USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1055 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 80 ASN : amide:sc= -4.88! C(o=-6.2!,f=-4.2!) USER MOD Set 1.2: A 96 MET CE :methyl -160:sc= -1.36 (180deg=-0.22) USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.0385 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -32:sc= 0.593 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc= -1.74! K(o=-1.7!,f=-0.84) USER MOD Single : A 19 GLN : amide:sc= -0.065 K(o=-0.065,f=-0.57) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -1.18 K(o=-1.2,f=-0.069) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.0933 K(o=-0.093,f=-0.68) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -77:sc= 0.0499 USER MOD Single : A 51 LYS NZ :NH3+ -155:sc= -0.0781 (180deg=-0.487) USER MOD Single : A 53 TYR OH : rot 30:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 160:sc= -4.54 (180deg=-5.45!) USER MOD Single : A 61 HIS : no HD1:sc= -0.453 K(o=-0.45,f=-1.3!) USER MOD Single : A 62 ASN : amide:sc= -5.53! C(o=-5.5!,f=-5.8!) USER MOD Single : A 63 TYR OH : rot 162:sc= -2.89! USER MOD Single : A 67 ASN : amide:sc= -0.419 K(o=-0.42,f=-4.4!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc=-0.00248 X(o=-0.0025,f=0) USER MOD Single : A 71 GLN : amide:sc= -0.775 X(o=-0.77,f=-0.77) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.216 K(o=0.22,f=-0.5) USER MOD Single : A 78 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.0011) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.0207 X(o=-0.021,f=-0.079) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 CYS SG : rot -18:sc= 0.18 USER MOD Single : A 116 GLN : amide:sc= -0.0617 K(o=-0.062,f=-0.95) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0.0017) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.393 25.746 -6.100 1.00 0.00 N ATOM 2 CA GLY A 1 14.337 25.039 -5.255 1.00 0.00 C ATOM 3 C GLY A 1 13.658 24.299 -4.120 1.00 0.00 C ATOM 4 O GLY A 1 12.479 23.955 -4.212 1.00 0.00 O ATOM 0 H1 GLY A 1 13.533 25.461 -7.090 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.423 25.514 -5.806 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.546 26.771 -6.010 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.902 24.330 -5.860 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.054 25.749 -4.844 1.00 0.00 H new ATOM 8 N SER A 2 14.402 24.051 -3.047 1.00 0.00 N ATOM 9 CA SER A 2 13.866 23.342 -1.891 1.00 0.00 C ATOM 10 C SER A 2 14.139 24.115 -0.605 1.00 0.00 C ATOM 11 O SER A 2 15.208 24.699 -0.433 1.00 0.00 O ATOM 12 CB SER A 2 14.476 21.942 -1.798 1.00 0.00 C ATOM 13 OG SER A 2 13.962 21.092 -2.808 1.00 0.00 O ATOM 0 H SER A 2 15.378 24.331 -2.954 1.00 0.00 H new ATOM 0 HA SER A 2 12.787 23.253 -2.018 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.560 22.008 -1.891 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.266 21.515 -0.817 1.00 0.00 H new ATOM 0 HG SER A 2 14.369 20.204 -2.727 1.00 0.00 H new ATOM 19 N SER A 3 13.162 24.113 0.297 1.00 0.00 N ATOM 20 CA SER A 3 13.294 24.817 1.568 1.00 0.00 C ATOM 21 C SER A 3 13.625 23.845 2.696 1.00 0.00 C ATOM 22 O SER A 3 13.607 22.629 2.508 1.00 0.00 O ATOM 23 CB SER A 3 12.004 25.572 1.892 1.00 0.00 C ATOM 24 OG SER A 3 11.086 24.742 2.582 1.00 0.00 O ATOM 0 H SER A 3 12.271 23.632 0.171 1.00 0.00 H new ATOM 0 HA SER A 3 14.112 25.531 1.477 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.234 26.448 2.499 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.549 25.934 0.970 1.00 0.00 H new ATOM 0 HG SER A 3 11.193 23.815 2.281 1.00 0.00 H new ATOM 30 N GLY A 4 13.928 24.391 3.870 1.00 0.00 N ATOM 31 CA GLY A 4 14.259 23.559 5.012 1.00 0.00 C ATOM 32 C GLY A 4 13.040 23.192 5.835 1.00 0.00 C ATOM 33 O GLY A 4 12.197 22.412 5.394 1.00 0.00 O ATOM 0 H GLY A 4 13.950 25.395 4.050 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.747 22.648 4.665 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.976 24.083 5.644 1.00 0.00 H new ATOM 37 N SER A 5 12.948 23.756 7.035 1.00 0.00 N ATOM 38 CA SER A 5 11.826 23.479 7.925 1.00 0.00 C ATOM 39 C SER A 5 11.757 21.994 8.268 1.00 0.00 C ATOM 40 O SER A 5 10.679 21.401 8.296 1.00 0.00 O ATOM 41 CB SER A 5 10.513 23.926 7.278 1.00 0.00 C ATOM 42 OG SER A 5 10.287 25.309 7.485 1.00 0.00 O ATOM 0 H SER A 5 13.636 24.407 7.413 1.00 0.00 H new ATOM 0 HA SER A 5 11.979 24.040 8.847 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.541 23.715 6.209 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.685 23.353 7.695 1.00 0.00 H new ATOM 0 HG SER A 5 9.443 25.570 7.061 1.00 0.00 H new ATOM 48 N SER A 6 12.917 21.400 8.528 1.00 0.00 N ATOM 49 CA SER A 6 12.991 19.983 8.866 1.00 0.00 C ATOM 50 C SER A 6 13.364 19.793 10.333 1.00 0.00 C ATOM 51 O SER A 6 14.528 19.572 10.666 1.00 0.00 O ATOM 52 CB SER A 6 14.013 19.277 7.972 1.00 0.00 C ATOM 53 OG SER A 6 13.524 19.137 6.650 1.00 0.00 O ATOM 0 H SER A 6 13.818 21.877 8.511 1.00 0.00 H new ATOM 0 HA SER A 6 12.008 19.543 8.700 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.944 19.844 7.961 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.243 18.294 8.384 1.00 0.00 H new ATOM 0 HG SER A 6 14.196 18.685 6.099 1.00 0.00 H new ATOM 59 N GLY A 7 12.366 19.881 11.207 1.00 0.00 N ATOM 60 CA GLY A 7 12.608 19.716 12.628 1.00 0.00 C ATOM 61 C GLY A 7 12.127 20.903 13.440 1.00 0.00 C ATOM 62 O GLY A 7 11.579 20.737 14.529 1.00 0.00 O ATOM 0 H GLY A 7 11.394 20.064 10.956 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.106 18.814 12.977 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.675 19.572 12.797 1.00 0.00 H new ATOM 66 N MET A 8 12.333 22.104 12.908 1.00 0.00 N ATOM 67 CA MET A 8 11.916 23.323 13.591 1.00 0.00 C ATOM 68 C MET A 8 10.400 23.488 13.531 1.00 0.00 C ATOM 69 O MET A 8 9.842 24.403 14.137 1.00 0.00 O ATOM 70 CB MET A 8 12.599 24.541 12.967 1.00 0.00 C ATOM 71 CG MET A 8 12.344 24.683 11.475 1.00 0.00 C ATOM 72 SD MET A 8 12.490 26.387 10.905 1.00 0.00 S ATOM 73 CE MET A 8 10.879 27.032 11.350 1.00 0.00 C ATOM 0 H MET A 8 12.786 22.259 12.007 1.00 0.00 H new ATOM 0 HA MET A 8 12.214 23.245 14.637 1.00 0.00 H new ATOM 0 HB2 MET A 8 12.252 25.441 13.474 1.00 0.00 H new ATOM 0 HB3 MET A 8 13.673 24.473 13.139 1.00 0.00 H new ATOM 0 HG2 MET A 8 13.051 24.059 10.928 1.00 0.00 H new ATOM 0 HG3 MET A 8 11.346 24.311 11.244 1.00 0.00 H new ATOM 0 HE1 MET A 8 10.814 28.081 11.060 1.00 0.00 H new ATOM 0 HE2 MET A 8 10.105 26.465 10.834 1.00 0.00 H new ATOM 0 HE3 MET A 8 10.736 26.944 12.427 1.00 0.00 H new ATOM 83 N ALA A 9 9.741 22.598 12.797 1.00 0.00 N ATOM 84 CA ALA A 9 8.290 22.645 12.660 1.00 0.00 C ATOM 85 C ALA A 9 7.657 21.320 13.070 1.00 0.00 C ATOM 86 O ALA A 9 8.055 20.257 12.592 1.00 0.00 O ATOM 87 CB ALA A 9 7.907 22.997 11.231 1.00 0.00 C ATOM 0 H ALA A 9 10.188 21.836 12.288 1.00 0.00 H new ATOM 0 HA ALA A 9 7.911 23.419 13.327 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.821 23.029 11.143 1.00 0.00 H new ATOM 0 HB2 ALA A 9 8.321 23.972 10.973 1.00 0.00 H new ATOM 0 HB3 ALA A 9 8.304 22.243 10.552 1.00 0.00 H new ATOM 93 N SER A 10 6.670 21.390 13.957 1.00 0.00 N ATOM 94 CA SER A 10 5.985 20.195 14.434 1.00 0.00 C ATOM 95 C SER A 10 4.718 19.936 13.625 1.00 0.00 C ATOM 96 O SER A 10 4.526 18.847 13.083 1.00 0.00 O ATOM 97 CB SER A 10 5.636 20.339 15.917 1.00 0.00 C ATOM 98 OG SER A 10 5.115 19.128 16.438 1.00 0.00 O ATOM 0 H SER A 10 6.327 22.262 14.360 1.00 0.00 H new ATOM 0 HA SER A 10 6.657 19.346 14.307 1.00 0.00 H new ATOM 0 HB2 SER A 10 6.526 20.627 16.477 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.906 21.138 16.046 1.00 0.00 H new ATOM 0 HG SER A 10 4.901 19.245 17.387 1.00 0.00 H new ATOM 104 N SER A 11 3.856 20.944 13.548 1.00 0.00 N ATOM 105 CA SER A 11 2.605 20.826 12.808 1.00 0.00 C ATOM 106 C SER A 11 2.870 20.506 11.340 1.00 0.00 C ATOM 107 O SER A 11 3.487 21.293 10.622 1.00 0.00 O ATOM 108 CB SER A 11 1.796 22.120 12.921 1.00 0.00 C ATOM 109 OG SER A 11 1.670 22.526 14.273 1.00 0.00 O ATOM 0 H SER A 11 4.001 21.852 13.989 1.00 0.00 H new ATOM 0 HA SER A 11 2.031 20.008 13.243 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.282 22.908 12.345 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.806 21.973 12.488 1.00 0.00 H new ATOM 0 HG SER A 11 1.151 23.356 14.318 1.00 0.00 H new ATOM 115 N VAL A 12 2.398 19.343 10.900 1.00 0.00 N ATOM 116 CA VAL A 12 2.583 18.917 9.518 1.00 0.00 C ATOM 117 C VAL A 12 2.118 19.994 8.544 1.00 0.00 C ATOM 118 O VAL A 12 1.128 20.684 8.792 1.00 0.00 O ATOM 119 CB VAL A 12 1.818 17.613 9.226 1.00 0.00 C ATOM 120 CG1 VAL A 12 1.976 17.216 7.766 1.00 0.00 C ATOM 121 CG2 VAL A 12 2.296 16.498 10.144 1.00 0.00 C ATOM 0 H VAL A 12 1.885 18.680 11.481 