.24 H new ATOM 0 HH TYR A 70 -2.713 -35.193 1.863 1.00 12.52 H new ATOM 1076 N THR A 71 0.239 -32.773 -6.712 1.00 61.35 N ATOM 1077 CA THR A 71 0.195 -32.830 -8.192 1.00 51.44 C ATOM 1078 C THR A 71 1.318 -33.668 -8.818 1.00 2.11 C ATOM 1079 O THR A 71 1.198 -34.091 -9.970 1.00 63.31 O ATOM 1080 CB THR A 71 0.246 -31.406 -8.809 1.00 32.42 C ATOM 1081 OG1 THR A 71 0.097 -31.464 -10.240 1.00 20.15 O ATOM 1082 CG2 THR A 71 1.552 -30.699 -8.461 1.00 4.22 C ATOM 0 H THR A 71 0.234 -31.824 -6.337 1.00 61.35 H new ATOM 0 HA THR A 71 -0.752 -33.318 -8.423 1.00 51.44 H new ATOM 0 HB THR A 71 -0.582 -30.838 -8.385 1.00 32.42 H new ATOM 0 HG1 THR A 71 0.485 -32.299 -10.576 1.00 20.15 H new ATOM 0 HG21 THR A 71 1.558 -29.705 -8.907 1.00 4.22 H new ATOM 0 HG22 THR A 71 1.641 -30.611 -7.378 1.00 4.22 H new ATOM 0 HG23 THR A 71 2.392 -31.275 -8.849 1.00 4.22 H new ATOM 1090 N GLU A 72 2.400 -33.902 -8.086 1.00 51.24 N ATOM 1091 CA GLU A 72 3.515 -34.689 -8.616 1.00 74.02 C ATOM 1092 C GLU A 72 3.153 -36.174 -8.691 1.00 60.10 C ATOM 1093 O GLU A 72 3.795 -36.944 -9.407 1.00 53.34 O ATOM 1094 CB GLU A 72 4.767 -34.475 -7.761 1.00 21.44 C ATOM 1095 CG GLU A 72 5.293 -33.046 -7.816 1.00 35.12 C ATOM 1096 CD GLU A 72 6.470 -32.820 -6.887 1.00 32.11 C ATOM 1097 OE1 GLU A 72 7.605 -33.184 -7.256 1.00 53.51 O ATOM 1098 OE2 GLU A 72 6.264 -32.273 -5.782 1.00 0.13 O1- ATOM 0 H GLU A 72 2.532 -33.564 -7.133 1.00 51.24 H new ATOM 0 HA GLU A 72 3.725 -34.348 -9.630 1.00 74.02 H new ATOM 0 HB2 GLU A 72 4.541 -34.733 -6.726 1.00 21.44 H new ATOM 0 HB3 GLU A 72 5.549 -35.157 -8.096 1.00 21.44 H new ATOM 0 HG2 GLU A 72 5.592 -32.812 -8.838 1.00 35.12 H new ATOM 0 HG3 GLU A 72 4.490 -32.357 -7.553 1.00 35.12 H new ATOM 1105 N ASN A 73 2.123 -36.560 -7.945 1.00 54.34 N ATOM 1106 CA ASN A 73 1.631 -37.941 -7.930 1.00 53.33 C ATOM 1107 C ASN A 73 0.151 -37.986 -8.308 1.00 50.23 C ATOM 1108 O ASN A 73 -0.333 -38.986 -8.825 1.00 40.15 O ATOM 1109 CB ASN A 73 1.826 -38.558 -6.537 1.00 52.25 C ATOM 1110 CG ASN A 73 1.312 -39.990 -6.426 1.00 60.25 C ATOM 1111 OD1 ASN A 73 0.125 -40.227 -6.197 1.00 52.33 O ATOM 1112 ND2 ASN A 73 2.208 -40.955 -6.549 1.00 3.30 N ATOM 0 H ASN A 73 1.604 -35.929 -7.334 1.00 54.34 H new ATOM 0 HA ASN A 73 2.200 -38.516 -8.661 1.00 53.33 H new ATOM 0 HB2 ASN A 73 2.887 -38.541 -6.287 1.00 52.25 H new ATOM 0 HB3 ASN A 73 1.315 -37.939 -5.800 1.00 52.25 H new ATOM 0 HD21 ASN A 73 1.924 -41.930 -6.454 1.00 3.30 H new ATOM 0 HD22 ASN A 73 3.183 -40.724 -6.739 1.00 3.30 H new ATOM 1119 N VAL A 74 -0.556 -36.886 -8.067 1.00 42.24 N ATOM 1120 CA VAL A 74 -2.006 -36.839 -8.234 1.00 72.51 C ATOM 1121 C VAL A 74 -2.410 -35.996 -9.442 1.00 33.41 C ATOM 1122 O VAL A 74 -1.891 -34.899 -9.653 1.00 74.22 O ATOM 1123 CB VAL A 74 -2.685 -36.270 -6.959 1.00 15.53 C ATOM 1124 CG1 VAL A 74 -4.161 -35.944 -7.197 1.00 23.10 C ATOM 1125 CG2 VAL A 74 -2.528 -37.246 -5.797 1.00 50.05 C ATOM 0 H VAL A 74 -0.144 -36.007 -7.753 1.00 42.24 H new ATOM 0 HA VAL A 74 -2.342 -37.862 -8.401 1.00 72.51 H new ATOM 0 HB VAL A 74 -2.185 -35.335 -6.706 1.00 15.53 H new ATOM 0 HG11 VAL A 74 -4.599 -35.549 -6.280 1.00 23.10 H new ATOM 0 HG12 VAL A 74 -4.246 -35.201 -7.990 1.00 23.10 H new ATOM 0 HG13 VAL A 74 -4.691 -36.850 -7.491 1.00 23.10 H new ATOM 0 HG21 VAL A 74 -3.008 -36.835 -4.909 1.00 50.05 H new ATOM 0 HG22 VAL A 74 -2.995 -38.197 -6.055 1.00 50.05 H new ATOM 0 HG23 VAL A 74 -1.469 -37.405 -5.596 1.00 50.05 H new ATOM 1135 N LYS A 75 -3.340 -36.525 -10.229 1.00 71.33 N ATOM 1136 CA LYS A 75 -3.953 -35.778 -11.324 1.00 20.41 C ATOM 1137 C LYS A 75 -5.453 -36.060 -11.349 1.00 63.15 C ATOM 1138 O LYS A 75 -5.868 -37.219 -11.355 1.00 32.02 O ATOM 1139 CB LYS A 75 -3.321 -36.154 -12.677 1.00 33.32 C ATOM 1140 CG LYS A 75 -3.940 -35.422 -13.870 1.00 15.44 C ATOM 1141 CD LYS A 75 -3.671 -33.914 -13.844 1.00 32.33 C ATOM 1142 CE LYS A 75 -2.247 -33.576 -14.273 1.00 62.53 C ATOM 1143 NZ LYS A 75 -1.997 -33.901 -15.707 1.00 41.05 N1+ ATOM 0 H LYS A 75 -3.690 -37.478 -10.128 1.00 71.33 H new ATOM 0 HA LYS A 75 -3.781 -34.714 -11.160 1.00 20.41 H new ATOM 0 HB2 LYS A 75 -2.254 -35.936 -12.642 1.00 33.32 H new ATOM 0 HB3 LYS A 75 -3.422 -37.229 -12.829 1.00 33.32 H new ATOM 0 HG2 LYS A 75 -3.543 -35.842 -14.794 1.00 15.44 H new ATOM 0 HG3 LYS A 75 -5.016 -35.595 -13.878 1.00 15.44 H new ATOM 0 HD2 LYS A 75 -4.377 -33.409 -14.503 1.00 32.33 H new ATOM 0 HD3 LYS A 75 -3.846 -33.533 -12.838 1.00 32.33 H new ATOM 0 HE2 LYS A 75 -2.061 -32.515 -14.105 1.00 62.53 H new ATOM 0 HE3 LYS A 75 -1.542 -34.126 -13.650 1.00 62.53 H new ATOM 0 HZ1 LYS A 75 -1.074 -33.518 -15.994 1.00 41.05 H new ATOM 0 HZ2 LYS A 75 -1.998 -34.933 -15.834 1.00 41.05 H new ATOM 0 HZ3 LYS A 75 -2.745 -33.479 -16.294 1.00 41.05 H new ATOM 1157 N ILE A 76 -6.263 -35.003 -11.347 1.00 10.31 N ATOM 1158 CA ILE A 76 -7.720 -35.144 -11.366 1.00 43.12 C ATOM 1159 C ILE A 76 -8.274 -34.723 -12.724 1.00 51.15 C ATOM 1160 O ILE A 76 -8.037 -33.598 -13.176 1.00 60.02 O ATOM 1161 CB ILE A 76 -8.395 -34.296 -10.255 1.00 3.10 C ATOM 1162 CG1 ILE A 76 -7.736 -34.575 -8.892 1.00 3.44 C ATOM 1163 CG2 ILE A 76 -9.899 -34.586 -10.198 1.00 13.44 C ATOM 1164 CD1 ILE A 76 -8.299 -33.751 -7.752 1.00 73.14 C ATOM 0 H ILE A 76 -5.935 -34.037 -11.332 1.00 10.31 H new ATOM 0 HA ILE A 76 -7.946 -36.194 -11.182 1.00 43.12 H new ATOM 0 HB ILE A 76 -8.259 -33.241 -10.493 1.00 3.10 H new ATOM 0 HG12 ILE A 76 -7.853 -35.632 -8.654 1.00 3.44 H new ATOM 0 HG13 ILE A 76 -6.666 -34.382 -8.972 1.00 3.44 H new ATOM 0 HG21 ILE A 76 -10.356 -33.983 -9.414 1.00 13.44 H new ATOM 0 HG22 ILE A 76 -10.354 -34.339 -11.157 1.00 13.44 H new ATOM 0 HG23 ILE A 76 -10.058 -35.643 -9.982 1.00 13.44 H new ATOM 0 HD11 ILE A 76 -7.781 -34.007 -6.828 1.00 73.14 H new ATOM 0 HD12 ILE A 76 -8.158 -32.691 -7.965 1.00 73.14 H new ATOM 0 HD13 ILE A 76 -9.363 -33.961 -7.642 1.00 73.14 H new ATOM 1176 N TYR A 77 -9.003 -35.628 -13.371 1.00 3.34 N ATOM 1177 CA TYR A 77 -9.579 -35.368 -14.686 1.00 12.22 C ATOM 1178 C TYR A 77 -11.091 -35.179 -14.594 1.00 34.33 C ATOM 1179 O TYR A 77 -11.782 -35.982 -13.966 1.00 1.44 O ATOM 1180 CB TYR A 77 -9.288 -36.529 -15.649 1.00 23.15 C ATOM 1181 CG TYR A 77 -7.817 -36.804 -15.889 1.00 51.23 C ATOM 1182 CD1 TYR A 77 -7.185 -37.884 -15.287 1.00 62.14 C ATOM 1183 CD2 TYR A 77 -7.064 -35.992 -16.731 1.00 61.02 C ATOM 1184 CE1 TYR A 77 -5.848 -38.147 -15.513 1.00 25.40 C ATOM 1185 CE2 TYR A 77 -5.726 -36.248 -16.959 1.00 34.01 C ATOM 1186 CZ TYR A 77 -5.124 -37.327 -16.350 1.00 2.40 C ATOM 1187 OH TYR A 77 -3.789 -37.584 -16.577 1.00 22.34 O ATOM 0 H TYR A 77 -9.210 -36.556 -13.001 1.00 3.34 H new ATOM 0 HA TYR A 77 -9.121 -34.454 -15.064 1.00 12.22 H new ATOM 0 HB2 TYR A 77 -9.753 -37.433 -15.256 1.00 23.15 H new ATOM 0 HB3 TYR A 77 -9.764 -36.316 -16.606 1.00 23.15 H new ATOM 0 HD1 TYR