1.00 0.00 H new ATOM 0 HA VAL A 12 3.650 18.743 9.381 1.00 0.00 H new ATOM 0 HB VAL A 12 0.759 17.783 9.419 1.00 0.00 H new ATOM 0 HG11 VAL A 12 1.428 16.292 7.579 1.00 0.00 H new ATOM 0 HG12 VAL A 12 1.581 18.007 7.129 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.032 17.064 7.543 1.00 0.00 H new ATOM 0 HG21 VAL A 12 1.745 15.584 9.924 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.361 16.327 9.985 1.00 0.00 H new ATOM 0 HG23 VAL A 12 2.126 16.783 11.182 1.00 0.00 H new ATOM 131 N ASP A 13 2.838 20.134 7.437 1.00 0.00 N ATOM 132 CA ASP A 13 2.499 21.127 6.424 1.00 0.00 C ATOM 133 C ASP A 13 2.761 20.584 5.023 1.00 0.00 C ATOM 134 O ASP A 13 3.258 19.470 4.861 1.00 0.00 O ATOM 135 CB ASP A 13 3.303 22.409 6.647 1.00 0.00 C ATOM 136 CG ASP A 13 4.738 22.282 6.173 1.00 0.00 C ATOM 137 OD1 ASP A 13 5.334 21.203 6.370 1.00 0.00 O ATOM 138 OD2 ASP A 13 5.264 23.263 5.606 1.00 0.00 O ATOM 0 H ASP A 13 3.661 19.572 7.218 1.00 0.00 H new ATOM 0 HA ASP A 13 1.437 21.354 6.513 1.00 0.00 H new ATOM 0 HB2 ASP A 13 2.821 23.233 6.121 1.00 0.00 H new ATOM 0 HB3 ASP A 13 3.295 22.660 7.708 1.00 0.00 H new ATOM 143 N GLU A 14 2.423 21.380 4.013 1.00 0.00 N ATOM 144 CA GLU A 14 2.620 20.978 2.625 1.00 0.00 C ATOM 145 C GLU A 14 4.055 20.512 2.392 1.00 0.00 C ATOM 146 O GLU A 14 4.301 19.596 1.609 1.00 0.00 O ATOM 147 CB GLU A 14 2.289 22.137 1.683 1.00 0.00 C ATOM 148 CG GLU A 14 0.910 22.733 1.911 1.00 0.00 C ATOM 149 CD GLU A 14 0.443 23.585 0.748 1.00 0.00 C ATOM 150 OE1 GLU A 14 1.059 24.644 0.504 1.00 0.00 O ATOM 151 OE2 GLU A 14 -0.538 23.194 0.081 1.00 0.00 O ATOM 0 H GLU A 14 2.012 22.306 4.130 1.00 0.00 H new ATOM 0 HA GLU A 14 1.948 20.146 2.416 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.038 22.919 1.806 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.359 21.788 0.653 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.194 21.928 2.078 1.00 0.00 H new ATOM 0 HG3 GLU A 14 0.925 23.339 2.817 1.00 0.00 H new ATOM 158 N GLU A 15 4.997 21.152 3.078 1.00 0.00 N ATOM 159 CA GLU A 15 6.407 20.804 2.945 1.00 0.00 C ATOM 160 C GLU A 15 6.657 19.366 3.389 1.00 0.00 C ATOM 161 O GLU A 15 7.322 18.598 2.695 1.00 0.00 O ATOM 162 CB GLU A 15 7.271 21.761 3.768 1.00 0.00 C ATOM 163 CG GLU A 15 8.702 21.284 3.952 1.00 0.00 C ATOM 164 CD GLU A 15 9.550 21.489 2.712 1.00 0.00 C ATOM 165 OE1 GLU A 15 9.114 21.067 1.620 1.00 0.00 O ATOM 166 OE2 GLU A 15 10.648 22.072 2.833 1.00 0.00 O ATOM 0 H GLU A 15 4.810 21.913 3.731 1.00 0.00 H new ATOM 0 HA GLU A 15 6.679 20.893 1.893 1.00 0.00 H new ATOM 0 HB2 GLU A 15 7.282 22.737 3.282 1.00 0.00 H new ATOM 0 HB3 GLU A 15 6.814 21.898 4.748 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.154 21.817 4.789 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.697 20.226 4.213 1.00 0.00 H new ATOM 173 N ALA A 16 6.119 19.010 4.551 1.00 0.00 N ATOM 174 CA ALA A 16 6.281 17.664 5.087 1.00 0.00 C ATOM 175 C ALA A 16 5.695 16.621 4.142 1.00 0.00 C ATOM 176 O ALA A 16 6.367 15.660 3.767 1.00 0.00 O ATOM 177 CB ALA A 16 5.632 17.561 6.459 1.00 0.00 C ATOM 0 H ALA A 16 5.567 19.635 5.139 1.00 0.00 H new ATOM 0 HA ALA A 16 7.348 17.466 5.186 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.761 16.551 6.847 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.101 18.273 7.138 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.569 17.785 6.376 1.00 0.00 H new ATOM 183 N LEU A 17 4.437 16.816 3.762 1.00 0.00 N ATOM 184 CA LEU A 17 3.758 15.891 2.860 1.00 0.00 C ATOM 185 C LEU A 17 4.643 15.548 1.666 1.00 0.00 C ATOM 186 O LEU A 17 4.919 14.377 1.401 1.00 0.00 O ATOM 187 CB LEU A 17 2.440 16.496 2.375 1.00 0.00 C ATOM 188 CG LEU A 17 1.462 16.937 3.465 1.00 0.00 C ATOM 189 CD1 LEU A 17 0.365 17.811 2.878 1.00 0.00 C ATOM 190 CD2 LEU A 17 0.863 15.725 4.166 1.00 0.00 C ATOM 0 H LEU A 17 3.866 17.606 4.064 1.00 0.00 H new ATOM 0 HA LEU A 17 3.549 14.973 3.410 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.668 17.359 1.749 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.940 15.765 1.740 1.00 0.00 H new ATOM 0 HG LEU A 17 2.010 17.525 4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.321 18.115 3.669 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.809 18.696 2.423 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -0.181 17.249 2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.170 16.057 4.938 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.330 15.111 3.440 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.660 15.138 4.622 1.00 0.00 H new ATOM 202 N HIS A 18 5.086 16.575 0.949 1.00 0.00 N ATOM 203 CA HIS A 18 5.942 16.382 -0.216 1.00 0.00 C ATOM 204 C HIS A 18 6.948 15.262 0.029 1.00 0.00 C ATOM 205 O HIS A 18 7.082 14.348 -0.784 1.00 0.00 O ATOM 206 CB HIS A 18 6.677 17.679 -0.556 1.00 0.00 C ATOM 207 CG HIS A 18 7.543 17.576 -1.773 1.00 0.00 C ATOM 208 ND1 HIS A 18 8.869 17.956 -1.788 1.00 0.00 N ATOM 209 CD2 HIS A 18 7.267 17.130 -3.021 1.00 0.00 C ATOM 210 CE1 HIS A 18 9.370 17.750 -2.993 1.00 0.00 C ATOM 211 NE2 HIS A 18 8.418 17.249 -3.760 1.00 0.00 N ATOM 0 H HIS A 18 4.867 17.550 1.154 1.00 0.00 H new ATOM 0 HA HIS A 18 5.310 16.101 -1.058 1.00 0.00 H new ATOM 0 HB2 HIS A 18 5.945 18.473 -0.707 1.00 0.00 H new ATOM 0 HB3 HIS A 18 7.293 17.971 0.294 1.00 0.00 H new ATOM 0 HD2 HIS A 18 6.318 16.751 -3.370 1.00 0.00 H new ATOM 0 HE1 HIS A 18 10.385 17.956 -3.299 1.00 0.00 H new ATOM 0 HE2 HIS A 18 8.521 16.992 -4.742 1.00 0.00 H new ATOM 220 N GLN A 19 7.653 15.342 1.153 1.00 0.00 N ATOM 221 CA GLN A 19 8.648 14.335 1.503 1.00 0.00 C ATOM 222 C GLN A 19 8.099 12.929 1.288 1.00 0.00 C ATOM 223 O GLN A 19 8.790 12.054 0.765 1.00 0.00 O ATOM 224 CB GLN A 19 9.088 14.507 2.958 1.00 0.00 C ATOM 225 CG GLN A 19 9.731 15.855 3.244 1.00 0.00 C ATOM 226 CD GLN A 19 11.228 15.850 3.003 1.00 0.00 C ATOM 227 OE1 GLN A 19 11.930 14.921 3.403 1.00 0.00 O ATOM 228 NE2 GLN A 19 11.725 16.891 2.346 1.00 0.00 N ATOM 0 H GLN A 19 7.554 16.093 1.836 1.00 0.00 H new ATOM 0 HA GLN A 19 9.511 14.471 0.851 1.00 0.00 H new ATOM 0 HB2 GLN A 19 8.222 14.382 3.608 1.00 0.00 H new ATOM 0 HB3 GLN A 19 9.794 13.716 3.211 1.00 0.00 H new ATOM 0 HG2 GLN A 19 9.268 16.615 2.615 1.00 0.00 H new ATOM 0 HG3 GLN A 19 9.534 16.135 4.279 1.00 0.00 H new ATOM 0 HE21 GLN A 19 11.106 17.639 2.033 1.00 0.00 H new ATOM 0 HE22 GLN A 19 12.726 16.943 2.155 1.00 0.00 H new ATOM 237 N LEU A 20 6.852 12.718 1.696 1.00 0.00 N ATOM 238 CA LEU A 20 6.209 11.416 1.549 1.00 0.00 C ATOM 239 C LEU A 20 5.975 11.089 0.077 1.00 0.00 C ATOM 240 O LEU A 20 6.085 9.935 -0.337 1.00 0.00 O ATOM 241 CB LEU A 20 4.880 11.393 2.306 1.00 0.00 C ATOM 242 CG LEU A 20 3.946 10.226 1.987 1.00 0.00 C ATOM 243 CD1 LEU A 20 4.544 8.915 2.475 1.00 0.00 C ATOM 244 CD2 LEU A 20 2.576 10.453 2.610 1.00 0.00 C ATOM 0 H LEU A 20 6.266 13.431 2.131 1.00 0.00 H new ATOM 0 HA LEU A 20 6.872 10.660 1.970 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.094 11.379 3.375 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.351 12.323 2.099 1.00 0.00 H new ATOM 0 HG LEU A 20 3.826 10.167 0.905 1.00 0.00 H new ATOM 0 HD11 LEU A 20 3.865 8.095 2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.502 8.746 1.982 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.694 8.963 3.554 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.924 9.612 2.372 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.678 10.539 3.692 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.143 11.371 2.213 1.00 0.00 H new ATOM 256 N TYR A 21 5.653 12.111 -0.707 1.00 0.00 N ATOM 257 CA TYR A 21 5.403 11.932 -2.132 1.00 0.00 C ATOM 258 C TYR A 21 6.659 11.446 -2.849 1.00 0.00 C ATOM 259 O TYR A 21 6.650 10.404 -3.505 1.00 0.00 O ATOM 260 CB TYR A 21 4.921 13.243 -2.756 1.00 0.00 C ATOM 261 CG TYR A 21 3.450 13.515 -2.534 1.00 0.00 C ATOM 262 CD1 TYR A 21 2.944 13.702 -1.253 1.00 0.00 C ATOM 263 CD2 TYR A 21 2.567 13.583 -3.604 1.00 0.00 C ATOM 264 CE1 TYR A 21 1.601 13.950 -1.045 1.00 0.00 C ATOM 265 CE2 TYR A 21 1.222 13.831 -3.405 1.00 0.00 C ATOM 266 CZ TYR A 21 0.744 14.014 -2.125 1.00 0.00 C ATOM 267 OH TYR A 21 -0.594 14.261 -1.923 1.00 0.00 O ATOM 0 H TYR A 21 5.559 13.073 -0.380 1.00 0.00 H new ATOM 0 HA TYR A 21 4.626 11.176 -2.246 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.501 14.068 -2.341 1.00 0.00 H new ATOM 0 HB3 TYR A 21 5.120 13.220 -3.827 1.00 0.00 H new ATOM 0 HD1 TYR A 21 3.612 13.653 -0.406 1.00 0.00 H new ATOM 0 HD2 TYR A 21 2.938 13.440 -4.608 1.00 0.00 H new ATOM 0 HE1 TYR A 21 1.224 14.093 -0.043 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.549 13.881 -4.248 1.00 0.00 H new ATOM 0 HH TYR A 21 -1.058 14.275 -2.786 1.00 0.00 H new ATOM 277 N LEU