A 77 -7.749 -38.530 -14.630 1.00 62.14 H new ATOM 0 HD2 TYR A 77 -7.533 -35.148 -17.214 1.00 61.02 H new ATOM 0 HE1 TYR A 77 -5.373 -38.991 -15.036 1.00 25.40 H new ATOM 0 HE2 TYR A 77 -5.154 -35.605 -17.612 1.00 34.01 H new ATOM 0 HH TYR A 77 -3.426 -36.912 -17.192 1.00 22.34 H new ATOM 1197 N LYS A 78 -11.597 -34.123 -15.222 1.00 10.01 N ATOM 1198 CA LYS A 78 -13.035 -33.938 -15.391 1.00 3.41 C ATOM 1199 C LYS A 78 -13.448 -34.429 -16.775 1.00 25.15 C ATOM 1200 O LYS A 78 -13.238 -33.740 -17.779 1.00 45.21 O ATOM 1201 CB LYS A 78 -13.446 -32.460 -15.207 1.00 53.32 C ATOM 1202 CG LYS A 78 -13.626 -32.032 -13.747 1.00 32.43 C ATOM 1203 CD LYS A 78 -14.107 -30.583 -13.626 1.00 31.14 C ATOM 1204 CE LYS A 78 -14.355 -30.172 -12.172 1.00 3.31 C ATOM 1205 NZ LYS A 78 -15.509 -30.891 -11.567 1.00 62.33 N1+ ATOM 0 H LYS A 78 -11.029 -33.378 -15.625 1.00 10.01 H new ATOM 0 HA LYS A 78 -13.547 -34.518 -14.623 1.00 3.41 H new ATOM 0 HB2 LYS A 78 -12.690 -31.825 -15.669 1.00 53.32 H new ATOM 0 HB3 LYS A 78 -14.379 -32.285 -15.742 1.00 53.32 H new ATOM 0 HG2 LYS A 78 -14.344 -32.693 -13.262 1.00 32.43 H new ATOM 0 HG3 LYS A 78 -12.680 -32.145 -13.217 1.00 32.43 H new ATOM 0 HD2 LYS A 78 -13.365 -29.918 -14.067 1.00 31.14 H new ATOM 0 HD3 LYS A 78 -15.026 -30.459 -14.198 1.00 31.14 H new ATOM 0 HE2 LYS A 78 -13.459 -30.369 -11.584 1.00 3.31 H new ATOM 0 HE3 LYS A 78 -14.536 -29.098 -12.127 1.00 3.31 H new ATOM 0 HZ1 LYS A 78 -15.288 -31.133 -10.580 1.00 62.33 H new ATOM 0 HZ2 LYS A 78 -16.351 -30.281 -11.594 1.00 62.33 H new ATOM 0 HZ3 LYS A 78 -15.695 -31.762 -12.104 1.00 62.33 H new ATOM 1219 N ILE A 79 -13.991 -35.641 -16.836 1.00 35.25 N ATOM 1220 CA ILE A 79 -14.470 -36.197 -18.096 1.00 51.22 C ATOM 1221 C ILE A 79 -15.862 -35.654 -18.390 1.00 13.33 C ATOM 1222 O ILE A 79 -16.878 -36.279 -18.071 1.00 3.23 O ATOM 1223 CB ILE A 79 -14.501 -37.747 -18.080 1.00 11.23 C ATOM 1224 CG1 ILE A 79 -13.127 -38.306 -17.673 1.00 75.13 C ATOM 1225 CG2 ILE A 79 -14.919 -38.289 -19.451 1.00 32.21 C ATOM 1226 CD1 ILE A 79 -13.059 -39.818 -17.666 1.00 50.20 C ATOM 0 H ILE A 79 -14.110 -36.255 -16.030 1.00 35.25 H new ATOM 0 HA ILE A 79 -13.774 -35.896 -18.879 1.00 51.22 H new ATOM 0 HB ILE A 79 -15.237 -38.072 -17.344 1.00 11.23 H new ATOM 0 HG12 ILE A 79 -12.371 -37.921 -18.358 1.00 75.13 H new ATOM 0 HG13 ILE A 79 -12.875 -37.936 -16.679 1.00 75.13 H new ATOM 0 HG21 ILE A 79 -14.935 -39.378 -19.422 1.00 32.21 H new ATOM 0 HG22 ILE A 79 -15.913 -37.918 -19.702 1.00 32.21 H new ATOM 0 HG23 ILE A 79 -14.207 -37.957 -20.206 1.00 32.21 H new ATOM 0 HD11 ILE A 79 -12.060 -40.136 -17.369 1.00 50.20 H new ATOM 0 HD12 ILE A 79 -13.790 -40.212 -16.960 1.00 50.20 H new ATOM 0 HD13 ILE A 79 -13.279 -40.197 -18.664 1.00 50.20 H new ATOM 1238 N ASN A 80 -15.905 -34.465 -18.964 1.00 52.33 N ATOM 1239 CA ASN A 80 -17.164 -33.790 -19.227 1.00 2.04 C ATOM 1240 C ASN A 80 -17.738 -34.224 -20.571 1.00 60.11 C ATOM 1241 O ASN A 80 -17.596 -33.531 -21.579 1.00 23.20 O ATOM 1242 CB ASN A 80 -16.986 -32.263 -19.164 1.00 23.44 C ATOM 1243 CG ASN A 80 -16.488 -31.787 -17.803 1.00 12.41 C ATOM 1244 OD1 ASN A 80 -16.844 -32.502 -16.745 1.00 32.04 O flip ATOM 1245 ND2 ASN A 80 -15.791 -30.780 -17.700 1.00 24.31 N flip ATOM 0 H ASN A 80 -15.079 -33.945 -19.258 1.00 52.33 H new ATOM 0 HA ASN A 80 -17.876 -34.075 -18.452 1.00 2.04 H new ATOM 0 HB2 ASN A 80 -16.281 -31.951 -19.934 1.00 23.44 H new ATOM 0 HB3 ASN A 80 -17.937 -31.780 -19.388 1.00 23.44 H new ATOM 0 HD21 ASN A 80 -15.533 -30.251 -18.533 1.00 24.31 H new ATOM 0 HD22 ASN A 80 -15.470 -30.474 -16.782 1.00 24.31 H new ATOM 1252 N ILE A 81 -18.336 -35.410 -20.579 1.00 22.21 N ATOM 1253 CA ILE A 81 -19.040 -35.930 -21.749 1.00 54.13 C ATOM 1254 C ILE A 81 -20.537 -36.008 -21.446 1.00 65.23 C ATOM 1255 O ILE A 81 -21.135 -37.084 -21.403 1.00 21.40 O ATOM 1256 CB ILE A 81 -18.487 -37.313 -22.193 1.00 63.43 C ATOM 1257 CG1 ILE A 81 -18.452 -38.300 -21.012 1.00 0.10 C ATOM 1258 CG2 ILE A 81 -17.093 -37.156 -22.805 1.00 45.20 C ATOM 1259 CD1 ILE A 81 -17.929 -39.677 -21.376 1.00 64.23 C ATOM 0 H ILE A 81 -18.347 -36.039 -19.776 1.00 22.21 H new ATOM 0 HA ILE A 81 -18.875 -35.247 -22.582 1.00 54.13 H new ATOM 0 HB ILE A 81 -19.157 -37.720 -22.950 1.00 63.43 H new ATOM 0 HG12 ILE A 81 -17.829 -37.883 -20.221 1.00 0.10 H new ATOM 0 HG13 ILE A 81 -19.458 -38.400 -20.605 1.00 0.10 H new ATOM 0 HG21 ILE A 81 -16.718 -38.133 -23.111 1.00 45.20 H new ATOM 0 HG22 ILE A 81 -17.149 -36.500 -23.674 1.00 45.20 H new ATOM 0 HG23 ILE A 81 -16.418 -36.724 -22.066 1.00 45.20 H new ATOM 0 HD11 ILE A 81 -17.935 -40.314 -20.492 1.00 64.23 H new ATOM 0 HD12 ILE A 81 -18.565 -40.116 -22.144 1.00 64.23 H new ATOM 0 HD13 ILE A 81 -16.910 -39.591 -21.754 1.00 64.23 H new ATOM 1271 N GLU A 82 -21.118 -34.831 -21.243 1.00 34.03 N ATOM 1272 CA GLU A 82 -22.501 -34.674 -20.780 1.00 12.21 C ATOM 1273 C GLU A 82 -23.500 -35.462 -21.635 1.00 64.13 C ATOM 1274 O GLU A 82 -24.510 -35.952 -21.130 1.00 42.22 O ATOM 1275 CB GLU A 82 -22.861 -33.184 -20.800 1.00 14.33 C ATOM 1276 CG GLU A 82 -24.268 -32.863 -20.307 1.00 12.32 C ATOM 1277 CD GLU A 82 -24.632 -31.406 -20.530 1.00 44.14 C ATOM 1278 OE1 GLU A 82 -25.192 -31.086 -21.600 1.00 64.21 O ATOM 1279 OE2 GLU A 82 -24.340 -30.572 -19.651 1.00 51.21 O1- ATOM 0 H GLU A 82 -20.639 -33.944 -21.396 1.00 34.03 H new ATOM 0 HA GLU A 82 -22.565 -35.074 -19.768 1.00 12.21 H new ATOM 0 HB2 GLU A 82 -22.143 -32.642 -20.185 1.00 14.33 H new ATOM 0 HB3 GLU A 82 -22.754 -32.812 -21.819 1.00 14.33 H new ATOM 0 HG2 GLU A 82 -24.987 -33.499 -20.824 1.00 12.32 H new ATOM 0 HG3 GLU A 82 -24.342 -33.096 -19.245 1.00 12.32 H new ATOM 1286 N ASP A 83 -23.206 -35.593 -22.926 1.00 63.52 N ATOM 1287 CA ASP A 83 -24.140 -36.213 -23.871 1.00 11.04 C ATOM 1288 C ASP A 83 -24.239 -37.725 -23.647 1.00 33.50 C ATOM 1289 O ASP A 83 -25.173 -38.376 -24.118 1.00 21.21 O ATOM 1290 CB ASP A 83 -23.702 -35.917 -25.313 1.00 23.45 C ATOM 1291 CG ASP A 83 -24.691 -36.432 -26.351 1.00 52.42 C ATOM 1292 OD1 ASP A 83 -24.401 -37.455 -27.011 1.00 43.25 O ATOM 1293 OD2 ASP A 83 -25.762 -35.806 -26.519 1.00 25.20 O1- ATOM 0 H ASP A 83 -22.330 -35.280 -23.345 1.00 63.52 H new ATOM 0 HA ASP A 83 -25.128 -35.785 -23.700 1.00 11.04 H new ATOM 0 HB2 ASP A 83 -23.581 -34.841 -25.437 1.00 23.45 H new ATOM 0 HB3 ASP A 83 -22.727 -36.370 -25.491 1.00 23.45 H new ATOM 1298 N ASN A 84 -23.282 -38.275 -22.908 1.00 32.21 N ATOM 1299 CA ASN A 84 -23.220 -39.716 -22.675 1.00 13.34 C ATOM 1300 C ASN A 84 -23.665 -40.049 -21.254 1.00 61.05 C ATOM 1301 O ASN A 84 -22.841 -40.320 -20.378 1.00 23.22 O ATOM 1302 CB ASN A 84 -21.801 -40.244 -22.937 1.00 61.11 C ATOM 1303 CG ASN A 84 -21.326 -39.953 -24.349 1.00 73.53 C ATOM 1304 OD1 ASN A 84 -20.709 -38.799 -24.536 1.00 44.50 O flip ATOM 1305 ND2 ASN A 84 -21.522 -40.752 -25.266 1.00 3.45 N flip ATOM 0 H ASN A 84 -22.536 -37.744 -22.458 1.00 32.21 H new ATOM 0 HA ASN A 84 -23.901 -40.207 -23.370 1.00 13.34 H new ATOM 0 HB2 ASN A 84 -21.111 -39.792 -22.224 1.00 61.11 H new ATOM 0 HB3 ASN A 84 -21.779 -41.320 -22.764 1.00 61.11 H new ATOM 0 HD21 ASN A 84 -22.002 -41.633 -25.081 1.00 3.45 H new ATOM 0 HD22 ASN A 84 -21.204 -40.533 -26.210 1.00 3.45 H new ATOM 1312 N GLN A 85 -24.976 -40.015 -21.032 1.00 14.34 N ATOM 1313 CA GLN A 85 -25.552 -40.300 -19.719 1.00 73.43 C ATOM 1314 C GLN A 85 -25.252 -41.739 -19.298 1.00 30.44 C ATOM 1315 O GLN A 85 -25.052 -42.025 -18.114 1.00 11.40 O ATOM 1316 CB GLN A 85 -27.070 -40.057 -19.743 1.00 62.01 C ATOM 1317 CG GLN A 85 -27.754 -40.257 -18.392 1.00 14.43 C ATOM 1318 CD GLN A 85 -29.246 -39.963 -18.437 1.00 52.52 C ATOM 1319 OE1 GLN A 85 -29.674 -38.829 -18.228 1.00 30.11 O ATOM 1320 NE2 GLN A 85 -30.051 -40.983 -18.703 1.00 22.33 N ATOM 0 H GLN A 85 -25.665 -39.791 -21.750 1.00 14.34 H new ATOM 0 HA GLN A 85 -25.099 -39.628 -18.990 1.00 73.43 H new ATOM 0 HB2 GLN A 85 -27.259 -39.040 -20.087 1.00 62.01 H new ATOM 0 HB3 GLN A 85 -27.524 -40.730 -20.471 1.00 62.01 H new ATOM 0 HG2 GLN A 85 -27.601 -41.284 -18.061 1.00 14.43 H new ATOM 0 HG3 GLN A 85 -27.283 -39.610 -17.652 1.00 14.43 H new ATOM 0 HE21 GLN A 85 -29.661 -41.910 -18.871 1.00 22.33 H new ATOM 0 HE22 GLN A 85 -31.060 -40.840 -18.739 1.00 22.33 H new ATOM 1329 N ASP A 86 -25.196 -42.634 -20.286 1.00 11.41 N ATOM 1330 CA ASP A 86 -24.976 -44.064 -20.042 1.00 44.11 C ATOM 1331 C ASP A 86 -23.755 -44.303 -19.160 1.00 63.32 C ATOM 1332 O ASP A 86 -23.729 -45.251 -18.379 1.00 33.14 O ATOM 1333 CB ASP A 86 -24.809 -44.818 -21.369 1.00 54.34 C ATOM 1334 CG ASP A 86 -26.103 -44.918 -22.160 1.00 51.54 C ATOM 1335 OD1 ASP A 86 -26.754 -45.985 -22.122 1.00 24.41 O ATOM 1336 OD2 ASP A 86 -26.482 -43.929 -22.817 1.00 5.23 O1- ATOM 0 H ASP A 86 -25.301 -42.392 -21.271 1.00 11.41 H new ATOM 0 HA ASP A 86 -25.854 -44.442 -19.519 1.00 44.11 H new ATOM 0 HB2 ASP A 86 -24.057 -44.314 -21.975 1.00 54.34 H new ATOM 0 HB3 ASP A 86 -24.435 -45.821 -21.166 1.00 54.34 H new ATOM 1341 N VAL A 87 -22.754 -43.435 -19.279 1.00 53.31 N ATOM 1342 CA VAL A 87 -21.525 -43.560 -18.499 1.00 43.31 C ATOM 1343 C VAL A 87 -21.837 -43.600 -17.002 1.00 71.01 C ATOM 1344 O VAL A 87 -21.242 -44.382 -16.250 1.00 44.23 O ATOM 1345 CB VAL A 87 -20.549 -42.395 -18.803 1.00 24.23 C ATOM 1346 CG1 VAL A 87 -19.276 -42.504 -17.966 1.00 42.44 C ATOM 1347 CG2 VAL A 87 -20.212 -42.359 -20.293 1.00 22.14 C ATOM 0 H VAL A 87 -22.770 -42.634 -19.911 1.00 53.31 H new ATOM 0 HA VAL A 87 -21.046 -44.496 -18.786 1.00 43.31 H new ATOM 0 HB VAL A 87 -21.044 -41.462 -18.533 1.00 24.23 H new ATOM 0 HG11 VAL A 87 -18.613 -41.672 -18.203 1.00 42.44 H new ATOM 0 HG12 VAL A 87 -19.533 -42.473 -16.907 1.00 42.44 H new ATOM 0 HG13 VAL A 87 -18.773 -43.445 -18.190 1.00 42.44 H new ATOM 0 HG21 VAL A 87 -19.526 -41.536 -20.491 1.00 22.14 H new ATOM 0 HG22 VAL A 87 -19.744 -43.300 -20.583 1.00 22.14 H new ATOM 0 HG23 VAL A 87 -21.126 -42.216 -20.869 1.00 22.14 H new ATOM 1357 N ALA A 88 -22.799 -42.779 -16.584 1.00 74.24 N ATOM 1358 CA ALA A 88 -23.211 -42.729 -15.186 1.00 11.24 C ATOM 1359 C ALA A 88 -23.801 -44.072 -14.770 1.00 40.14 C ATOM 1360 O ALA A 88 -23.491 -44.600 -13.701 1.00 31.23 O ATOM 1361 CB ALA A 88 -24.219 -41.600 -14.964 1.00 44.41 C ATOM 0 H ALA A 88 -23.307 -42.140 -17.195 1.00 74.24 H new ATOM 0 HA ALA A 88 -22.337 -42.526 -14.567 1.00 11.24 H new ATOM 0 HB1 ALA A 88 -24.515 -41.578 -13.915 1.00 44.41 H new ATOM 0 HB2 ALA A 88 -23.763 -40.647 -15.233 1.00 44.41 H new ATOM 0 HB3 ALA A 88 -25.098 -41.770 -15.586 1.00 44.41 H new ATOM 1367 N THR A 89 -24.634 -44.626 -15.642 1.00 43.13 N ATOM 1368 CA THR A 89 -25.262 -45.916 -15.400 1.00 3.03 C ATOM 1369 C THR A 89 -24.210 -47.030 -15.343 1.00 72.34 C ATOM 1370 O THR A 89 -24.296 -47.935 -14.511 1.00 54.24 O ATOM 1371 CB THR A 89 -26.294 -46.230 -16.509 1.00 23.32 C ATOM 1372 OG1 THR A 89 -27.132 -45.085 -16.727 1.00 72.42 O ATOM 1373 CG2 THR A 89 -27.160 -47.433 -16.145 1.00 3.52 C ATOM 0 H THR A 89 -24.891 -44.196 -16.531 1.00 43.13 H new ATOM 0 HA THR A 89 -25.774 -45.867 -14.439 1.00 3.03 H new ATOM 0 HB THR A 89 -25.745 -46.471 -17.420 1.00 23.32 H new ATOM 0 HG1 THR A 89 -27.784 -45.286 -17.431 1.00 72.42 H new ATOM 0 HG21 THR A 89 -27.873 -47.624 -16.947 1.00 3.52 H new ATOM 0 HG22 THR A 89 -26.526 -48.309 -16.007 1.00 3.52 H new ATOM 0 HG23 THR A 89 -27.700 -47.226 -15.221 1.00 3.52 H new ATOM 1381 N GLN A 90 -23.208 -46.939 -16.220 1.00 45.13 N ATOM 1382 CA GLN A 90 -22.146 -47.942 -16.299 1.00 11.14 C ATOM 1383 C GLN A 90 -21.344 -47.984 -14.999 1.00 24.42 C ATOM 1384 O GLN A 90 -21.159 -49.048 -14.401 1.00 33.43 O ATOM 1385 CB GLN A 90 -21.203 -47.642 -17.478 1.00 21.33 C ATOM 1386 CG GLN A 90 -21.873 -47.672 -18.849 1.00 23.40 C ATOM 1387 CD GLN A 90 -22.542 -49.003 -19.155 1.00 32.12 C ATOM 1388 OE1 GLN A 90 -23.724 -49.200 -18.866 1.00 31.51 O ATOM 1389 NE2 GLN A 90 -21.792 -49.925 -19.740 1.00 52.44 N ATOM 0 H GLN A 90 -23.111 -46.175 -16.889 1.00 45.13 H new ATOM 0 HA GLN A 90 -22.615 -48.913 -16.457 1.00 11.14 H new ATOM 0 HB2 GLN A 90 -20.756 -46.659 -17.328 1.00 21.33 H new ATOM 0 HB3 GLN A 90 -20.389 -48.367 -17.469 1.00 21.33 H new ATOM 0 HG2 GLN A 90 -22.617 -46.877 -18.901 1.00 23.40 H new ATOM 0 HG3 GLN A 90 -21.128 -47.461 -19.616 1.00 23.40 H new ATOM 0 HE21 GLN A 90 -20.817 -49.723 -19.963 1.00 52.44 H new ATOM 0 HE22 GLN A 90 -22.189 -50.837 -19.967 1.00 52.44 H new ATOM 1398 N TYR A 91 -20.870 -46.817 -14.568 1.00 23.00 N ATOM 1399 CA TYR A 91 -20.063 -46.717 -13.354 1.00 63.04 C ATOM 1400 C TYR A 91 -20.946 -46.693 -12.104 1.00 53.41 C ATOM 1401 O TYR A 91 -20.446 -46.821 -10.984 1.00 53.15 O ATOM 1402 CB TYR A 91 -19.158 -45.477 -13.414 1.00 50.03 C ATOM 1403 CG TYR A 91 -18.048 -45.589 -14.448 1.00 40.41 C ATOM 1404 CD1 TYR A 91 -16.764 -45.984 -14.082 1.00 1.24 C ATOM 1405 CD2 TYR A 91 -18.283 -45.304 -15.789 1.00 62.23 C ATOM 1406 CE1 TYR A 91 -15.755 -46.091 -15.020 1.00 31.01 C ATOM 1407 CE2 TYR A 91 -17.277 -45.410 -16.732 1.00 43.30 C ATOM 1408 CZ TYR A 91 -16.015 -45.801 -16.342 1.00 51.11 C ATOM 1409 OH TYR A 91 -15.012 -45.909 -17.276 1.00 21.33 O ATOM 0 H TYR A 91 -21.031 -45.928 -15.041 1.00 23.00 H new ATOM 0 HA TYR A 91 -19.430 -47.602 -13.292 1.00 63.04 H new ATOM 0 HB2 TYR A 91 -19.768 -44.602 -13.639 1.00 50.03 H new ATOM 0 HB3 TYR A 91 -18.715 -45.312 -12.432 1.00 50.03 H new ATOM 0 HD1 TYR A 91 -16.553 -46.211 -13.047 1.00 1.24 H new ATOM 0 HD2 TYR A 91 -19.270 -44.994 -16.100 1.00 62.23 H new ATOM 0 HE1 TYR A 91 -14.765 -46.401 -14.718 1.00 31.01 H new ATOM 0 HE2 TYR A 91 -17.480 -45.187 -17.769 1.00 43.30 H new ATOM 0 HH TYR A 91 -14.210 -45.450 -16.949 1.00 21.33 H new ATOM 1419 N GLY A 92 -22.255 -46.519 -12.303 1.00 22.12 N ATOM 1420 CA GLY A 92 -23.203 -46.592 -11.201 1.00 65.55 C ATOM 1421 C GLY A 92 -23.114 -45.393 -10.279 1.00 41.00 C ATOM 1422 O GLY A 92 -23.120 -45.542 -9.052 1.00 12.12 O ATOM 0 H GLY A 92 -22.675 -46.328 -13.213 1.00 22.12 H new ATOM 0 HA2 GLY A 92 -24.215 -46.665 -11.600 1.00 65.55 H new ATOM 0 HA3 GLY A 92 -23.020 -47.501 -10.628 1.00 65.55 H new ATOM 1426 N VAL A 93 -23.033 -44.202 -10.865 1.00 13.51 N ATOM 1427 CA VAL A 93 -22.969 -42.972 -10.088 1.00 13.34 C ATOM 1428 C VAL A 93 -24.219 -42.833 -9.222 1.00 30.02 C ATOM 1429 O VAL A 93 -25.333 -42.668 -9.730 1.00 73.22 O ATOM 1430 CB VAL A 93 -22.817 -41.725 -10.991 1.00 53.43 C ATOM 1431 CG1 VAL A 93 -22.809 -40.450 -10.148 1.00 75.31 C ATOM 1432 CG2 VAL A 93 -21.542 -41.824 -11.829 1.00 13.21 C ATOM 0 H VAL A 93 -23.010 -44.064 -11.875 1.00 13.51 H new ATOM 0 HA VAL A 93 -22.086 -43.033 -9.452 1.00 13.34 H new ATOM 0 HB VAL A 93 -23.671 -41.683 -11.667 1.00 53.43 H new ATOM 0 HG11 VAL A 93 -22.701 -39.583 -10.800 1.00 75.31 H new ATOM 0 HG12 VAL A 93 -23.745 -40.374 -9.595 1.00 75.31 H new ATOM 0 HG13 VAL A 93 -21.975 -40.482 -9.447 1.00 75.31 H new ATOM 0 HG21 VAL A 93 -21.451 -40.939 -12.458 1.00 13.21 H new ATOM 0 HG22 VAL A 93 -20.677 -41.891 -11.169 1.00 13.21 H new ATOM 0 HG23 VAL A 93 -21.588 -42.713 -12.458 1.00 13.21 H new ATOM 1442 N SER A 94 -24.020 -42.921 -7.915 1.00 15.51 N ATOM 1443 CA SER A 94 -25.114 -42.924 -6.956 1.00 63.12 C ATOM 1444 C SER A 94 -25.515 -41.501 -6.555 1.00 52.01 C ATOM 1445 O SER A 94 -26.701 -41.170 -6.510 1.00 33.01 O ATOM 1446 CB SER A 94 -24.684 -43.720 -5.729 1.00 45.35 C ATOM 1447 OG SER A 94 -24.221 -45.011 -6.103 1.00 22.42 O ATOM 0 H SER A 94 -23.096 -42.992 -7.490 1.00 15.51 H new ATOM 0 HA SER A 94 -25.987 -43.386 -7.417 1.00 63.12 H new ATOM 0 HB2 SER A 94 -23.895 -43.185 -5.200 1.00 45.35 H new ATOM 0 HB3 SER A 94 -25.522 -43.815 -5.039 1.00 45.35 H new ATOM 0 HG SER A 94 -23.948 -45.505 -5.302 1.00 22.42 H new ATOM 1453 N ALA A 95 -24.522 -40.662 -6.279 1.00 12.01 N ATOM 1454 CA ALA A 95 -24.767 -39.298 -5.818 1.00 52.44 C ATOM 1455 C ALA A 95 -23.741 -38.345 -6.410 1.00 22.24 C ATOM 1456 O ALA A 95 -22.697 -38.775 -6.910 1.00 22.21 O ATOM 1457 CB ALA A 95 -24.737 -39.237 -4.293 1.00 0.24 C ATOM 0 H ALA A 95 -23.535 -40.903 -6.367 1.00 12.01 H new ATOM 0 HA ALA A 95 -25.757 -38.991 -6.156 1.00 52.44 H new ATOM 0 HB1 ALA A 95 -24.921 -38.214 -3.966 1.00 0.24 H new ATOM 0 HB2 ALA A 95 -25.508 -39.892 -3.887 1.00 0.24 H new ATOM 0 HB3 ALA A 95 -23.760 -39.562 -3.935 1.00 0.24 H new ATOM 1463 N ILE A 96 -24.042 -37.055 -6.352 1.00 40.13 N ATOM 1464 CA ILE A 96 -23.158 -36.030 -6.890 1.00 41.53 C ATOM 1465 C ILE A 96 -22.367 -35.353 -5.764 1.00 24.21 C ATOM 1466 O ILE A 96 -22.934 -34.996 -4.728 1.00 22.54 O ATOM 1467 CB ILE A 96 -23.949 -34.960 -7.693 1.00 44.03 C ATOM 1468 CG1 ILE A 96 -25.045 -34.310 -6.825 1.00 70.20 C ATOM 1469 CG2 ILE A 96 -24.553 -35.581 -8.954 1.00 72.40 C ATOM 1470 CD1 ILE A 96 -25.860 -33.255 -7.547 1.00 75.51 C ATOM 0 H ILE A 96 -24.899 -36.691 -5.934 1.00 40.13 H new ATOM 0 HA ILE A 96 -22.463 -36.523 -7.570 1.00 41.53 H new ATOM 0 HB ILE A 96 -23.253 -34.176 -7.991 1.00 44.03 H new ATOM 0 HG12 ILE A 96 -25.717 -35.089 -6.463 1.00 70.20 H new ATOM 0 HG13 ILE A 96 -24.580 -33.858 -5.949 1.00 70.20 H new ATOM 0 HG21 ILE A 96 -25.104 -34.820 -9.506 1.00 72.40 H new ATOM 0 HG22 ILE A 96 -23.755 -35.979 -9.582 1.00 72.40 H new ATOM 0 HG23 ILE A 96 -25.230 -36.388 -8.674 1.00 72.40 H new ATOM 0 HD11 ILE A 96 -26.609 -32.846 -6.869 1.00 75.51 H new ATOM 0 HD12 ILE A 96 -25.202 -32.455 -7.885 1.00 75.51 H new ATOM 0 HD13 ILE A 96 -26.356 -33.704 -8.407 1.00 75.51 H new ATOM 1482 N PRO A 97 -21.038 -35.188 -5.932 1.00 41.14 N ATOM 1483 CA PRO A 97 -20.298 -35.679 -7.095 1.00 50.44 C ATOM 1484 C PRO A 97 -19.766 -37.100 -6.878 1.00 2.04 C ATOM 1485 O PRO A 97 -20.008 -37.715 -5.836 1.00 63.12 O ATOM 1486 CB PRO A 97 -19.147 -34.676 -7.187 1.00 4.13 C ATOM 1487 CG PRO A 97 -18.851 -34.321 -5.765 1.00 64.14 C ATOM 1488 CD PRO A 97 -20.147 -34.484 -4.992 1.00 35.15 C ATOM 0 HA PRO A 97 -20.908 -35.745 -7.996 1.00 50.44 H new ATOM 0 HB2 PRO A 97 -18.277 -35.113 -7.677 1.00 4.13 H new ATOM 0 HB3 PRO A 97 -19.431 -33.797 -7.766 1.00 4.13 H new ATOM 0 HG2 PRO A 97 -18.075 -34.969 -5.359 1.00 64.14 H new ATOM 0 HG3 PRO A 97 -18.483 -33.298 -5.691 1.00 64.14 H new ATOM 0 HD2 PRO A 97 -19.997 -35.059 -4.078 1.00 35.15 H new ATOM 0 HD3 PRO A 97 -20.560 -33.519 -4.697 1.00 35.15 H new ATOM 1496 N THR A 98 -19.045 -37.616 -7.866 1.00 51.24 N ATOM 1497 CA THR A 98 -18.431 -38.934 -7.772 1.00 74.00 C ATOM 1498 C THR A 98 -17.001 -38.884 -8.308 1.00 5.01 C ATOM 1499 O THR A 98 -16.755 -38.347 -9.394 1.00 43.51 O ATOM 1500 CB THR A 98 -19.251 -39.997 -8.542 1.00 21.00 C ATOM 1501 OG1 THR A 98 -20.562 -40.109 -7.971 1.00 33.40 O ATOM 1502 CG2 THR A 98 -18.568 -41.361 -8.506 1.00 73.42 C ATOM 0 H THR A 98 -18.870 -37.136 -8.749 1.00 51.24 H new ATOM 0 HA THR A 98 -18.413 -39.222 -6.721 1.00 74.00 H new ATOM 0 HB THR A 98 -19.323 -39.675 -9.581 1.00 21.00 H new ATOM 0 HG1 THR A 98 -20.961 -39.218 -7.891 1.00 33.40 H new ATOM 0 HG21 THR A 98 -19.170 -42.084 -9.056 1.00 73.42 H new ATOM 0 HG22 THR A 98 -17.582 -41.286 -8.965 1.00 73.42 H new ATOM 0 HG23 THR A 98 -18.463 -41.688 -7.472 1.00 73.42 H new ATOM 1510 N ILE A 99 -16.074 -39.430 -7.525 1.00 33.32 N ATOM 1511 CA ILE A 99 -14.653 -39.425 -7.854 1.00 62.41 C ATOM 1512 C ILE A 99 -14.132 -40.858 -7.974 1.00 30.42 C ATOM 1513 O ILE A 99 -14.142 -41.609 -7.000 1.00 23.12 O ATOM 1514 CB ILE A 99 -13.834 -38.689 -6.758 1.00 11.51 C ATOM 1515 CG1 ILE A 99 -14.365 -37.258 -6.539 1.00 44.42 C ATOM 1516 CG2 ILE A 99 -12.348 -38.662 -7.119 1.00 43.23 C ATOM 1517 CD1 ILE A 99 -14.240 -36.356 -7.750 1.00 13.43 C ATOM 0 H ILE A 99 -16.289 -39.890 -6.641 1.00 33.32 H new ATOM 0 HA ILE A 99 -14.534 -38.905 -8.804 1.00 62.41 H new ATOM 0 HB ILE A 99 -13.951 -39.240 -5.825 1.00 11.51 H new ATOM 0 HG12 ILE A 99 -15.414 -37.313 -6.248 1.00 44.42 H new ATOM 0 HG13 ILE A 99 -13.826 -36.806 -5.706 1.00 44.42 H new ATOM 0 HG21 ILE A 99 -11.793 -38.142 -6.338 1.00 43.23 H new ATOM 0 HG22 ILE A 99 -11.977 -39.683 -7.209 1.00 43.23 H new ATOM 0 HG23 ILE A 99 -12.213 -38.142 -8.067 1.00 43.23 H new ATOM 0 HD11 ILE A 99 -14.636 -35.369 -7.511 1.00 13.43 H new ATOM 0 HD12 ILE A 99 -13.191 -36.267 -8.031 1.00 13.43 H new ATOM 0 HD13 ILE A 99 -14.803 -36.782 -8.580 1.00 13.43 H new ATOM 1529 N LEU A 100 -13.697 -41.238 -9.168 1.00 43.14 N ATOM 1530 CA LEU A 100 -13.068 -42.543 -9.379 1.00 54.31 C ATOM 1531 C LEU A 100 -11.567 -42.429 -9.120 1.00 72.51 C ATOM 1532 O LEU A 100 -11.016 -41.330 -9.162 1.00 11.02 O ATOM 1533 CB LEU A 100 -13.276 -43.024 -10.827 1.00 62.44 C ATOM 1534 CG LEU A 100 -14.690 -42.855 -11.404 1.00 2.41 C ATOM 1535 CD1 LEU A 100 -14.731 -43.307 -12.862 1.00 3.04 C ATOM 1536 CD2 LEU A 100 -15.715 -43.618 -10.573 1.00 53.13 C ATOM 0 H LEU A 100 -13.766 -40.664 -10.008 1.00 43.14 H new ATOM 0 HA LEU A 100 -13.525 -43.257 -8.694 1.00 54.31 H new ATOM 0 HB2 LEU A 100 -12.578 -42.487 -11.469 1.00 62.44 H new ATOM 0 HB3 LEU A 100 -13.009 -44.080 -10.878 1.00 62.44 H new ATOM 0 HG LEU A 100 -14.948 -41.797 -11.364 1.00 2.41 H new ATOM 0 HD11 LEU A 100 -15.740 -43.180 -13.254 1.00 3.04 H new ATOM 0 HD12 LEU A 100 -14.036 -42.707 -13.449 1.00 3.04 H new ATOM 0 HD13 LEU A 100 -14.447 -44.357 -12.925 1.00 3.04 H new ATOM 0 HD21 LEU A 100 -16.707 -43.481 -11.004 1.00 53.13 H new ATOM 0 HD22 LEU A 100 -15.464 -44.679 -10.570 1.00 53.13 H new ATOM 0 HD23 LEU A 100 -15.708 -43.241 -9.550 1.00 53.13 H new ATOM 1548 N MET A 101 -10.912 -43.548 -8.837 1.00 11.43 N ATOM 1549 CA MET A 101 -9.456 -43.580 -8.759 1.00 4.10 C ATOM 1550 C MET A 101 -8.910 -44.630 -9.728 1.00 43.12 C ATOM 1551 O MET A 101 -9.512 -45.691 -9.907 1.00 65.12 O ATOM 1552 CB MET A 101 -8.977 -43.877 -7.324 1.00 31.24 C ATOM 1553 CG MET A 101 -9.544 -42.931 -6.272 1.00 63.31 C ATOM 1554 SD MET A 101 -8.686 -43.031 -4.692 1.00 12.02 S ATOM 1555 CE MET A 101 -9.322 -41.557 -3.896 1.00 54.53 C ATOM 0 H MET A 101 -11.365 -44.444 -8.658 1.00 11.43 H new ATOM 0 HA MET A 101 -9.077 -42.597 -9.039 1.00 4.10 H new ATOM 0 HB2 MET A 101 -9.252 -44.899 -7.064 1.00 31.24 H new ATOM 0 HB3 MET A 101 -7.889 -43.823 -7.297 1.00 31.24 H new ATOM 0 HG2 MET A 101 -9.488 -41.908 -6.644 1.00 63.31 H new ATOM 0 HG3 MET A 101 -10.599 -43.157 -6.120 1.00 63.31 H new ATOM 0 HE1 MET A 101 -8.524 -41.076 -3.330 1.00 54.53 H new ATOM 0 HE2 MET A 101 -9.697 -40.868 -4.653 1.00 54.53 H new ATOM 0 HE3 MET A 101 -10.133 -41.829 -3.220 1.00 54.53 H new ATOM 1565 N PHE A 102 -7.788 -44.314 -10.365 1.00 13.11 N ATOM 1566 CA PHE A 102 -7.076 -45.247 -11.241 1.00 71.35 C ATOM 1567 C PHE A 102 -5.575 -45.077 -11.035 1.00 34.00 C ATOM 1568 O PHE A 102 -5.126 -44.009 -10.613 1.00 61.02 O ATOM 1569 CB PHE A 102 -7.435 -45.010 -12.718 1.00 21.10 C ATOM 1570 CG PHE A 102 -8.873 -45.323 -13.054 1.00 2.32 C ATOM 1571 CD1 PHE A 102 -9.815 -44.309 -13.156 1.00 2.42 C ATOM 1572 CD2 PHE A 102 -9.281 -46.632 -13.265 1.00 24.22 C ATOM 1573 CE1 PHE A 102 -11.133 -44.596 -13.466 1.00 61.40 C ATOM 1574 CE2 PHE A 102 -10.597 -46.923 -13.573 1.00 73.14 C ATOM 1575 CZ PHE A 102 -11.523 -45.904 -13.674 1.00 3.41 C ATOM 0 H PHE A 102 -7.342 -43.400 -10.290 1.00 13.11 H new ATOM 0 HA PHE A 102 -7.374 -46.264 -10.985 1.00 71.35 H new ATOM 0 HB2 PHE A 102 -7.231 -43.969 -12.969 1.00 21.10 H new ATOM 0 HB3 PHE A 102 -6.784 -45.622 -13.343 1.00 21.10 H new ATOM 0 HD1 PHE A 102 -9.516 -43.284 -12.992 1.00 2.42 H new ATOM 0 HD2 PHE A 102 -8.562 -47.434 -13.188 1.00 24.22 H new ATOM 0 HE1 PHE A 102 -11.856 -43.797 -13.545 1.00 61.40 H new ATOM 0 HE2 PHE A 102 -10.900 -47.947 -13.734 1.00 73.14 H new ATOM 0 HZ PHE A 102 -12.551 -46.130 -13.915 1.00 3.41 H new ATOM 1585 N LYS A 103 -4.798 -46.120 -11.307 1.00 14.01 N ATOM 1586 CA LYS A 103 -3.350 -46.053 -11.112 1.00 2.12 C ATOM 1587 C LYS A 103 -2.634 -46.971 -12.098 1.00 22.12 C ATOM 1588 O LYS A 103 -2.741 -48.189 -11.996 1.00 72.21 O ATOM 1589 CB LYS A 103 -3.004 -46.450 -9.667 1.00 74.24 C ATOM 1590 CG LYS A 103 -1.520 -46.353 -9.313 1.00 43.03 C ATOM 1591 CD LYS A 103 -1.244 -46.880 -7.902 1.00 41.12 C ATOM 1592 CE LYS A 103 -1.821 -45.975 -6.810 1.00 53.33 C ATOM 1593 NZ LYS A 103 -0.970 -44.777 -6.563 1.00 71.52 N1+ ATOM 0 H LYS A 103 -5.140 -47.014 -11.660 1.00 14.01 H new ATOM 0 HA LYS A 103 -3.016 -45.031 -11.292 1.00 2.12 H new ATOM 0 HB2 LYS A 103 -3.568 -45.813 -8.985 1.00 74.24 H new ATOM 0 HB3 LYS A 103 -3.338 -47.474 -9.497 1.00 74.24 H new ATOM 0 HG2 LYS A 103 -0.935 -46.921 -10.036 1.00 43.03 H new ATOM 0 HG3 LYS A 103 -1.195 -45.315 -9.385 1.00 43.03 H new ATOM 0 HD2 LYS A 103 -1.669 -47.879 -7.802 1.00 41.12 H new ATOM 0 HD3 LYS A 103 -0.168 -46.975 -7.758 1.00 41.12 H new ATOM 0 HE2 LYS A 103 -2.822 -45.654 -7.098 1.00 53.33 H new ATOM 0 HE3 LYS A 103 -1.922 -46.543 -5.885 1.00 53.33 H new ATOM 0 HZ1 LYS A 103 -0.622 -44.795 -5.583 1.00 71.52 H new ATOM 0 HZ2 LYS A 103 -0.162 -44.784 -7.218 1.00 71.52 H new ATOM 0 HZ3 LYS A 103 -1.531 -43.915 -6.716 1.00 71.52 H new ATOM 1607 N ASN A 104 -1.923 -46.377 -13.062 1.00 41.43 N ATOM 1608 CA ASN A 104 -1.137 -47.140 -14.044 1.00 72.22 C ATOM 1609 C ASN A 104 -2.062 -48.000 -14.913 1.00 0.14 C ATOM 1610 O ASN A 104 -1.651 -49.006 -15.494 1.00 72.20 O ATOM 1611 CB ASN A 104 -0.093 -48.010 -13.314 1.00 20.21 C ATOM 1612 CG ASN A 104 0.891 -48.700 -14.249 1.00 24.30 C ATOM 1613 OD1 ASN A 104 1.251 -48.175 -15.306 1.00 10.43 O ATOM 1614 ND2 ASN A 104 1.329 -49.888 -13.865 1.00 31.24 N ATOM 0 H ASN A 104 -1.874 -45.366 -13.185 1.00 41.43 H new ATOM 0 HA ASN A 104 -0.610 -46.447 -14.700 1.00 72.22 H new ATOM 0 HB2 ASN A 104 0.462 -47.385 -12.614 1.00 20.21 H new ATOM 0 HB3 ASN A 104 -0.612 -48.766 -12.725 1.00 20.21 H new ATOM 0 HD21 ASN A 104 1.987 -50.402 -14.450 1.00 31.24 H new ATOM 0 HD22 ASN A 104 1.008 -50.289 -12.984 1.00 31.24 H new ATOM 1621 N GLY A 105 -3.315 -47.565 -15.031 1.00 32.31 N ATOM 1622 CA GLY A 105 -4.318 -48.339 -15.748 1.00 42.31 C ATOM 1623 C GLY A 105 -4.980 -49.376 -14.855 1.00 34.43 C ATOM 1624 O GLY A 105 -6.044 -49.906 -15.182 1.00 43.11 O ATOM 0 H GLY A 105 -3.655 -46.686 -14.641 1.00 32.31 H new ATOM 0 HA2 GLY A 105 -5.077 -47.667 -16.148 1.00 42.31 H new ATOM 0 HA3 GLY A 105 -3.852 -48.837 -16.599 1.00 42.31 H new ATOM 1628 N LYS A 106 -4.345 -49.656 -13.721 1.00 12.22 N ATOM 1629 CA LYS A 106 -4.855 -50.613 -12.745 1.00 63.04 C ATOM 1630 C LYS A 106 -6.021 -50.002 -11.971 1.00 35.11 C ATOM 1631 O LYS A 106 -6.035 -48.789 -11.710 1.00 44.30 O ATOM 1632 CB LYS A 106 -3.724 -51.020 -11.785 1.00 13.01 C ATOM 1633 CG LYS A 106 -4.164 -51.886 -10.605 1.00 24.15 C ATOM 1634 CD LYS A 106 -3.012 -52.133 -9.633 1.00 53.23 C ATOM 1635 CE LYS A 106 -2.394 -50.822 -9.148 1.00 13.04 C ATOM 1636 NZ LYS A 106 -1.311 -51.051 -8.157 1.00 41.10 N1+ ATOM 0 H LYS A 106 -3.461 -49.225 -13.453 1.00 12.22 H new ATOM 0 HA LYS A 106 -5.216 -51.501 -13.263 1.00 63.04 H new ATOM 0 HB2 LYS A 106 -2.964 -51.560 -12.350 1.00 13.01 H new ATOM 0 HB3 LYS A 106 -3.252 -50.117 -11.398 1.00 13.01 H new ATOM 0 HG2 LYS A 106 -4.986 -51.398 -10.081 1.00 24.15 H new ATOM 0 HG3 LYS A 106 -4.542 -52.840 -10.973 1.00 24.15 H new ATOM 0 HD2 LYS A 106 -3.373 -52.704 -8.778 1.00 53.23 H new ATOM 0 HD3 LYS A 106 -2.247 -52.738 -10.120 1.00 53.23 H new ATOM 0 HE2 LYS A 106 -1.995 -50.272 -10.000 1.00 13.04 H new ATOM 0 HE3 LYS A 106 -3.169 -50.199 -8.701 1.00 13.04 H new ATOM 0 HZ1 LYS A 106 -0.919 -50.137 -7.854 1.00 41.10 H new ATOM 0 HZ2 LYS A 106 -1.696 -51.553 -7.332 1.00 41.10 H new ATOM 0 HZ3 LYS A 106 -0.559 -51.624 -8.591 1.00 41.10 H new ATOM 1650 N LYS A 107 -6.997 -50.842 -11.620 1.00 44.23 N ATOM 1651 CA LYS A 107 -8.179 -50.394 -10.890 1.00 71.41 C ATOM 1652 C LYS A 107 -7.798 -49.875 -9.504 1.00 52.45 C ATOM 1653 O LYS A 107 -6.852 -50.358 -8.876 1.00 11.33 O ATOM 1654 CB LYS A 107 -9.220 -51.522 -10.782 1.00 63.10 C ATOM 1655 CG LYS A 107 -10.551 -51.084 -10.161 1.00 42.24 C ATOM 1656 CD LYS A 107 -11.180 -49.915 -10.923 1.00 71.43 C ATOM 1657 CE LYS A 107 -12.508 -49.479 -10.308 1.00 14.53 C ATOM 1658 NZ LYS A 107 -13.587 -50.478 -10.531 1.00 70.01 N1+ ATOM 0 H LYS A 107 -6.989 -51.840 -11.832 1.00 44.23 H new ATOM 0 HA LYS A 107 -8.627 -49.573 -11.449 1.00 71.41 H new ATOM 0 HB2 LYS A 107 -9.410 -51.924 -11.777 1.00 63.10 H new ATOM 0 HB3 LYS A 107 -8.802 -52.333 -10.185 1.00 63.10 H new ATOM 0 HG2 LYS A 107 -11.243 -51.926 -10.154 1.00 42.24 H new ATOM 0 HG3 LYS A 107 -10.389 -50.795 -9.122 1.00 42.24 H new ATOM 0 HD2 LYS A 107 -10.489 -49.072 -10.928 1.00 71.43 H new ATOM 0 HD3 LYS A 107 -11.339 -50.203 -11.962 1.00 71.43 H new ATOM 0 HE2 LYS A 107 -12.376 -49.322 -9.237 1.00 14.53 H new ATOM 0 HE3 LYS A 107 -12.807 -48.522 -10.736 1.00 14.53 H new ATOM 0 HZ1 LYS A 107 -14.481 -50.117 -10.141 1.00 70.01 H new ATOM 0 HZ2 LYS A 107 -13.698 -50.647 -11.551 1.00 70.01 H new ATOM 0 HZ3 LYS A 107 -13.338 -51.370 -10.057 1.00 70.01 H new ATOM 1672 N LEU A 108 -8.568 -48.905 -9.045 1.00 60.01 N ATOM 1673 CA LEU A 108 -8.283 -48.128 -7.852 1.00 60.42 C ATOM 1674 C LEU A 108 -9.616 -47.646 -7.276 1.00 41.03 C ATOM 1675 O LEU A 108 -10.656 -47.784 -7.928 1.00 12.22 O ATOM 1676 CB LEU A 108 -7.320 -46.964 -8.155 1.00 52.31 C ATOM 1677 CG LEU A 108 -6.027 -46.917 -7.311 1.00 61.41 C ATOM 1678 CD1 LEU A 108 -6.338 -46.702 -5.832 1.00 21.14 C ATOM 1679 CD2 LEU A 108 -5.204 -48.190 -7.502 1.00 11.12 C ATOM 0 H LEU A 108 -9.435 -48.628 -9.506 1.00 60.01 H new ATOM 0 HA LEU A 108 -7.773 -48.745 -7.112 1.00 60.42 H new ATOM 0 HB2 LEU A 108 -7.041 -47.014 -9.208 1.00 52.31 H new ATOM 0 HB3 LEU A 108 -7.858 -46.027 -8.012 1.00 52.31 H new ATOM 0 HG LEU A 108 -5.438 -46.069 -7.660 1.00 61.41 H new ATOM 0 HD11 LEU A 108 -5.408 -46.674 -5.265 1.00 21.14 H new ATOM 0 HD12 LEU A 108 -6.869 -45.759 -5.705 1.00 21.14 H new ATOM 0 HD13 LEU A 108 -6.960 -47.520 -5.468 1.00 21.14 H new ATOM 0 HD21 LEU A 108 -4.299 -48.132 -6.897 1.00 11.12 H new ATOM 0 HD22 LEU A 108 -5.793 -49.054 -7.193 1.00 11.12 H new ATOM 0 HD23 LEU A 108 -4.932 -48.294 -8.553 1.00 11.12 H new ATOM 1691 N SER A 109 -9.595 -47.125 -6.060 1.00 60.43 N ATOM 1692 CA SER A 109 -10.798 -46.938 -5.252 1.00 11.20 C ATOM 1693 C SER A 109 -11.720 -45.838 -5.795 1.00 20.34 C ATOM 1694 O SER A 109 -11.481 -45.264 -6.858 1.00 72.41 O ATOM 1695 CB SER A 109 -10.351 -46.564 -3.834 1.00 32.42 C ATOM 1696 OG SER A 109 -9.980 -47.715 -3.091 1.00 42.25 O ATOM 0 H SER A 109 -8.739 -46.817 -5.599 1.00 60.43 H new ATOM 0 HA SER A 109 -11.370 -47.865 -5.272 1.00 11.20 H new ATOM 0 HB2 SER A 109 -9.508 -45.874 -3.886 1.00 32.42 H new ATOM 0 HB3 SER A 109 -11.159 -46.042 -3.321 1.00 32.42 H new ATOM 0 HG SER A 109 -9.698 -47.447 -2.192 1.00 42.25 H new ATOM 1702 N GLN A 110 -12.813 -45.592 -5.078 1.00 61.23 N ATOM 1703 CA GLN A 110 -13.845 -44.670 -5.531 1.00 74.54 C ATOM 1704 C GLN A 110 -14.517 -44.006 -4.359 1.00 60.21 C ATOM 1705 O GLN A 110 -14.680 -44.592 -3.287 1.00 10.33 O ATOM 1706 CB GLN A 110 -14.867 -45.420 -6.401 1.00 11.44 C ATOM 1707 CG GLN A 110 -15.859 -44.524 -7.130 1.00 71.21 C ATOM 1708 CD GLN A 110 -16.851 -45.314 -7.972 1.00 13.41 C ATOM 1709 OE1 GLN A 110 -16.559 -46.422 -8.423 1.00 25.31 O ATOM 1710 NE2 GLN A 110 -18.013 -44.732 -8.220 1.00 4.42 N ATOM 0 H GLN A 110 -13.006 -46.023 -4.174 1.00 61.23 H new ATOM 0 HA GLN A 110 -13.382 -43.888 -6.133 1.00 74.54 H new ATOM 0 HB2 GLN A 110 -14.329 -46.018 -7.137 1.00 11.44 H new ATOM 0 HB3 GLN A 110 -15.421 -46.115 -5.770 1.00 11.44 H new ATOM 0 HG2 GLN A 110 -16.404 -43.923 -6.402 1.00 71.21 H new ATOM 0 HG3 GLN A 110 -15.314 -43.831 -7.771 1.00 71.21 H new ATOM 0 HE21 GLN A 110 -18.217 -43.813 -7.828 1.00 4.42 H new ATOM 0 HE22 GLN A 110 -18.705 -45.202 -8.804 1.00 4.42 H new ATOM 1719 N VAL A 111 -14.895 -42.767 -4.592 1.00 70.11 N ATOM 1720 CA VAL A 111 -15.433 -41.904 -3.576 1.00 60.35 C ATOM 1721 C VAL A 111 -16.743 -41.290 -4.068 1.00 22.32 C ATOM 1722 O VAL A 111 -16.768 -40.602 -5.088 1.00 33.31 O ATOM 1723 CB VAL A 111 -14.417 -40.788 -3.252 1.00 32.14 C ATOM 1724 CG1 VAL A 111 -14.963 -39.885 -2.176 1.00 22.02 C ATOM 1725 CG2 VAL A 111 -13.068 -41.375 -2.834 1.00 44.03 C ATOM 0 H VAL A 111 -14.834 -42.329 -5.511 1.00 70.11 H new ATOM 0 HA VAL A 111 -15.626 -42.483 -2.673 1.00 60.35 H new ATOM 0 HB VAL A 111 -14.256 -40.199 -4.155 1.00 32.14 H new ATOM 0 HG11 VAL A 111 -14.238 -39.102 -1.956 1.00 22.02 H new ATOM 0 HG12 VAL A 111 -15.893 -39.432 -2.519 1.00 22.02 H new ATOM 0 HG13 VAL A 111 -15.153 -40.467 -1.274 1.00 22.02 H new ATOM 0 HG21 VAL A 111 -12.372 -40.566 -2.612 1.00 44.03 H new ATOM 0 HG22 VAL A 111 -13.200 -41.994 -1.947 1.00 44.03 H new ATOM 0 HG23 VAL A 111 -12.669 -41.984 -3.645 1.00 44.03 H new ATOM 1735 N ILE A 112 -17.831 -41.563 -3.361 1.00 51.33 N ATOM 1736 CA ILE A 112 -19.147 -41.050 -3.740 1.00 62.14 C ATOM 1737 C ILE A 112 -19.644 -40.054 -2.695 1.00 15.21 C ATOM 1738 O ILE A 112 -19.729 -40.379 -1.507 1.00 22.02 O ATOM 1739 CB ILE A 112 -20.182 -42.197 -3.904 1.00 32.24 C ATOM 1740 CG1 ILE A 112 -19.696 -43.209 -4.960 1.00 3.11 C ATOM 1741 CG2 ILE A 112 -21.557 -41.636 -4.282 1.00 52.53 C ATOM 1742 CD1 ILE A 112 -20.655 -44.359 -5.200 1.00 61.34 C ATOM 0 H ILE A 112 -17.831 -42.138 -2.519 1.00 51.33 H new ATOM 0 HA ILE A 112 -19.042 -40.549 -4.702 1.00 62.14 H new ATOM 0 HB ILE A 112 -20.279 -42.714 -2.949 1.00 32.24 H new ATOM 0 HG12 ILE A 112 -19.531 -42.685 -5.901 1.00 3.11 H new ATOM 0 HG13 ILE A 112 -18.733 -43.612 -4.646 1.00 3.11 H new ATOM 0 HG21 ILE A 112 -22.267 -42.456 -4.392 1.00 52.53 H new ATOM 0 HG22 ILE A 112 -21.902 -40.960 -3.500 1.00 52.53 H new ATOM 0 HG23 ILE A 112 -21.482 -41.092 -5.224 1.00 52.53 H new ATOM 0 HD11 ILE A 112 -20.241 -45.026 -5.956 1.00 61.34 H new ATOM 0 HD12 ILE A 112 -20.802 -44.910 -4.271 1.00 61.34 H new ATOM 0 HD13 ILE A 112 -21.612 -43.969 -5.546 1.00 61.34 H new ATOM 1754 N GLY A 113 -19.963 -38.844 -3.142 1.00 41.41 N ATOM 1755 CA GLY A 113 -20.410 -37.803 -2.237 1.00 14.45 C ATOM 1756 C GLY A 113 -19.307 -36.805 -1.946 1.00 3.03 C ATOM 1757 O GLY A 113 -18.122 -37.144 -2.003 1.00 60.32 O ATOM 0 H GLY A 113 -19.919 -38.565 -4.122 1.00 41.41 H new ATOM 0 HA2 GLY A 113 -21.265 -37.285 -2.671 1.00 14.45 H new ATOM 0 HA3 GLY A 113 -20.750 -38.253 -1.304 1.00 14.45 H new ATOM 1761 N ALA A 114 -19.691 -35.573 -1.636 1.00 12.52 N ATOM 1762 CA ALA A 