A 22 7.738 12.209 -2.719 1.00 0.00 N ATOM 278 CA LEU A 22 9.004 11.858 -3.353 1.00 0.00 C ATOM 279 C LEU A 22 9.308 10.374 -3.178 1.00 0.00 C ATOM 280 O LEU A 22 9.539 9.658 -4.152 1.00 0.00 O ATOM 281 CB LEU A 22 10.141 12.696 -2.765 1.00 0.00 C ATOM 282 CG LEU A 22 10.082 14.198 -3.044 1.00 0.00 C ATOM 283 CD1 LEU A 22 10.995 14.954 -2.091 1.00 0.00 C ATOM 284 CD2 LEU A 22 10.460 14.487 -4.490 1.00 0.00 C ATOM 0 H LEU A 22 7.762 13.075 -2.180 1.00 0.00 H new ATOM 0 HA LEU A 22 8.919 12.069 -4.419 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.154 12.548 -1.685 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.085 12.312 -3.151 1.00 0.00 H new ATOM 0 HG LEU A 22 9.059 14.539 -2.882 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.940 16.021 -2.304 1.00 0.00 H new ATOM 0 HD12 LEU A 22 10.679 14.773 -1.064 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.021 14.610 -2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.413 15.561 -4.671 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.473 14.132 -4.679 1.00 0.00 H new ATOM 0 HD23 LEU A 22 9.766 13.976 -5.157 1.00 0.00 H new ATOM 296 N TRP A 23 9.303 9.918 -1.930 1.00 0.00 N ATOM 297 CA TRP A 23 9.576 8.517 -1.628 1.00 0.00 C ATOM 298 C TRP A 23 8.916 7.600 -2.652 1.00 0.00 C ATOM 299 O TRP A 23 9.478 6.574 -3.034 1.00 0.00 O ATOM 300 CB TRP A 23 9.081 8.172 -0.222 1.00 0.00 C ATOM 301 CG TRP A 23 8.755 6.720 -0.047 1.00 0.00 C ATOM 302 CD1 TRP A 23 9.630 5.672 -0.095 1.00 0.00 C ATOM 303 CD2 TRP A 23 7.463 6.155 0.202 1.00 0.00 C ATOM 304 NE1 TRP A 23 8.959 4.490 0.109 1.00 0.00 N ATOM 305 CE2 TRP A 23 7.629 4.760 0.295 1.00 0.00 C ATOM 306 CE3 TRP A 23 6.183 6.693 0.358 1.00 0.00 C ATOM 307 CZ2 TRP A 23 6.563 3.898 0.535 1.00 0.00 C ATOM 308 CZ3 TRP A 23 5.125 5.837 0.596 1.00 0.00 C ATOM 309 CH2 TRP A 23 5.320 4.452 0.684 1.00 0.00 C ATOM 0 H TRP A 23 9.113 10.497 -1.112 1.00 0.00 H new ATOM 0 HA TRP A 23 10.654 8.365 -1.674 1.00 0.00 H new ATOM 0 HB2 TRP A 23 9.843 8.456 0.504 1.00 0.00 H new ATOM 0 HB3 TRP A 23 8.194 8.765 -0.001 1.00 0.00 H new ATOM 0 HD1 TRP A 23 10.692 5.759 -0.268 1.00 0.00 H new ATOM 0 HE1 TRP A 23 9.383 3.562 0.120 1.00 0.00 H new ATOM 0 HE3 TRP A 23 6.023 7.759 0.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 6.711 2.830 0.601 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 4.131 6.242 0.716 1.00 0.00 H new ATOM 0 HH2 TRP A 23 4.473 3.809 0.873 1.00 0.00 H new ATOM 320 N VAL A 24 7.719 7.977 -3.093 1.00 0.00 N ATOM 321 CA VAL A 24 6.983 7.189 -4.074 1.00 0.00 C ATOM 322 C VAL A 24 7.569 7.364 -5.471 1.00 0.00 C ATOM 323 O VAL A 24 7.716 6.398 -6.219 1.00 0.00 O ATOM 324 CB VAL A 24 5.493 7.577 -4.102 1.00 0.00 C ATOM 325 CG1 VAL A 24 4.747 6.756 -5.142 1.00 0.00 C ATOM 326 CG2 VAL A 24 4.871 7.400 -2.725 1.00 0.00 C ATOM 0 H VAL A 24 7.239 8.823 -2.786 1.00 0.00 H new ATOM 0 HA VAL A 24 7.073 6.145 -3.773 1.00 0.00 H new ATOM 0 HB VAL A 24 5.414 8.628 -4.379 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.696 7.044 -5.147 1.00 0.00 H new ATOM 0 HG12 VAL A 24 5.178 6.938 -6.127 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.832 5.697 -4.899 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.818 7.679 -2.763 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.960 6.358 -2.417 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.389 8.036 -2.007 1.00 0.00 H new ATOM 336 N ASP A 25 7.902 8.603 -5.815 1.00 0.00 N ATOM 337 CA ASP A 25 8.474 8.906 -7.122 1.00 0.00 C ATOM 338 C ASP A 25 9.681 8.017 -7.406 1.00 0.00 C ATOM 339 O ASP A 25 9.978 7.707 -8.559 1.00 0.00 O ATOM 340 CB ASP A 25 8.880 10.378 -7.196 1.00 0.00 C ATOM 341 CG ASP A 25 10.309 10.608 -6.745 1.00 0.00 C ATOM 342 OD1 ASP A 25 11.230 10.072 -7.396 1.00 0.00 O ATOM 343 OD2 ASP A 25 10.506 11.323 -5.740 1.00 0.00 O ATOM 0 H ASP A 25 7.786 9.414 -5.207 1.00 0.00 H new ATOM 0 HA ASP A 25 7.714 8.709 -7.878 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.764 10.733 -8.220 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.207 10.969 -6.575 1.00 0.00 H new ATOM 348 N ASN A 26 10.373 7.612 -6.347 1.00 0.00 N ATOM 349 CA ASN A 26 11.549 6.760 -6.482 1.00 0.00 C ATOM 350 C ASN A 26 11.146 5.316 -6.763 1.00 0.00 C ATOM 351 O ASN A 26 11.701 4.667 -7.650 1.00 0.00 O ATOM 352 CB ASN A 26 12.401 6.826 -5.213 1.00 0.00 C ATOM 353 CG ASN A 26 13.826 6.362 -5.449 1.00 0.00 C ATOM 354 OD1 ASN A 26 14.771 7.144 -5.340 1.00 0.00 O ATOM 355 ND2 ASN A 26 13.986 5.084 -5.773 1.00 0.00 N ATOM 0 H ASN A 26 10.140 7.860 -5.385 1.00 0.00 H new ATOM 0 HA ASN A 26 12.136 7.125 -7.325 1.00 0.00 H new ATOM 0 HB2 ASN A 26 12.412 7.850 -4.839 1.00 0.00 H new ATOM 0 HB3 ASN A 26 11.944 6.209 -4.439 1.00 0.00 H new ATOM 0 HD21 ASN A 26 14.921 4.714 -5.943 1.00 0.00 H new ATOM 0 HD22 ASN A 26 13.174 4.472 -5.852 1.00 0.00 H new ATOM 362 N ILE A 27 10.177 4.819 -6.001 1.00 0.00 N ATOM 363 CA ILE A 27 9.698 3.453 -6.169 1.00 0.00 C ATOM 364 C ILE A 27 9.189 3.219 -7.587 1.00 0.00 C ATOM 365 O ILE A 27 8.448 4.027 -8.148 1.00 0.00 O ATOM 366 CB ILE A 27 8.572 3.125 -5.171 1.00 0.00 C ATOM 367 CG1 ILE A 27 9.084 3.242 -3.734 1.00 0.00 C ATOM 368 CG2 ILE A 27 8.024 1.729 -5.431 1.00 0.00 C ATOM 369 CD1 ILE A 27 7.998 3.098 -2.691 1.00 0.00 C ATOM 0 H ILE A 27 9.709 5.342 -5.261 1.00 0.00 H new ATOM 0 HA ILE A 27 10.546 2.796 -5.977 1.00 0.00 H new ATOM 0 HB ILE A 27 7.764 3.844 -5.309 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.843 2.478 -3.564 1.00 0.00 H new ATOM 0 HG13 ILE A 27 9.571 4.209 -3.608 1.00 0.00 H new ATOM 0 HG21 ILE A 27 7.229 1.512 -4.718 1.00 0.00 H new ATOM 0 HG22 ILE A 27 7.626 1.677 -6.445 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.824 0.997 -5.317 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.434 3.192 -1.696 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.250 3.878 -2.834 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.526 2.120 -2.790 1.00 0.00 H new ATOM 381 N PRO A 28 9.593 2.087 -8.181 1.00 0.00 N ATOM 382 CA PRO A 28 9.188 1.718 -9.541 1.00 0.00 C ATOM 383 C PRO A 28 7.711 1.351 -9.627 1.00 0.00 C ATOM 384 O PRO A 28 7.292 0.301 -9.137 1.00 0.00 O ATOM 385 CB PRO A 28 10.061 0.500 -9.853 1.00 0.00 C ATOM 386 CG PRO A 28 10.387 -0.083 -8.522 1.00 0.00 C ATOM 387 CD PRO A 28 10.476 1.078 -7.572 1.00 0.00 C ATOM 0 HA PRO A 28 9.317 2.543 -10.242 1.00 0.00 H new ATOM 0 HB2 PRO A 28 9.531 -0.217 -10.480 1.00 0.00 H new ATOM 0 HB3 PRO A 28 10.964 0.788 -10.391 1.00 0.00 H new ATOM 0 HG2 PRO A 28 9.618 -0.788 -8.206 1.00 0.00 H new ATOM 0 HG3 PRO A 28 11.328 -0.632 -8.556 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.143 0.804 -6.571 1.00 0.00 H new ATOM 0 HD3 PRO A 28 11.499 1.443 -7.479 1.00 0.00 H new ATOM 395 N LEU A 29 6.925 2.222 -10.251 1.00 0.00 N ATOM 396 CA LEU A 29 5.493 1.989 -10.401 1.00 0.00 C ATOM 397 C LEU A 29 5.049 2.234 -11.840 1.00 0.00 C ATOM 398 O LEU A 29 5.210 3.332 -12.371 1.00 0.00 O ATOM 399 CB LEU A 29 4.706 2.894 -9.452 1.00 0.00 C ATOM 400 CG LEU A 29 4.848 2.588 -7.960 1.00 0.00 C ATOM 401 CD1 LEU A 29 4.600 3.839 -7.132 1.00 0.00 C ATOM 402 CD2 LEU A 29 3.891 1.477 -7.552 1.00 0.00 C ATOM 0 H LEU A 29 7.255 3.096 -10.661 1.00 0.00 H new ATOM 0 HA LEU A 29 5.292 0.948 -10.150 1.00 0.00 H new ATOM 0 HB2 LEU A 29 5.018 3.924 -9.622 1.00 0.00 H new ATOM 0 HB3 LEU A 29 3.650 2.833 -9.716 1.00 0.00 H new ATOM 0 HG LEU A 29 5.867 2.251 -7.772 1.00 0.00 H new ATOM 0 HD11 LEU A 29 4.705 3.601 -6.073 1.00 0.00 H new ATOM 0 HD12 LEU A 29 5.324 4.606 -7.406 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.592 4.208 -7.323 1.00 0.00 H new ATOM 0 HD21 LEU A 29 4.005 1.271 -6.488 1.00 0.00 H new ATOM 0 HD22 LEU A 29 2.866 1.787 -7.754 1.00 0.00 H new ATOM 0 HD23 LEU A 29 4.116 0.575 -8.122 1.00 0.00 H new ATOM 414 N SER A 30 4.488 1.203 -12.464 1.00 0.00 N ATOM 415 CA SER A 30 4.022 1.306 -13.842 1.00 0.00 C ATOM 416 C SER A 30 3.122 2.525 -14.022 1.00 0.00 C ATOM 417 O SER A 30 3.000 3.063 -15.123 1.00 0.00 O ATOM 418 CB SER A 30 3.267 0.037 -14.244 1.00 0.00 C ATOM 419 OG SER A 30 3.072 -0.018 -15.646 1.00 0.00 O ATOM 0 H SER A 30 4.345 0.287 -12.038 1.00 0.00 H new ATOM 0 HA SER A 30 4.894 1.421 -14.486 1.00 0.00 H new ATOM 0 HB2 SER A 30 3.824 -0.841 -13.917 1.00 0.00 H new ATOM 0 HB3 SER A 30 2.302 0.009 -13.738 1.00 0.00 H new ATOM 0 HG SER A 30 2.589 -0.839 -15.877 1.00 0.00 H new ATOM 425 N ARG A 31 2.495 2.955 -12.932 1.00 0.00 N ATOM 426 CA ARG A 31 1.605 4.110 -12.969 1.00 0.00 C ATOM 427 C ARG A 31 2.236 5.259 -13.749 1.00 0.00 C ATOM 428 O ARG A 31 3.411 5.587 -13.577 1.00 0.00 O ATOM 429 CB ARG A 31 1.270 4.567 -11.548 1.00 0.00 C ATOM 430 CG ARG A 31 0.251 5.694 -11.495 1.00 0.00 C ATOM 431 CD ARG A 31 0.443 