114 -18.733 -34.510 -1.366 1.00 24.52 C ATOM 1763 C ALA A 114 -18.140 -34.644 0.036 1.00 0.33 C ATOM 1764 O ALA A 114 -18.477 -33.876 0.942 1.00 33.13 O ATOM 1765 CB ALA A 114 -19.393 -33.147 -1.548 1.00 15.11 C ATOM 0 H ALA A 114 -20.667 -35.285 -1.565 1.00 12.52 H new ATOM 0 HA ALA A 114 -17.914 -34.599 -2.080 1.00 24.52 H new ATOM 0 HB1 ALA A 114 -18.666 -32.361 -1.343 1.00 15.11 H new ATOM 0 HB2 ALA A 114 -19.753 -33.051 -2.572 1.00 15.11 H new ATOM 0 HB3 ALA A 114 -20.232 -33.054 -0.859 1.00 15.11 H new ATOM 1771 N ASP A 115 -17.277 -35.637 0.217 1.00 64.24 N ATOM 1772 CA ASP A 115 -16.608 -35.852 1.500 1.00 1.22 C ATOM 1773 C ASP A 115 -15.105 -35.642 1.333 1.00 22.24 C ATOM 1774 O ASP A 115 -14.353 -36.581 1.036 1.00 33.32 O ATOM 1775 CB ASP A 115 -16.902 -37.259 2.043 1.00 64.14 C ATOM 1776 CG ASP A 115 -16.612 -37.378 3.534 1.00 52.23 C ATOM 1777 OD1 ASP A 115 -15.426 -37.417 3.920 1.00 51.14 O ATOM 1778 OD2 ASP A 115 -17.579 -37.430 4.331 1.00 30.13 O1- ATOM 0 H ASP A 115 -17.022 -36.308 -0.508 1.00 64.24 H new ATOM 0 HA ASP A 115 -16.991 -35.132 2.223 1.00 1.22 H new ATOM 0 HB2 ASP A 115 -17.947 -37.506 1.858 1.00 64.14 H new ATOM 0 HB3 ASP A 115 -16.301 -37.988 1.499 1.00 64.14 H new ATOM 1783 N ILE A 116 -14.680 -34.393 1.496 1.00 10.14 N ATOM 1784 CA ILE A 116 -13.293 -34.008 1.257 1.00 23.23 C ATOM 1785 C ILE A 116 -12.335 -34.796 2.154 1.00 50.32 C ATOM 1786 O ILE A 116 -11.216 -35.114 1.752 1.00 24.53 O ATOM 1787 CB ILE A 116 -13.089 -32.484 1.464 1.00 35.22 C ATOM 1788 CG1 ILE A 116 -11.668 -32.060 1.053 1.00 23.43 C ATOM 1789 CG2 ILE A 116 -13.377 -32.085 2.913 1.00 34.43 C ATOM 1790 CD1 ILE A 116 -11.359 -32.293 -0.414 1.00 62.15 C ATOM 0 H ILE A 116 -15.281 -33.625 1.795 1.00 10.14 H new ATOM 0 HA ILE A 116 -13.066 -34.248 0.218 1.00 23.23 H new ATOM 0 HB ILE A 116 -13.798 -31.960 0.823 1.00 35.22 H new ATOM 0 HG12 ILE A 116 -11.535 -31.002 1.279 1.00 23.43 H new ATOM 0 HG13 ILE A 116 -10.946 -32.608 1.658 1.00 23.43 H new ATOM 0 HG21 ILE A 116 -13.227 -31.012 3.032 1.00 34.43 H new ATOM 0 HG22 ILE A 116 -14.408 -32.337 3.162 1.00 34.43 H new ATOM 0 HG23 ILE A 116 -12.702 -32.622 3.579 1.00 34.43 H new ATOM 0 HD11 ILE A 116 -10.340 -31.970 -0.627 1.00 62.15 H new ATOM 0 HD12 ILE A 116 -11.458 -33.354 -0.643 1.00 62.15 H new ATOM 0 HD13 ILE A 116 -12.056 -31.723 -1.028 1.00 62.15 H new ATOM 1802 N SER A 117 -12.792 -35.122 3.362 1.00 64.32 N ATOM 1803 CA SER A 117 -12.010 -35.890 4.307 1.00 24.52 C ATOM 1804 C SER A 117 -11.680 -37.273 3.733 1.00 72.20 C ATOM 1805 O SER A 117 -10.522 -37.699 3.727 1.00 63.13 O ATOM 1806 CB SER A 117 -12.807 -36.012 5.604 1.00 2.24 C ATOM 1807 OG SER A 117 -13.283 -34.743 6.031 1.00 54.32 O ATOM 0 H SER A 117 -13.715 -34.857 3.705 1.00 64.32 H new ATOM 0 HA SER A 117 -11.064 -35.386 4.506 1.00 24.52 H new ATOM 0 HB2 SER A 117 -13.648 -36.689 5.456 1.00 2.24 H new ATOM 0 HB3 SER A 117 -12.180 -36.449 6.381 1.00 2.24 H new ATOM 0 HG SER A 117 -13.792 -34.847 6.862 1.00 54.32 H new ATOM 1813 N LYS A 118 -12.706 -37.956 3.226 1.00 24.02 N ATOM 1814 CA LYS A 118 -12.535 -39.257 2.588 1.00 23.25 C ATOM 1815 C LYS A 118 -11.607 -39.132 1.385 1.00 51.14 C ATOM 1816 O LYS A 118 -10.704 -39.953 1.194 1.00 44.54 O ATOM 1817 CB LYS A 118 -13.902 -39.815 2.157 1.00 55.14 C ATOM 1818 CG LYS A 118 -13.843 -41.126 1.369 1.00 21.34 C ATOM 1819 CD LYS A 118 -13.277 -42.283 2.193 1.00 32.24 C ATOM 1820 CE LYS A 118 -13.376 -43.605 1.436 1.00 45.55 C ATOM 1821 NZ LYS A 118 -12.813 -44.746 2.206 1.00 20.35 N1+ ATOM 0 H LYS A 118 -13.671 -37.625 3.246 1.00 24.02 H new ATOM 0 HA LYS A 118 -12.086 -39.947 3.302 1.00 23.25 H new ATOM 0 HB2 LYS A 118 -14.512 -39.970 3.047 1.00 55.14 H new ATOM 0 HB3 LYS A 118 -14.409 -39.065 1.550 1.00 55.14 H new ATOM 0 HG2 LYS A 118 -14.845 -41.385 1.026 1.00 21.34 H new ATOM 0 HG3 LYS A 118 -13.229 -40.984 0.480 1.00 21.34 H new ATOM 0 HD2 LYS A 118 -12.235 -42.080 2.440 1.00 32.24 H new ATOM 0 HD3 LYS A 118 -13.819 -42.360 3.136 1.00 32.24 H new ATOM 0 HE2 LYS A 118 -14.421 -43.809 1.203 1.00 45.55 H new ATOM 0 HE3 LYS A 118 -12.849 -43.516 0.486 1.00 45.55 H new ATOM 0 HZ1 LYS A 118 -11.949 -45.088 1.738 1.00 20.35 H new ATOM 0 HZ2 LYS A 118 -12.584 -44.434 3.171 1.00 20.35 H new ATOM 0 HZ3 LYS A 118 -13.512 -45.515 2.248 1.00 20.35 H new ATOM 1835 N ILE A 119 -11.825 -38.087 0.586 1.00 22.14 N ATOM 1836 CA ILE A 119 -11.015 -37.860 -0.608 1.00 2.21 C ATOM 1837 C ILE A 119 -9.526 -37.730 -0.256 1.00 62.22 C ATOM 1838 O ILE A 119 -8.697 -38.500 -0.748 1.00 24.10 O ATOM 1839 CB ILE A 119 -11.475 -36.591 -1.376 1.00 43.35 C ATOM 1840 CG1 ILE A 119 -12.948 -36.722 -1.801 1.00 44.33 C ATOM 1841 CG2 ILE A 119 -10.582 -36.344 -2.595 1.00 11.44 C ATOM 1842 CD1 ILE A 119 -13.490 -35.507 -2.526 1.00 40.14 C ATOM 0 H ILE A 119 -12.552 -37.389 0.744 1.00 22.14 H new ATOM 0 HA ILE A 119 -11.153 -38.729 -1.251 1.00 2.21 H new ATOM 0 HB ILE A 119 -11.385 -35.734 -0.708 1.00 43.35 H new ATOM 0 HG12 ILE A 119 -13.053 -37.594 -2.446 1.00 44.33 H new ATOM 0 HG13 ILE A 119 -13.556 -36.905 -0.915 1.00 44.33 H new ATOM 0 HG21 ILE A 119 -10.921 -35.451 -3.119 1.00 11.44 H new ATOM 0 HG22 ILE A 119 -9.551 -36.204 -2.269 1.00 11.44 H new ATOM 0 HG23 ILE A 119 -10.637 -37.201 -3.266 1.00 11.44 H new ATOM 0 HD11 ILE A 119 -14.533 -35.677 -2.792 1.00 40.14 H new ATOM 0 HD12 ILE A 119 -13.419 -34.634 -1.877 1.00 40.14 H new ATOM 0 HD13 ILE A 119 -12.908 -35.334 -3.431 1.00 40.14 H new ATOM 1854 N ILE A 120 -9.200 -36.786 0.627 1.00 71.14 N ATOM 1855 CA ILE A 120 -7.806 -36.511 0.989 1.00 1.52 C ATOM 1856 C ILE A 120 -7.176 -37.730 1.671 1.00 44.53 C ATOM 1857 O ILE A 120 -6.005 -38.064 1.429 1.00 2.32 O ATOM 1858 CB ILE A 120 -7.703 -35.249 1.904 1.00 41.41 C ATOM 1859 CG1 ILE A 120 -6.237 -34.792 2.099 1.00 72.14 C ATOM 1860 CG2 ILE A 120 -8.361 -35.507 3.256 1.00 5.22 C ATOM 1861 CD1 ILE A 120 -5.552 -35.371 3.322 1.00 43.13 C ATOM 0 H ILE A 120 -9.882 -36.197 1.106 1.00 71.14 H new ATOM 0 HA ILE A 120 -7.252 -36.306 0.073 1.00 1.52 H new ATOM 0 HB ILE A 120 -8.235 -34.443 1.399 1.00 41.41 H new ATOM 0 HG12 ILE A 120 -5.664 -35.067 1.214 1.00 72.14 H new ATOM 0 HG13 ILE A 120 -6.215 -33.704 2.168 1.00 72.14 H new ATOM 0 HG21 ILE A 120 -8.278 -34.615 3.877 1.00 5.22 H new ATOM 0 HG22 ILE A 120 -9.413 -35.749 3.108 1.00 5.22 H new ATOM 0 HG23 ILE A 120 -7.863 -36.341 3.750 1.00 5.22 H new ATOM 0 HD11 ILE A 120 -4.530 -34.996 3.378 1.00 43.13 H new ATOM 0 HD12 ILE A 120 -6.097 -35.075 4.218 1.00 43.13 H new ATOM 0 HD13 ILE A 120 -5.536 -36.458 3.250 1.00 43.13 H new ATOM 1873 N SER A 121 -7.972 -38.408 2.495 1.00 33.33 N ATOM 1874 CA SER A 121 -7.522 -39.592 3.211 1.00 32.12 C ATOM 1875 C SER A 121 -7.061 -40.666 2.226 1.00 12.31 C ATOM 1876 O SER A 121 -5.942 -41.177 2.329 1.00 23.30 O ATOM 1877 CB SER A 121 -8.651 -40.126 4.106 