6.561 -10.261 1.00 0.00 C ATOM 432 NE ARG A 31 1.769 7.172 -10.222 1.00 0.00 N ATOM 433 CZ ARG A 31 2.360 7.575 -9.102 1.00 0.00 C ATOM 434 NH1 ARG A 31 1.746 7.432 -7.936 1.00 0.00 N ATOM 435 NH2 ARG A 31 3.568 8.123 -9.148 1.00 0.00 N ATOM 0 H ARG A 31 2.586 2.522 -12.013 1.00 0.00 H new ATOM 0 HA ARG A 31 0.686 3.813 -13.475 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.889 3.717 -10.982 1.00 0.00 H new ATOM 0 HB3 ARG A 31 2.186 4.893 -11.055 1.00 0.00 H new ATOM 0 HG2 ARG A 31 0.340 6.309 -12.391 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -0.756 5.276 -11.494 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.317 7.342 -10.245 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.296 5.956 -9.366 1.00 0.00 H new ATOM 0 HE ARG A 31 2.269 7.296 -11.102 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.817 7.012 -7.897 1.00 0.00 H new ATOM 0 HH12 ARG A 31 2.202 7.742 -7.078 1.00 0.00 H new ATOM 0 HH21 ARG A 31 4.043 8.235 -10.043 1.00 0.00 H new ATOM 0 HH22 ARG A 31 4.021 8.432 -8.288 1.00 0.00 H new ATOM 449 N PRO A 32 1.441 5.885 -14.628 1.00 0.00 N ATOM 450 CA PRO A 32 1.900 7.007 -15.453 1.00 0.00 C ATOM 451 C PRO A 32 2.148 8.267 -14.631 1.00 0.00 C ATOM 452 O PRO A 32 2.247 8.212 -13.405 1.00 0.00 O ATOM 453 CB PRO A 32 0.743 7.225 -16.431 1.00 0.00 C ATOM 454 CG PRO A 32 -0.456 6.697 -15.723 1.00 0.00 C ATOM 455 CD PRO A 32 0.030 5.547 -14.885 1.00 0.00 C ATOM 0 HA PRO A 32 2.852 6.793 -15.939 1.00 0.00 H new ATOM 0 HB2 PRO A 32 0.625 8.281 -16.676 1.00 0.00 H new ATOM 0 HB3 PRO A 32 0.913 6.697 -17.369 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -0.913 7.467 -15.101 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -1.215 6.369 -16.433 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -0.537 5.457 -13.958 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -0.066 4.597 -15.411 1.00 0.00 H new ATOM 463 N LYS A 33 2.248 9.402 -15.313 1.00 0.00 N ATOM 464 CA LYS A 33 2.483 10.678 -14.647 1.00 0.00 C ATOM 465 C LYS A 33 1.165 11.354 -14.285 1.00 0.00 C ATOM 466 O LYS A 33 0.372 11.699 -15.162 1.00 0.00 O ATOM 467 CB LYS A 33 3.312 11.600 -15.544 1.00 0.00 C ATOM 468 CG LYS A 33 4.729 11.107 -15.779 1.00 0.00 C ATOM 469 CD LYS A 33 4.780 10.064 -16.883 1.00 0.00 C ATOM 470 CE LYS A 33 4.143 10.577 -18.165 1.00 0.00 C ATOM 471 NZ LYS A 33 4.763 9.969 -19.375 1.00 0.00 N ATOM 0 H LYS A 33 2.170 9.465 -16.328 1.00 0.00 H new ATOM 0 HA LYS A 33 3.035 10.483 -13.728 1.00 0.00 H new ATOM 0 HB2 LYS A 33 2.809 11.706 -16.505 1.00 0.00 H new ATOM 0 HB3 LYS A 33 3.351 12.592 -15.094 1.00 0.00 H new ATOM 0 HG2 LYS A 33 5.369 11.949 -16.043 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.125 10.682 -14.857 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.817 9.788 -17.076 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.265 9.161 -16.556 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.076 10.356 -18.154 1.00 0.00 H new ATOM 0 HE3 LYS A 33 4.243 11.661 -18.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 4.301 10.344 -20.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.776 10.201 -19.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.645 8.936 -19.344 1.00 0.00 H new ATOM 485 N ARG A 34 0.937 11.541 -12.989 1.00 0.00 N ATOM 486 CA ARG A 34 -0.286 12.176 -12.512 1.00 0.00 C ATOM 487 C ARG A 34 -0.241 12.374 -11.000 1.00 0.00 C ATOM 488 O ARG A 34 0.750 12.044 -10.350 1.00 0.00 O ATOM 489 CB ARG A 34 -1.505 11.333 -12.891 1.00 0.00 C ATOM 490 CG ARG A 34 -2.767 12.151 -13.111 1.00 0.00 C ATOM 491 CD ARG A 34 -3.691 11.489 -14.120 1.00 0.00 C ATOM 492 NE ARG A 34 -4.360 10.317 -13.563 1.00 0.00 N ATOM 493 CZ ARG A 34 -4.984 9.406 -14.303 1.00 0.00 C ATOM 494 NH1 ARG A 34 -5.024 9.533 -15.622 1.00 0.00 N ATOM 495 NH2 ARG A 34 -5.570 8.367 -13.722 1.00 0.00 N ATOM 0 H ARG A 34 1.583 11.262 -12.251 1.00 0.00 H new ATOM 0 HA ARG A 34 -0.367 13.154 -12.987 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -1.281 10.774 -13.800 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -1.689 10.601 -12.104 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.291 12.276 -12.163 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -2.499 13.148 -13.461 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -4.439 12.209 -14.454 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -3.117 11.195 -14.999 1.00 0.00 H new ATOM 0 HE ARG A 34 -4.348 10.190 -12.551 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -4.575 10.331 -16.071 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -5.503 8.832 -16.187 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -5.542 8.267 -12.707 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -6.049 7.668 -14.290 1.00 0.00 H new ATOM 509 N ASN A 35 -1.321 12.916 -10.447 1.00 0.00 N ATOM 510 CA ASN A 35 -1.405 13.159 -9.011 1.00 0.00 C ATOM 511 C ASN A 35 -1.144 11.878 -8.226 1.00 0.00 C ATOM 512 O ASN A 35 -1.090 10.787 -8.797 1.00 0.00 O ATOM 513 CB ASN A 35 -2.780 13.723 -8.648 1.00 0.00 C ATOM 514 CG ASN A 35 -3.121 14.971 -9.439 1.00 0.00 C ATOM 515 OD1 ASN A 35 -3.811 14.905 -10.457 1.00 0.00 O ATOM 516 ND2 ASN A 35 -2.637 16.117 -8.974 1.00 0.00 N ATOM 0 H ASN A 35 -2.150 13.195 -10.971 1.00 0.00 H new ATOM 0 HA ASN A 35 -0.639 13.888 -8.746 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -3.540 12.963 -8.828 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -2.805 13.953 -7.583 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.833 16.990 -9.464 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.070 16.124 -8.126 1.00 0.00 H new ATOM 523 N LEU A 36 -0.984 12.016 -6.915 1.00 0.00 N ATOM 524 CA LEU A 36 -0.730 10.869 -6.050 1.00 0.00 C ATOM 525 C LEU A 36 -2.038 10.264 -5.549 1.00 0.00 C ATOM 526 O LEU A 36 -2.343 9.104 -5.825 1.00 0.00 O ATOM 527 CB LEU A 36 0.141 11.284 -4.862 1.00 0.00 C ATOM 528 CG LEU A 36 0.995 10.180 -4.238 1.00 0.00 C ATOM 529 CD1 LEU A 36 0.154 9.313 -3.314 1.00 0.00 C ATOM 530 CD2 LEU A 36 1.645 9.332 -5.322 1.00 0.00 C ATOM 0 H LEU A 36 -1.026 12.911 -6.427 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.202 10.115 -6.634 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.802 12.088 -5.185 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.507 11.696 -4.088 1.00 0.00 H new ATOM 0 HG LEU A 36 1.783 10.647 -3.647 1.00 0.00 H new ATOM 0 HD11 LEU A 36 0.778 8.533 -2.879 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.264 9.929 -2.518 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.656 8.855 -3.882 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.249 8.551 -4.860 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.871 8.875 -5.939 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.281 9.962 -5.944 1.00 0.00 H new ATOM 542 N SER A 37 -2.808 11.059 -4.813 1.00 0.00 N ATOM 543 CA SER A 37 -4.083 10.602 -4.273 1.00 0.00 C ATOM 544 C SER A 37 -4.979 10.057 -5.381 1.00 0.00 C ATOM 545 O SER A 37 -5.616 9.015 -5.224 1.00 0.00 O ATOM 546 CB SER A 37 -4.792 11.745 -3.544 1.00 0.00 C ATOM 547 OG SER A 37 -5.817 11.253 -2.699 1.00 0.00 O ATOM 0 H SER A 37 -2.571 12.023 -4.577 1.00 0.00 H new ATOM 0 HA SER A 37 -3.882 9.798 -3.565 1.00 0.00 H new ATOM 0 HB2 SER A 37 -4.069 12.308 -2.954 1.00 0.00 H new ATOM 0 HB3 SER A 37 -5.217 12.436 -4.272 1.00 0.00 H new ATOM 0 HG SER A 37 -6.254 12.003 -2.244 1.00 0.00 H new ATOM 553 N ARG A 38 -5.022 10.769 -6.502 1.00 0.00 N ATOM 554 CA ARG A 38 -5.840 10.359 -7.637 1.00 0.00 C ATOM 555 C ARG A 38 -5.639 8.878 -7.945 1.00 0.00 C ATOM 556 O ARG A 38 -6.581 8.178 -8.319 1.00 0.00 O ATOM 557 CB ARG A 38 -5.498 11.198 -8.870 1.00 0.00 C ATOM 558 CG ARG A 38 -5.958 12.643 -8.770 1.00 0.00 C ATOM 559 CD ARG A 38 -7.466 12.759 -8.927 1.00 0.00 C ATOM 560 NE ARG A 38 -7.971 14.037 -8.431 1.00 0.00 N ATOM 561 CZ ARG A 38 -7.764 15.197 -9.045 1.00 0.00 C ATOM 562 NH1 ARG A 38 -7.066 15.239 -10.172 1.00 0.00 N ATOM 563 NH2 ARG A 38 -8.256 16.317 -8.532 1.00 0.00 N ATOM 0 H ARG A 38 -4.500 11.633 -6.649 1.00 0.00 H new ATOM 0 HA ARG A 38 -6.886 10.520 -7.375 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -4.419 11.179 -9.024 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.954 10.740 -9.748 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -5.658 13.056 -7.807 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -5.464 13.237 -9.539 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -7.731 12.648 -9.979 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -7.950 11.944 -8.389 1.00 0.00 H new ATOM 0 HE ARG A 38 -8.512 14.039 -7.566 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -6.687 14.380 -10.569 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -6.909 16.131 -10.641 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -8.794 16.288 -7.666 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -8.097 17.207 -9.004 1.00 0.00 H new ATOM 577 N ASP A 39 -4.408 8.407 -7.784 1.00 0.00 N ATOM 578 CA ASP A 39 -4.083 7.010 -8.044 1.00 0.00 C ATOM 579 C ASP A 39 -4.172 6.184 -6.764 1.00 0.00 C ATOM 580 O ASP A 39 -4.992 5.272 -6.657 1.00 0.00 O ATOM 581 CB ASP A 39 -2.682 6.892 -8.645 1.00 0.00 C ATOM 582 CG ASP A 39 -2.659 7.210 -10.128 1.00 0.00 C ATOM 583 OD1 ASP A 39 -3.019 6.323 -10.930 1.00 0.00 O ATOM 584 OD2 ASP A 39 -2.282 8.346 -10.485 1.00 0.00 O ATOM 0 H ASP A 39 -3.618 8.973 -7.474 1.00 0.00 H new ATOM 0 HA ASP A 39 -4.809 6.621 -8.758 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -2.007 7.568 -8.121 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -2.306 5.881 -8.487 1.00 0.00 H new ATOM 589 N PHE A 40 -3.321 6.510 -5.796 1.00 0.00 N ATOM 590 CA PHE A 40 -3.302 5.797 -4.524 1.00 0.00 C ATOM 591 C PHE A 40 -4.720 5.517 -4.036 1.00 0.00 C ATOM 592 O PHE A 40 -5.021 4.421 -3.564 1.00 0.00 O ATOM 593 CB PHE A 40 -2.539 6.607 -3.473 1.00 0.00 C ATOM 594 CG PHE A 40 -1.064 6.324 -3.453 1.00 0.00 C ATOM 595 CD1 PHE A 40 -0.333 6.308 -4.630 1.00 0.00 C ATOM 596 CD2 PHE A 40 -0.409 6.075 -2.258 1.00 0.00 C ATOM 597 CE1 PHE A 40 1.025 6.047 -4.614 1.00 0.00 C ATOM 598 CE2 PHE A 40 0.948 5.814 -2.236 1.00 0.00 C ATOM 599 CZ PHE A 40 1.666 5.801 -3.416 1.00 0.00 C ATOM 0 H PHE A 40 -2.636 7.263 -5.868 1.00 0.00 H new ATOM 0 HA PHE A 40 -2.795 4.844 -4.677 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -2.695 7.669 -3.661 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -2.955 6.393 -2.489 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.829 6.501 -5.570 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -0.965 6.085 -1.332 1.00 0.00 H new ATOM 0 HE1 PHE A 40 1.584 6.036 -5.538 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.446 5.620 -1.298 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.727 5.599 -3.402 1.00 0.00 H new ATOM 609 N SER A 41 -5.588 6.518 -4.152 1.00 0.00 N ATOM 610 CA SER A 41 -6.974 6.382 -3.719 1.00 0.00 C ATOM 611 C SER A 41 -7.483 4.965 -3.964 1.00 0.00 C ATOM 612 O SER A 41 -8.174 4.388 -3.124 1.00 0.00 O ATOM 613 CB SER A 41 -7.861 7.389 -4.453 1.00 0.00 C ATOM 614 OG SER A 41 -7.745 7.242 -5.858 1.00 0.00 O ATOM 0 H SER A 41 -5.356 7.431 -4.542 1.00 0.00 H new ATOM 0 HA SER A 41 -7.016 6.584 -2.649 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.900 7.249 -4.154 1.00 0.00 H new ATOM 0 HB3 SER A 41 -7.581 8.402 -4.166 1.00 0.00 H new ATOM 0 HG SER A 41 -6.904 7.645 -6.161 1.00 0.00 H new ATOM 620 N ASP A 42 -7.137 4.411 -5.121 1.00 0.00 N ATOM 621 CA ASP A 42 -7.558 3.061 -5.478 1.00 0.00 C ATOM 622 C ASP A 42 -6.743 2.019 -4.718 1.00 0.00 C ATOM 623 O ASP A 42 -5.562 1.817 -4.995 1.00 0.00 O ATOM 624 CB ASP A 42 -7.413 2.840 -6.985 1.00 0.00 C ATOM 625 CG ASP A 42 -8.196 1.637 -7.472 1.00 0.00 C ATOM 626 OD1 ASP A 42 -8.482 0.743 -6.649 1.00 0.00 O ATOM 627 OD2 ASP A 42 -8.522 1.589 -8.677 1.00 0.00 O ATOM 0 H ASP A 42 -6.566 4.876 -5.827 1.00 0.00 H new ATOM 0 HA ASP A 42 -8.606 2.949 -5.201 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -7.754 3.730 -7.514 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -6.359 2.707 -7.230 1.00 0.00 H new ATOM 632 N GLY A 43 -7.384 1.359 -3.758 1.00 0.00 N ATOM 633 CA GLY A 43 -6.703 0.347 -2.971 1.00 0.00 C ATOM 634 C GLY A 43 -5.675 -0.420 -3.779 1.00 0.00 C ATOM 635 O GLY A 43 -4.529 -0.573 -3.355 1.00 0.00 O ATOM 0 H GLY A 43 -8.363 1.507 -3.511 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -6.212 0.821 -2.121 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.437 -0.350 -2.567 1.00 0.00 H new ATOM 639 N VAL A 44 -6.084 -0.905 -4.947 1.00 0.00 N ATOM 640 CA VAL A 44 -5.190 -1.661 -5.816 1.00 0.00 C ATOM 641 C VAL A 44 -3.814 -1.010 -5.889 1.00 0.00 C ATOM 642 O VAL A 44 -2.795 -1.655 -5.639 1.00 0.00 O ATOM 643 CB VAL A 44 -5.764 -1.785 -7.240 1.00 0.00 C ATOM 644 CG1 VAL A 44 -4.770 -2.480 -8.158 1.00 0.00 C ATOM 645 CG2 VAL A 44 -7.091 -2.528 -7.217 1.00 0.00 C ATOM 0 H VAL A 44 -7.029 -0.788 -5.313 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.095 -2.657 -5.383 1.00 0.00 H new ATOM 0 HB VAL A 44 -5.942 -0.783 -7.630 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.193 -2.559 -9.159 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.847 -1.902 -8.198 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.557 -3.478 -7.775 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.482 -2.606 -8.232 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.942 -3.527 -6.808 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.802 -1.984 -6.595 1.00 0.00 H new ATOM 655 N LEU A 45 -3.791 0.273 -6.234 1.00 0.00 N ATOM 656 CA LEU A 45 -2.538 1.014 -6.340 1.00 0.00 C ATOM 657 C LEU A 45 -1.668 0.791 -5.108 1.00 0.00 C ATOM 658 O LEU A 45 -0.526 0.342 -5.214 1.00 0.00 O ATOM 659 CB LEU A 45 -2.820 2.507 -6.516 1.00 0.00 C ATOM 660 CG LEU A 45 -1.762 3.304 -7.280 1.00 0.00 C ATOM 661 CD1 LEU A 45 -0.365 2.847 -6.892 1.00 0.00 C ATOM 662 CD2 LEU A 45 -1.972 3.167 -8.781 1.00 0.00 C ATOM 0 H LEU A 45 -4.625 0.822 -6.445 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.999 0.647 -7.213 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.773 2.618 -7.033 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -2.939 2.953 -5.528 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.865 4.356 -7.013 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.374 3.426 -7.446 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.217 2.998 -5.823 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.249 1.789 -7.129 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -1.210 3.741 -9.309 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.897 2.117 -9.065 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.959 3.545 -9.046 1.00 0.00 H new ATOM 674 N VAL A 46 -2.215 1.104 -3.938 1.00 0.00 N ATOM 675 CA VAL A 46 -1.490 0.935 -2.684 1.00 0.00 C ATOM 676 C VAL A 46 -0.852 -0.447 -2.601 1.00 0.00 C ATOM 677 O VAL A 46 0.314 -0.583 -2.231 1.00 0.00 O ATOM 678 CB VAL A 46 -2.414 1.136 -1.469 1.00 0.00 C ATOM 679 CG1 VAL A 46 -1.639 0.958 -0.173 1.00 0.00 C ATOM 680 CG2 VAL A 46 -3.073 2.506 -1.522 1.00 0.00 C ATOM 0 H VAL A 46 -3.159 1.476 -3.832 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.709 1.695 -2.665 1.00 0.00 H new ATOM 0 HB VAL A 46 -3.198 0.379 -1.502 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.309 1.104 0.674 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -1.219 -0.047 -0.135 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.832 1.690 -0.128 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -3.723 2.631 -0.656 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -2.305 3.280 -1.515 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -3.664 2.590 -2.434 1.00 0.00 H new ATOM 690 N ALA A 47 -1.625 -1.471 -2.948 1.00 0.00 N ATOM 691 CA ALA A 47 -1.135 -2.844 -2.915 1.00 0.00 C ATOM 692 C ALA A 47 0.153 -2.987 -3.719 1.00 0.00 C ATOM 693 O ALA A 47 1.061 -3.718 -3.327 1.00 0.00 O ATOM 694 CB ALA A 47 -2.198 -3.796 -3.443 1.00 0.00 C ATOM 0 H ALA A 47 -2.593 -1.376 -3.255 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.915 -3.101 -1.879 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.819 -4.818 -3.413 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.092 -3.722 -2.824 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.445 -3.531 -4.471 1.00 0.00 H new ATOM 700 N GLU A 48 0.223 -2.283 -4.845 1.00 0.00 N ATOM 701 CA GLU A 48 1.400 -2.334 -5.704 1.00 0.00 C ATOM 702 C GLU A 48 2.639 -1.848 -4.959 1.00 0.00 C ATOM 703 O GLU A 48 3.723 -2.414 -5.098 1.00 0.00 O ATOM 704 CB GLU A 48 1.180 -1.485 -6.958 1.00 0.00 C ATOM 705 CG GLU A 48 -0.190 -1.674 -7.588 1.00 0.00 C ATOM 706 CD GLU A 48 -0.285 -1.061 -8.972 1.00 0.00 C ATOM 707 OE1 GLU A 48 -0.393 0.179 -9.066 1.00 0.00 O ATOM 708 OE2 GLU A 48 -0.251 -1.823 -9.961 1.00 0.00 O ATOM 0 H GLU A 48 -0.520 -1.672 -5.183 1.00 0.00 H new ATOM 0 HA GLU A 48 1.558 -3.371 -5.999 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.311 -0.434 -6.702 1.00 0.00 H new ATOM 0 HB3 GLU A 48 1.946 -1.732 -7.693 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.413 -2.739 -7.650 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.947 -1.227 -6.944 1.00 0.00 H new ATOM 715 N VAL A 49 2.471 -0.793 -4.167 1.00 0.00 N ATOM 716 CA VAL A 49 3.575 -0.230 -3.398 1.00 0.00 C ATOM 717 C VAL A 49 4.235 -1.292 -2.526 1.00 0.00 C ATOM 718 O VAL A 49 5.408 -1.175 -2.170 1.00 0.00 O ATOM 719 CB VAL A 49 3.101 0.931 -2.504 1.00 0.00 C ATOM 720 CG1 VAL A 49 4.225 