1.00 43.12 C ATOM 1878 OG SER A 121 -8.233 -41.256 4.853 1.00 42.33 O ATOM 0 H SER A 121 -8.941 -38.151 2.682 1.00 33.33 H new ATOM 0 HA SER A 121 -6.676 -39.322 3.843 1.00 32.12 H new ATOM 0 HB2 SER A 121 -8.980 -39.340 4.786 1.00 43.12 H new ATOM 0 HB3 SER A 121 -9.509 -40.393 3.490 1.00 43.12 H new ATOM 0 HG SER A 121 -8.973 -41.570 5.413 1.00 42.33 H new ATOM 1884 N GLU A 122 -7.915 -40.989 1.255 1.00 14.44 N ATOM 1885 CA GLU A 122 -7.591 -42.024 0.274 1.00 72.13 C ATOM 1886 C GLU A 122 -6.449 -41.578 -0.642 1.00 73.04 C ATOM 1887 O GLU A 122 -5.617 -42.401 -1.046 1.00 20.21 O ATOM 1888 CB GLU A 122 -8.831 -42.409 -0.546 1.00 32.23 C ATOM 1889 CG GLU A 122 -9.929 -43.098 0.268 1.00 71.24 C ATOM 1890 CD GLU A 122 -9.575 -44.510 0.739 1.00 22.22 C ATOM 1891 OE1 GLU A 122 -8.386 -44.804 0.996 1.00 61.24 O ATOM 1892 OE2 GLU A 122 -10.499 -45.339 0.874 1.00 70.43 O1- ATOM 0 H GLU A 122 -8.828 -40.553 1.127 1.00 14.44 H new ATOM 0 HA GLU A 122 -7.257 -42.907 0.819 1.00 72.13 H new ATOM 0 HB2 GLU A 122 -9.243 -41.510 -1.005 1.00 32.23 H new ATOM 0 HB3 GLU A 122 -8.526 -43.070 -1.357 1.00 32.23 H new ATOM 0 HG2 GLU A 122 -10.158 -42.484 1.139 1.00 71.24 H new ATOM 0 HG3 GLU A 122 -10.836 -43.146 -0.335 1.00 71.24 H new ATOM 1899 N ILE A 123 -6.392 -40.283 -0.960 1.00 11.43 N ATOM 1900 CA ILE A 123 -5.296 -39.748 -1.763 1.00 32.41 C ATOM 1901 C ILE A 123 -3.961 -40.085 -1.095 1.00 5.24 C ATOM 1902 O ILE A 123 -3.115 -40.777 -1.672 1.00 71.51 O ATOM 1903 CB ILE A 123 -5.413 -38.207 -1.947 1.00 73.41 C ATOM 1904 CG1 ILE A 123 -6.596 -37.842 -2.864 1.00 51.34 C ATOM 1905 CG2 ILE A 123 -4.117 -37.626 -2.504 1.00 71.34 C ATOM 1906 CD1 ILE A 123 -6.898 -36.364 -2.898 1.00 15.35 C ATOM 0 H ILE A 123 -7.087 -39.592 -0.676 1.00 11.43 H new ATOM 0 HA ILE A 123 -5.349 -40.207 -2.750 1.00 32.41 H new ATOM 0 HB ILE A 123 -5.596 -37.772 -0.964 1.00 73.41 H new ATOM 0 HG12 ILE A 123 -6.380 -38.184 -3.876 1.00 51.34 H new ATOM 0 HG13 ILE A 123 -7.484 -38.379 -2.529 1.00 51.34 H new ATOM 0 HG21 ILE A 123 -4.224 -36.548 -2.624 1.00 71.34 H new ATOM 0 HG22 ILE A 123 -3.299 -37.835 -1.815 1.00 71.34 H new ATOM 0 HG23 ILE A 123 -3.902 -38.079 -3.472 1.00 71.34 H new ATOM 0 HD11 ILE A 123 -7.742 -36.180 -3.563 1.00 15.35 H new ATOM 0 HD12 ILE A 123 -7.146 -36.020 -1.894 1.00 15.35 H new ATOM 0 HD13 ILE A 123 -6.025 -35.822 -3.262 1.00 15.35 H new ATOM 1918 N ASN A 124 -3.813 -39.666 0.161 1.00 61.24 N ATOM 1919 CA ASN A 124 -2.574 -39.915 0.899 1.00 42.31 C ATOM 1920 C ASN A 124 -2.354 -41.408 1.083 1.00 20.40 C ATOM 1921 O ASN A 124 -1.224 -41.894 1.001 1.00 70.22 O ATOM 1922 CB ASN A 124 -2.581 -39.209 2.260 1.00 5.10 C ATOM 1923 CG ASN A 124 -2.338 -37.714 2.139 1.00 40.22 C ATOM 1924 OD1 ASN A 124 -3.405 -36.933 2.067 1.00 31.24 O flip ATOM 1925 ND2 ASN A 124 -1.192 -37.263 2.129 1.00 15.41 N flip ATOM 0 H ASN A 124 -4.526 -39.158 0.685 1.00 61.24 H new ATOM 0 HA ASN A 124 -1.752 -39.506 0.312 1.00 42.31 H new ATOM 0 HB2 ASN A 124 -3.540 -39.380 2.750 1.00 5.10 H new ATOM 0 HB3 ASN A 124 -1.814 -39.648 2.898 1.00 5.10 H new ATOM 0 HD21 ASN A 124 -0.394 -37.896 2.186 1.00 15.41 H new ATOM 0 HD22 ASN A 124 -1.041 -36.256 2.064 1.00 15.41 H new ATOM 1932 N ASN A 125 -3.449 -42.129 1.303 1.00 31.14 N ATOM 1933 CA ASN A 125 -3.405 -43.574 1.498 1.00 72.20 C ATOM 1934 C ASN A 125 -2.830 -44.278 0.268 1.00 71.23 C ATOM 1935 O ASN A 125 -2.105 -45.267 0.393 1.00 34.51 O ATOM 1936 CB ASN A 125 -4.814 -44.108 1.802 1.00 65.54 C ATOM 1937 CG ASN A 125 -4.842 -45.609 2.057 1.00 44.14 C ATOM 1938 OD1 ASN A 125 -3.872 -46.190 2.544 1.00 32.44 O ATOM 1939 ND2 ASN A 125 -5.958 -46.244 1.738 1.00 44.23 N ATOM 0 H ASN A 125 -4.387 -41.731 1.351 1.00 31.14 H new ATOM 0 HA ASN A 125 -2.752 -43.783 2.345 1.00 72.20 H new ATOM 0 HB2 ASN A 125 -5.212 -43.590 2.674 1.00 65.54 H new ATOM 0 HB3 ASN A 125 -5.473 -43.875 0.965 1.00 65.54 H new ATOM 0 HD21 ASN A 125 -6.035 -47.249 1.894 1.00 44.23 H new ATOM 0 HD22 ASN A 125 -6.741 -45.728 1.336 1.00 44.23 H new ATOM 1946 N ASN A 126 -3.143 -43.759 -0.921 1.00 24.21 N ATOM 1947 CA ASN A 126 -2.701 -44.385 -2.171 1.00 34.20 C ATOM 1948 C ASN A 126 -1.522 -43.643 -2.812 1.00 61.32 C ATOM 1949 O ASN A 126 -1.045 -44.042 -3.880 1.00 63.21 O ATOM 1950 CB ASN A 126 -3.869 -44.504 -3.161 1.00 71.20 C ATOM 1951 CG ASN A 126 -4.908 -45.520 -2.707 1.00 53.32 C ATOM 1952 OD1 ASN A 126 -4.784 -46.716 -2.981 1.00 60.30 O ATOM 1953 ND2 ASN A 126 -5.938 -45.059 -2.017 1.00 41.12 N ATOM 0 H ASN A 126 -3.697 -42.912 -1.046 1.00 24.21 H new ATOM 0 HA ASN A 126 -2.349 -45.385 -1.919 1.00 34.20 H new ATOM 0 HB2 ASN A 126 -4.344 -43.530 -3.279 1.00 71.20 H new ATOM 0 HB3 ASN A 126 -3.485 -44.792 -4.140 1.00 71.20 H new ATOM 0 HD21 ASN A 126 -6.663 -45.700 -1.693 1.00 41.12 H new ATOM 0 HD22 ASN A 126 -6.008 -44.063 -1.809 1.00 41.12 H new ATOM 1960 N ILE A 127 -1.075 -42.548 -2.192 1.00 24.11 N ATOM 1961 CA ILE A 127 0.201 -41.921 -2.571 1.00 45.52 C ATOM 1962 C ILE A 127 1.364 -42.601 -1.850 1.00 24.03 C ATOM 1963 O ILE A 127 2.257 -43.166 -2.483 1.00 24.55 O ATOM 1964 CB ILE A 127 0.258 -40.409 -2.236 1.00 23.43 C ATOM 1965 CG1 ILE A 127 -0.753 -39.616 -3.065 1.00 53.10 C ATOM 1966 CG2 ILE A 127 1.670 -39.856 -2.452 1.00 51.22 C ATOM 1967 CD1 ILE A 127 -0.803 -38.151 -2.694 1.00 54.51 C ATOM 0 H ILE A 127 -1.569 -42.079 -1.433 1.00 24.11 H new ATOM 0 HA ILE A 127 0.280 -42.040 -3.652 1.00 45.52 H new ATOM 0 HB ILE A 127 -0.004 -40.297 -1.184 1.00 23.43 H new ATOM 0 HG12 ILE A 127 -0.501 -39.709 -4.121 1.00 53.10 H new ATOM 0 HG13 ILE A 127 -1.743 -40.052 -2.934 1.00 53.10 H new ATOM 0 HG21 ILE A 127 1.685 -38.793 -2.211 1.00 51.22 H new ATOM 0 HG22 ILE A 127 2.371 -40.385 -1.806 1.00 51.22 H new ATOM 0 HG23 ILE A 127 1.960 -39.996 -3.493 1.00 51.22 H new ATOM 0 HD11 ILE A 127 -1.539 -37.643 -3.317 1.00 54.51 H new ATOM 0 HD12 ILE A 127 -1.084 -38.051 -1.646 1.00 54.51 H new ATOM 0 HD13 ILE A 127 0.178 -37.702 -2.851 1.00 54.51 H new ATOM 1979 N ASN A 128 1.328 -42.544 -0.517 1.00 64.33 N ATOM 1980 CA ASN A 128 2.432 -43.010 0.318 1.00 71.43 C ATOM 1981 C ASN A 128 2.589 -44.520 0.209 1.00 23.15 C ATOM 1982 O ASN A 128 3.514 -44.979 -0.494 1.00 65.33 O ATOM 1983 CB ASN A 128 2.210 -42.607 1.786 1.00 24.12 C ATOM 1984 CG ASN A 128 2.251 -41.105 1.997 1.00 23.51 C ATOM 1985 OD1 ASN A 128 3.309 -40.532 2.260 1.00 5.34 O ATOM 1986 ND2 ASN A 128 1.102 -40.456 1.889 1.00 22.35 N ATOM 1987 OXT ASN A 128 1.773 -45.250 0.811 1.00 0.00 O1- ATOM 0 H ASN A 128 0.536 -42.175 0.010 1.00 64.33 H new ATOM 0 HA ASN A 128 3.347 -42.538 -0.039 1.00 71.43 H new ATOM 0 HB2 ASN A 128 1.246 -42.990 2.121 1.00 24.12 H new ATOM 0 HB3 ASN A 128 2.973 -43.077 2.406 1.00 24.12 H new ATOM 0 HD21 ASN A 128 1.072 -39.446 2.025 1.00 22.35 H new ATOM 0 HD22 ASN A 128 0.247 -40.966 1.670 1.00 22.35 H new TER 1994 ASN A 128