1.395 -1.591 1.00 0.00 C ATOM 721 CG2 VAL A 49 2.584 2.081 -3.354 1.00 0.00 C ATOM 0 H VAL A 49 1.581 -0.311 -4.041 1.00 0.00 H new ATOM 0 HA VAL A 49 4.302 0.148 -4.117 1.00 0.00 H new ATOM 0 HB VAL A 49 2.282 0.575 -1.879 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.871 2.216 -0.967 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.543 0.568 -0.957 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.067 1.735 -2.194 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.253 2.893 -2.706 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.381 2.439 -4.006 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.746 1.737 -3.961 1.00 0.00 H new ATOM 731 N ILE A 50 3.476 -2.328 -2.187 1.00 0.00 N ATOM 732 CA ILE A 50 3.988 -3.412 -1.358 1.00 0.00 C ATOM 733 C ILE A 50 4.789 -4.409 -2.190 1.00 0.00 C ATOM 734 O ILE A 50 5.828 -4.904 -1.755 1.00 0.00 O ATOM 735 CB ILE A 50 2.849 -4.158 -0.640 1.00 0.00 C ATOM 736 CG1 ILE A 50 1.907 -3.162 0.040 1.00 0.00 C ATOM 737 CG2 ILE A 50 3.416 -5.138 0.377 1.00 0.00 C ATOM 738 CD1 ILE A 50 0.581 -3.766 0.447 1.00 0.00 C ATOM 0 H ILE A 50 2.504 -2.440 -2.474 1.00 0.00 H new ATOM 0 HA ILE A 50 4.640 -2.958 -0.612 1.00 0.00 H new ATOM 0 HB ILE A 50 2.280 -4.721 -1.380 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.398 -2.755 0.924 1.00 0.00 H new ATOM 0 HG13 ILE A 50 1.724 -2.327 -0.636 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.598 -5.658 0.876 1.00 0.00 H new ATOM 0 HG22 ILE A 50 4.050 -5.864 -0.132 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.006 -4.595 1.116 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.036 -3.003 0.923 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.069 -4.148 -0.436 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.753 -4.583 1.148 1.00 0.00 H new ATOM 750 N LYS A 51 4.298 -4.698 -3.390 1.00 0.00 N ATOM 751 CA LYS A 51 4.968 -5.633 -4.286 1.00 0.00 C ATOM 752 C LYS A 51 6.476 -5.406 -4.281 1.00 0.00 C ATOM 753 O LYS A 51 7.253 -6.338 -4.075 1.00 0.00 O ATOM 754 CB LYS A 51 4.424 -5.486 -5.709 1.00 0.00 C ATOM 755 CG LYS A 51 5.245 -6.223 -6.753 1.00 0.00 C ATOM 756 CD LYS A 51 4.948 -7.713 -6.747 1.00 0.00 C ATOM 757 CE LYS A 51 5.137 -8.325 -8.126 1.00 0.00 C ATOM 758 NZ LYS A 51 4.137 -7.811 -9.103 1.00 0.00 N ATOM 0 H LYS A 51 3.438 -4.298 -3.765 1.00 0.00 H new ATOM 0 HA LYS A 51 4.770 -6.644 -3.930 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.399 -5.856 -5.737 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.388 -4.428 -5.968 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.032 -5.813 -7.740 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.306 -6.062 -6.563 1.00 0.00 H new ATOM 0 HD2 LYS A 51 5.603 -8.213 -6.033 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.925 -7.880 -6.411 1.00 0.00 H new ATOM 0 HE2 LYS A 51 6.142 -8.106 -8.486 1.00 0.00 H new ATOM 0 HE3 LYS A 51 5.053 -9.410 -8.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 4.005 -8.508 -9.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.230 -7.650 -8.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.477 -6.916 -9.509 1.00 0.00 H new ATOM 772 N PHE A 52 6.883 -4.161 -4.508 1.00 0.00 N ATOM 773 CA PHE A 52 8.299 -3.812 -4.528 1.00 0.00 C ATOM 774 C PHE A 52 9.038 -4.467 -3.365 1.00 0.00 C ATOM 775 O PHE A 52 10.049 -5.142 -3.559 1.00 0.00 O ATOM 776 CB PHE A 52 8.472 -2.293 -4.467 1.00 0.00 C ATOM 777 CG PHE A 52 9.900 -1.859 -4.301 1.00 0.00 C ATOM 778 CD1 PHE A 52 10.743 -1.769 -5.397 1.00 0.00 C ATOM 779 CD2 PHE A 52 10.400 -1.541 -3.048 1.00 0.00 C ATOM 780 CE1 PHE A 52 12.058 -1.370 -5.248 1.00 0.00 C ATOM 781 CE2 PHE A 52 11.714 -1.140 -2.893 1.00 0.00 C ATOM 782 CZ PHE A 52 12.544 -1.056 -3.994 1.00 0.00 C ATOM 0 H PHE A 52 6.253 -3.378 -4.681 1.00 0.00 H new ATOM 0 HA PHE A 52 8.726 -4.182 -5.460 1.00 0.00 H new ATOM 0 HB2 PHE A 52 8.070 -1.853 -5.380 1.00 0.00 H new ATOM 0 HB3 PHE A 52 7.883 -1.901 -3.638 1.00 0.00 H new ATOM 0 HD1 PHE A 52 10.368 -2.014 -6.380 1.00 0.00 H new ATOM 0 HD2 PHE A 52 9.756 -1.607 -2.183 1.00 0.00 H new ATOM 0 HE1 PHE A 52 12.704 -1.304 -6.111 1.00 0.00 H new ATOM 0 HE2 PHE A 52 12.091 -0.893 -1.912 1.00 0.00 H new ATOM 0 HZ PHE A 52 13.571 -0.745 -3.874 1.00 0.00 H new ATOM 792 N TYR A 53 8.526 -4.263 -2.157 1.00 0.00 N ATOM 793 CA TYR A 53 9.138 -4.830 -0.961 1.00 0.00 C ATOM 794 C TYR A 53 8.889 -6.333 -0.883 1.00 0.00 C ATOM 795 O TYR A 53 9.823 -7.133 -0.936 1.00 0.00 O ATOM 796 CB TYR A 53 8.590 -4.145 0.292 1.00 0.00 C ATOM 797 CG TYR A 53 9.089 -2.729 0.475 1.00 0.00 C ATOM 798 CD1 TYR A 53 10.425 -2.474 0.757 1.00 0.00 C ATOM 799 CD2 TYR A 53 8.224 -1.648 0.368 1.00 0.00 C ATOM 800 CE1 TYR A 53 10.886 -1.183 0.926 1.00 0.00 C ATOM 801 CE2 TYR A 53 8.675 -0.353 0.534 1.00 0.00 C ATOM 802 CZ TYR A 53 10.007 -0.125 0.813 1.00 0.00 C ATOM 803 OH TYR A 53 10.461 1.163 0.981 1.00 0.00 O ATOM 0 H TYR A 53 7.688 -3.709 -1.980 1.00 0.00 H new ATOM 0 HA TYR A 53 10.213 -4.660 -1.018 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.501 -4.134 0.243 1.00 0.00 H new ATOM 0 HB3 TYR A 53 8.864 -4.734 1.167 1.00 0.00 H new ATOM 0 HD1 TYR A 53 11.115 -3.300 0.846 1.00 0.00 H new ATOM 0 HD2 TYR A 53 7.181 -1.823 0.151 1.00 0.00 H new ATOM 0 HE1 TYR A 53 11.928 -1.003 1.145 1.00 0.00 H new ATOM 0 HE2 TYR A 53 7.989 0.476 0.446 1.00 0.00 H new ATOM 0 HH TYR A 53 11.399 1.218 0.701 1.00 0.00 H new ATOM 813 N PHE A 54 7.621 -6.710 -0.757 1.00 0.00 N ATOM 814 CA PHE A 54 7.247 -8.117 -0.670 1.00 0.00 C ATOM 815 C PHE A 54 6.183 -8.462 -1.709 1.00 0.00 C ATOM 816 O PHE A 54 5.107 -7.866 -1.755 1.00 0.00 O ATOM 817 CB PHE A 54 6.730 -8.444 0.732 1.00 0.00 C ATOM 818 CG PHE A 54 7.589 -7.889 1.832 1.00 0.00 C ATOM 819 CD1 PHE A 54 8.918 -8.265 1.948 1.00 0.00 C ATOM 820 CD2 PHE A 54 7.068 -6.991 2.750 1.00 0.00 C ATOM 821 CE1 PHE A 54 9.711 -7.756 2.959 1.00 0.00 C ATOM 822 CE2 PHE A 54 7.857 -6.478 3.762 1.00 0.00 C ATOM 823 CZ PHE A 54 9.180 -6.862 3.868 1.00 0.00 C ATOM 0 H PHE A 54 6.835 -6.061 -0.713 1.00 0.00 H new ATOM 0 HA PHE A 54 8.135 -8.716 -0.871 1.00 0.00 H new ATOM 0 HB2 PHE A 54 5.719 -8.051 0.838 1.00 0.00 H new ATOM 0 HB3 PHE A 54 6.665 -9.526 0.843 1.00 0.00 H new ATOM 0 HD1 PHE A 54 9.339 -8.964 1.240 1.00 0.00 H new ATOM 0 HD2 PHE A 54 6.034 -6.689 2.674 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.745 -8.057 3.038 1.00 0.00 H new ATOM 0 HE2 PHE A 54 7.440 -5.777 4.470 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.797 -6.464 4.660 1.00 0.00 H new ATOM 833 N PRO A 55 6.491 -9.447 -2.566 1.00 0.00 N ATOM 834 CA PRO A 55 5.576 -9.894 -3.620 1.00 0.00 C ATOM 835 C PRO A 55 4.361 -10.626 -3.061 1.00 0.00 C ATOM 836 O PRO A 55 3.222 -10.323 -3.417 1.00 0.00 O ATOM 837 CB PRO A 55 6.436 -10.845 -4.456 1.00 0.00 C ATOM 838 CG PRO A 55 7.480 -11.338 -3.515 1.00 0.00 C ATOM 839 CD PRO A 55 7.756 -10.201 -2.570 1.00 0.00 C ATOM 0 HA PRO A 55 5.167 -9.058 -4.187 1.00 0.00 H new ATOM 0 HB2 PRO A 55 5.843 -11.668 -4.855 1.00 0.00 H new ATOM 0 HB3 PRO A 55 6.882 -10.331 -5.307 1.00 0.00 H new ATOM 0 HG2 PRO A 55 7.134 -12.219 -2.975 1.00 0.00 H new ATOM 0 HG3 PRO A 55 8.384 -11.628 -4.051 1.00 0.00 H new ATOM 0 HD2 PRO A 55 8.013 -10.560 -1.573 1.00 0.00 H new ATOM 0 HD3 PRO A 55 8.589 -9.587 -2.912 1.00 0.00 H new ATOM 847 N LYS A 56 4.610 -11.592 -2.183 1.00 0.00 N ATOM 848 CA LYS A 56 3.537 -12.367 -1.573 1.00 0.00 C ATOM 849 C LYS A 56 2.534 -11.453 -0.876 1.00 0.00 C ATOM 850 O LYS A 56 1.336 -11.507 -1.152 1.00 0.00 O ATOM 851 CB LYS A 56 4.111 -13.370 -0.570 1.00 0.00 C ATOM 852 CG LYS A 56 5.206 -14.250 -1.148 1.00 0.00 C ATOM 853 CD LYS A 56 4.649 -15.243 -2.155 1.00 0.00 C ATOM 854 CE LYS A 56 3.961 -16.410 -1.465 1.00 0.00 C ATOM 855 NZ LYS A 56 3.127 -17.201 -2.412 1.00 0.00 N ATOM 0 H LYS A 56 5.547 -11.857 -1.878 1.00 0.00 H new ATOM 0 HA LYS A 56 3.019 -12.909 -2.364 1.00 0.00 H new ATOM 0 HB2 LYS A 56 4.508 -12.827 0.288 1.00 0.00 H new ATOM 0 HB3 LYS A 56 3.305 -14.003 -0.201 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.960 -13.626 -1.629 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.705 -14.788 -0.342 1.00 0.00 H new ATOM 0 HD2 LYS A 56 3.940 -14.738 -2.812 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.457 -15.616 -2.785 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.712 -17.059 -1.013 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.335 -16.035 -0.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.675 -17.987 -1.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.394 -16.589 -2.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.729 -17.580 -3.171 1.00 0.00 H new ATOM 869 N MET A 57 3.032 -10.615 0.027 1.00 0.00 N ATOM 870 CA MET A 57 2.179 -9.687 0.760 1.00 0.00 C ATOM 871 C MET A 57 1.087 -9.122 -0.143 1.00 0.00 C ATOM 872 O MET A 57 0.016 -8.737 0.327 1.00 0.00 O ATOM 873 CB MET A 57 3.013 -8.546 1.345 1.00 0.00 C ATOM 874 CG MET A 57 3.840 -8.956 2.554 1.00 0.00 C ATOM 875 SD MET A 57 2.868 -9.021 4.071 1.00 0.00 S ATOM 876 CE MET A 57 2.904 -7.302 4.570 1.00 0.00 C ATOM 0 H MET A 57 4.021 -10.559 0.269 1.00 0.00 H new ATOM 0 HA MET A 57 1.705 -10.236 1.574 1.00 0.00 H new ATOM 0 HB2 MET A 57 3.679 -8.161 0.573 1.00 0.00 H new ATOM 0 HB3 MET A 57 2.349 -7.730 1.629 1.00 0.00 H new ATOM 0 HG2 MET A 57 4.285 -9.934 2.370 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.661 -8.251 2.683 1.00 0.00 H new ATOM 0 HE1 MET A 57 2.343 -7.180 5.497 1.00 0.00 H new ATOM 0 HE2 MET A 57 3.937 -6.990 4.727 1.00 0.00 H new ATOM 0 HE3 MET A 57 2.454 -6.687 3.790 1.00 0.00 H new ATOM 886 N VAL A 58 1.365 -9.075 -1.442 1.00 0.00 N ATOM 887 CA VAL A 58 0.406 -8.558 -2.411 1.00 0.00 C ATOM 888 C VAL A 58 -0.458 -9.677 -2.980 1.00 0.00 C ATOM 889 O VAL A 58 0.040 -10.754 -3.307 1.00 0.00 O ATOM 890 CB VAL A 58 1.115 -7.832 -3.570 1.00 0.00 C ATOM 891 CG1 VAL A 58 0.098 -7.295 -4.565 1.00 0.00 C ATOM 892 CG2 VAL A 58 1.996 -6.712 -3.037 1.00 0.00 C ATOM 0 H VAL A 58 2.247 -9.389 -1.848 1.00 0.00 H new ATOM 0 HA VAL A 58 -0.228 -7.848 -1.880 1.00 0.00 H new ATOM 0 HB VAL A 58 1.752 -8.548 -4.089 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.617 -6.785 -5.377 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.486 -8.121 -4.970 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.567 -6.593 -4.062 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.489 -6.210 -3.869 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.382 -5.994 -2.492 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.748 -7.128 -2.367 1.00 0.00 H new ATOM 902 N GLU A 59 -1.756 -9.415 -3.095 1.00 0.00 N ATOM 903 CA GLU A 59 -2.690 -10.402 -3.625 1.00 0.00 C ATOM 904 C GLU A 59 -3.610 -9.775 -4.668 1.00 0.00 C ATOM 905 O GLU A 59 -4.647 -9.201 -4.333 1.00 0.00 O ATOM 906 CB GLU A 59 -3.523 -11.007 -2.493 1.00 0.00 C ATOM 907 CG GLU A 59 -2.838 -12.165 -1.785 1.00 0.00 C ATOM 908 CD GLU A 59 -1.803 -11.703 -0.778 1.00 0.00 C ATOM 909 OE1 GLU A 59 -1.980 -10.608 -0.204 1.00 0.00 O ATOM 910 OE2 GLU A 59 -0.815 -12.436 -0.565 1.00 0.00 O ATOM 0 H GLU A 59 -2.185 -8.529 -2.829 1.00 0.00 H new ATOM 0 HA GLU A 59 -2.111 -11.192 -4.104 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -3.749 -10.229 -1.764 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -4.475 -11.351 -2.898 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -3.589 -12.771 -1.277 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -2.359 -12.806 -2.525 1.00 0.00 H new ATOM 917 N MET A 60 -3.223 -9.888 -5.934 1.00 0.00 N ATOM 918 CA MET A 60 -4.013 -9.333 -7.027 1.00 0.00 C ATOM 919 C MET A 60 -5.022 -10.354 -7.542 1.00 0.00 C ATOM 920 O MET A 60 -5.365 -10.362 -8.724 1.00 0.00 O ATOM 921 CB MET A 60 -3.098 -8.883 -8.169 1.00 0.00 C ATOM 922 CG MET A 60 -2.588 -7.460 -8.013 1.00 0.00 C ATOM 923 SD MET A 60 -3.744 -6.233 -8.654 1.00 0.00 S ATOM 924 CE MET A 60 -4.896 -6.108 -7.288 1.00 0.00 C ATOM 0 H MET A 60 -2.367 -10.359 -6.229 1.00 0.00 H new ATOM 0 HA MET A 60 -4.558 -8.470 -6.646 1.00 0.00 H new ATOM 0 HB2 MET A 60 -2.247 -9.561 -8.230 1.00 0.00 H new ATOM 0 HB3 MET A 60 -3.639 -8.965 -9.111 1.00 0.00 H new ATOM 0 HG2 MET A 60 -2.399 -7.259 -6.958 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.635 -7.361 -8.532 1.00 0.00 H new ATOM 0 HE1 MET A 60 -5.446 -5.170 -7.361 1.00 0.00 H new ATOM 0 HE2 MET A 60 -5.596 -6.943 -7.325 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.348 -6.135 -6.346 1.00 0.00 H new ATOM 934 N HIS A 61 -5.495 -11.215 -6.646 1.00 0.00 N ATOM 935 CA HIS A 61 -6.467 -12.240 -7.010 1.00 0.00 C ATOM 936 C HIS A 61 -7.862 -11.866 -6.520 1.00 0.00 C ATOM 937 O HIS A 61 -8.847 -12.028 -7.238 1.00 0.00 O ATOM 938 CB HIS A 61 -6.054 -13.593 -6.427 1.00 0.00 C ATOM 939 CG HIS A 61 -7.181 -14.576 -6.342 1.00 0.00 C ATOM 940 ND1 HIS A 61 -8.113 -14.567 -5.327 1.00 0.00 N ATOM 941 CD2 HIS A 61 -7.522 -15.603 -7.155 1.00 0.00 C ATOM 942 CE1 HIS A 61 -8.979 -15.547 -5.518 1.00 0.00 C ATOM 943 NE2 HIS A 61 -8.643 -16.190 -6.621 1.00 0.00 N ATOM 0 H HIS A 61 -5.221 -11.223 -5.663 1.00 0.00 H new ATOM 0 HA HIS A 61 -6.492 -12.313 -8.097 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -5.259 -14.016 -7.040 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -5.640 -13.439 -5.430 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -7.008 -15.905 -8.056 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -9.818 -15.782 -4.880 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -9.136 -16.992 -7.013 1.00 0.00 H new ATOM 952 N ASN A 62 -7.937 -11.364 -5.291 1.00 0.00 N ATOM 953 CA ASN A 62 -9.212 -10.968 -4.704 1.00 0.00 C ATOM 954 C ASN A 62 -9.525 -9.508 -5.018 1.00 0.00 C ATOM 955 O ASN A 62 -10.672 -9.154 -5.292 1.00 0.00 O ATOM 956 CB ASN A 62 -9.189 -11.182 -3.189 1.00 0.00 C ATOM 957 CG ASN A 62 -8.153 -10.316 -2.499 1.00 0.00 C ATOM 958 OD1 ASN A 62 -8.407 -9.151 -2.191 1.00 0.00 O ATOM 959 ND2 ASN A 62 -6.977 -10.882 -2.254 1.00 0.00 N ATOM 0 H ASN A 62 -7.130 -11.222 -4.683 1.00 0.00 H new ATOM 0 HA ASN A 62 -9.993 -11.591 -5.140 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -10.174 -10.962 -2.779 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -8.982 -12.231 -2.976 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.240 -10.348 -1.793 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.810 -11.851 -2.527 1.00 0.00 H new ATOM 966 N TYR A 63 -8.499 -8.667 -4.977 1.00 0.00 N ATOM 967 CA TYR A 63 -8.664 -7.245 -5.255 1.00 0.00 C ATOM 968 C TYR A 63 -9.027 -7.015 -6.718 1.00 0.00 C ATOM 969 O TYR A 63 -8.620 -7.773 -7.598 1.00 0.00 O ATOM 970 CB TYR A 63 -7.382 -6.484 -4.911 1.00 0.00 C ATOM 971 CG TYR A 63 -6.933 -6.671 -3.479 1.00 0.00 C ATOM 972 CD1 TYR A 63 -7.852 -6.670 -2.436 1.00 0.00 C ATOM 973 CD2 TYR A 63 -5.591 -6.848 -3.168 1.00 0.00 C ATOM 974 CE1 TYR A 63 -7.446 -6.840 -1.127 1.00 0.00 C ATOM 975 CE2 TYR A 63 -5.176 -7.019 -1.862 1.00 0.00 C ATOM 976 CZ TYR A 63 -6.108 -7.013 -0.844 1.00 0.00 C ATOM 977 OH TYR A 63 -5.700 -7.184 0.459 1.00 0.00 O ATOM 0 H TYR A 63 -7.543 -8.945 -4.754 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.478 -6.872 -4.634 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.585 -6.811 -5.579 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.539 -5.422 -5.098 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -8.901 -6.534 -2.653 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -4.859 -6.852 -3.962 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.173 -6.837 -0.329 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.128 -7.157 -1.639 1.00 0.00 H new ATOM 0 HH TYR A 63 -4.800 -7.573 0.472 1.00 0.00 H new ATOM 987 N VAL A 64 -9.798 -5.962 -6.972 1.00 0.00 N ATOM 988 CA VAL A 64 -10.216 -5.629 -8.328 1.00 0.00 C ATOM 989 C VAL A 64 -10.349 -4.121 -8.507 1.00 0.00 C ATOM 990 O VAL A 64 -10.962 -3.426 -7.696 1.00 0.00 O ATOM 991 CB VAL A 64 -11.558 -6.297 -8.682 1.00 0.00 C ATOM 992 CG1 VAL A 64 -12.212 -5.592 -9.860 1.00 0.00 C ATOM 993 CG2 VAL A 64 -11.354 -7.775 -8.980 1.00 0.00 C ATOM 0 H VAL A 64 -10.146 -5.325 -6.255 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.443 -6.005 -8.999 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.225 -6.211 -7.824 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -13.159 -6.078 -10.095 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -12.394 -4.548 -9.604 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.553 -5.643 -10.726 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -12.312 -8.232 -9.228 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.670 -7.885 -9.822 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.933 -8.268 -8.104 1.00 0.00 H new ATOM 1003 N PRO A 65 -9.763 -3.600 -9.596 1.00 0.00 N ATOM 1004 CA PRO A 65 -9.803 -2.169 -9.908 1.00 0.00 C ATOM 1005 C PRO A 65 -11.197 -1.703 -10.316 1.00 0.00 C ATOM 1006 O PRO A 65 -11.811 -2.271 -11.219 1.00 0.00 O ATOM 1007 CB PRO A 65 -8.829 -2.034 -11.082 1.00 0.00 C ATOM 1008 CG PRO A 65 -8.818 -3.380 -11.720 1.00 0.00 C ATOM 1009 CD PRO A 65 -9.016 -4.369 -10.605 1.00 0.00 C ATOM 0 HA PRO A 65 -9.540 -1.557 -9.046 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -9.157 -1.266 -11.783 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -7.834 -1.749 -10.740 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -9.611 -3.466 -12.463 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -7.875 -3.559 -12.237 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -9.575 -5.244 -10.938 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -8.065 -4.729 -10.213 1.00 0.00 H new ATOM 1017 N ALA A 66 -11.689 -0.666 -9.646 1.00 0.00 N ATOM 1018 CA ALA A 66 -13.009 -0.124 -9.941 1.00 0.00 C ATOM 1019 C ALA A 66 -13.022 1.395 -9.800 1.00 0.00 C ATOM 1020 O ALA A 66 -12.034 1.997 -9.384 1.00 0.00 O ATOM 1021 CB ALA A 66 -14.053 -0.749 -9.028 1.00 0.00 C ATOM 0 H ALA A 66 -11.193 -0.185 -8.896 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.253 -0.370 -10.975 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.034 -0.335 -9.260 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -14.070 -1.828 -9.180 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -13.804 -0.533 -7.989 1.00 0.00 H new ATOM 1027 N ASN A 67 -14.149 2.007 -10.150 1.00 0.00 N ATOM 1028 CA ASN A 67 -14.290 3.456 -10.063 1.00 0.00 C ATOM 1029 C ASN A 67 -15.526 3.835 -9.253 1.00 0.00 C ATOM 1030 O ASN A 67 -16.032 4.952 -9.359 1.00 0.00 O ATOM 1031 CB ASN A 67 -14.378 4.066 -11.464 1.00 0.00 C ATOM 1032 CG ASN A 67 -15.514 3.479 -12.279 1.00 0.00 C ATOM 1033 OD1 ASN A 67 -16.402 2.817 -11.741 1.00 0.00 O ATOM 1034 ND2 ASN A 67 -15.490 3.718 -13.585 1.00 0.00 N ATOM 0 H ASN A 67 -14.977 1.522 -10.496 1.00 0.00 H new ATOM 0 HA ASN A 67 -13.410 3.852 -9.556 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -14.514 5.144 -11.380 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -13.436 3.903 -11.988 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -16.227 3.348 -14.185 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -14.734 4.272 -13.988 1.00 0.00 H new ATOM 1041 N SER A 68 -16.006 2.897 -8.443 1.00 0.00 N ATOM 1042 CA SER A 68 -17.185 3.131 -7.617 1.00 0.00 C ATOM 1043 C SER A 68 -16.839 3.022 -6.135 1.00 0.00 C ATOM 1044 O SER A 68 -16.075 2.147 -5.726 1.00 0.00 O ATOM 1045 CB SER A 68 -18.288 2.131 -7.970 1.00 0.00 C ATOM 1046 OG SER A 68 -18.951 2.503 -9.165 1.00 0.00 O ATOM 0 H SER A 68 -15.597 1.968 -8.341 1.00 0.00 H new ATOM 0 HA SER A 68 -17.544 4.141 -7.816 1.00 0.00 H new ATOM 0 HB2 SER A 68 -17.858 1.136 -8.084 1.00 0.00 H new ATOM 0 HB3 SER A 68 -19.008 2.076 -7.153 1.00 0.00 H new ATOM 0 HG SER A 68 -19.650 1.847 -9.369 1.00 0.00 H new ATOM 1052 N LEU A 69 -17.407 3.917 -5.335 1.00 0.00 N ATOM 1053 CA LEU A 69 -17.161 3.924 -3.897 1.00 0.00 C ATOM 1054 C LEU A 69 -17.316 2.524 -3.311 1.00 0.00 C ATOM 1055 O LEU A 69 -16.331 1.877 -2.956 1.00 0.00 O ATOM 1056 CB LEU A 69 -18.120 4.890 -3.199 1.00 0.00 C ATOM 1057 CG LEU A 69 -17.786 6.376 -3.328 1.00 0.00 C ATOM 1058 CD1 LEU A 69 -16.447 6.681 -2.675 1.00 0.00 C ATOM 1059 CD2 LEU A 69 -17.777 6.796 -4.790 1.00 0.00 C ATOM 0 H LEU A 69 -18.041 4.648 -5.658 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.136 4.256 -3.731 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -19.122 4.727 -3.597 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.153 4.636 -2.140 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.557 6.948 -2.812 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -16.226 7.744 -2.777 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -16.490 6.419 -1.618 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -15.664 6.099 -3.162 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.537 7.857 -4.862 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -17.028 6.217 -5.330 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.759 6.615 -5.227 1.00 0.00 H new ATOM 1071 N GLN A 70 -18.559 2.062 -3.216 1.00 0.00 N ATOM 1072 CA GLN A 70 -18.842 0.738 -2.675 1.00 0.00 C ATOM 1073 C GLN A 70 -17.738 -0.248 -3.043 1.00 0.00 C ATOM 1074 O GLN A 70 -17.224 -0.966 -2.186 1.00 0.00 O ATOM 1075 CB GLN A 70 -20.189 0.230 -3.192 1.00 0.00 C ATOM 1076 CG GLN A 70 -20.218 0.007 -4.695 1.00 0.00 C ATOM 1077 CD GLN A 70 -21.612 -0.287 -5.214 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -21.880 -1.375 -5.725 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -22.509 0.684 -5.086 1.00 0.00 N ATOM 0 H GLN A 70 -19.385 2.585 -3.506 1.00 0.00 H new ATOM 0 HA GLN A 70 -18.885 0.819 -1.589 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -20.432 -0.706 -2.689 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -20.965 0.947 -2.924 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -19.826 0.891 -5.197 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -19.558 -0.822 -4.948 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -22.244 1.570 -4.656 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -23.463 0.544 -5.417 1.00 0.00 H new ATOM 1088 N GLN A 71 -17.379 -0.276 -4.322 1.00 0.00 N ATOM 1089 CA GLN A 71 -16.337 -1.175 -4.803 1.00 0.00 C ATOM 1090 C GLN A 71 -15.017 -0.911 -4.086 1.00 0.00 C ATOM 1091 O GLN A 71 -14.366 -1.836 -3.600 1.00 0.00 O ATOM 1092 CB GLN A 71 -16.152 -1.014 -6.313 1.00 0.00 C ATOM 1093 CG GLN A 71 -15.633 -2.268 -6.999 1.00 0.00 C ATOM 1094 CD GLN A 71 -16.319 -3.528 -6.510 1.00 0.00 C ATOM 1095 OE1 GLN A 71 -17.510 -3.732 -6.748 1.00 0.00 O ATOM 1096 NE2 GLN A 71 -15.570 -4.382 -5.823 1.00 0.00 N ATOM 0 H GLN A 71 -17.794 0.313 -5.044 1.00 0.00 H new ATOM 0 HA GLN A 71 -16.647 -2.198 -4.589 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.106 -0.734 -6.760 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -15.459 -0.194 -6.500 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -15.778 -2.175 -8.075 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -14.560 -2.353 -6.828 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.587 -4.173 -5.649 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.978 -5.248 -5.469 1.00 0.00 H new ATOM 1105 N LYS A 72 -14.626 0.358 -4.025 1.00 0.00 N ATOM 1106 CA LYS A 72 -13.384 0.745 -3.367 1.00 0.00 C ATOM 1107 C LYS A 72 -13.366 0.272 -1.917 1.00 0.00 C ATOM 1108 O LYS A 72 -12.479 -0.480 -1.510 1.00 0.00 O ATOM 1109 CB LYS A 72 -13.207 2.264 -3.421 1.00 0.00 C ATOM 1110 CG LYS A 72 -13.144 2.820 -4.833 1.00 0.00 C ATOM 1111 CD LYS A 72 -11.742 2.717 -5.411 1.00 0.00 C ATOM 1112 CE LYS A 72 -11.726 3.046 -6.896 1.00 0.00 C ATOM 1113 NZ LYS A 72 -11.598 4.510 -7.138 1.00 0.00 N ATOM 0 H LYS A 72 -15.152 1.136 -4.424 1.00 0.00 H new ATOM 0 HA LYS A 72 -12.558 0.269 -3.896 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.033 2.737 -2.890 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -12.293 2.534 -2.892 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -13.842 2.277 -5.470 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -13.461 3.863 -4.829 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -11.077 3.398 -4.879 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -11.357 1.709 -5.256 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -10.897 2.525 -7.375 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -12.642 2.680 -7.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -11.591 4.693 -8.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -12.402 5.005 -6.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -10.711 4.855 -6.718 1.00 0.00 H new ATOM 1127 N LEU A 73 -14.350 0.715 -1.142 1.00 0.00 N ATOM 1128 CA LEU A 73 -14.448 0.335 0.263 1.00 0.00 C ATOM 1129 C LEU A 73 -14.400 -1.182 0.421 1.00 0.00 C ATOM 1130 O LEU A 73 -13.739 -1.701 1.320 1.00 0.00 O ATOM 1131 CB LEU A 73 -15.740 0.882 0.870 1.00 0.00 C ATOM 1132 CG LEU A 73 -15.746 2.375 1.203 1.00 0.00 C ATOM 1133 CD1 LEU A 73 -17.118 2.806 1.697 1.00 0.00 C ATOM 1134 CD2 LEU A 73 -14.679 2.695 2.239 1.00 0.00 C ATOM 0 H LEU A 73 -15.091 1.338 -1.463 1.00 0.00 H new ATOM 0 HA LEU A 73 -13.596 0.764 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.557 0.682 0.177 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.953 0.326 1.783 1.00 0.00 H new ATOM 0 HG LEU A 73 -15.519 2.931 0.294 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -17.103 3.871 1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.861 2.614 0.923 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -17.375 2.243 2.594 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.698 3.761 2.463 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.875 2.129 3.150 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.699 2.424 1.847 1.00 0.00 H new ATOM 1146 N SER A 74 -15.104 -1.886 -0.459 1.00 0.00 N ATOM 1147 CA SER A 74 -15.143 -3.343 -0.416 1.00 0.00 C ATOM 1148 C SER A 74 -13.733 -3.925 -0.415 1.00 0.00 C ATOM 1149 O SER A 74 -13.404 -4.782 0.403 1.00 0.00 O ATOM 1150 CB SER A 74 -15.932 -3.889 -1.608 1.00 0.00 C ATOM 1151 OG SER A 74 -16.327 -5.232 -1.387 1.00 0.00 O ATOM 0 H SER A 74 -15.655 -1.471 -1.210 1.00 0.00 H new ATOM 0 HA SER A 74 -15.641 -3.641 0.507 1.00 0.00 H new ATOM 0 HB2 SER A 74 -16.813 -3.271 -1.778 1.00 0.00 H new ATOM 0 HB3 SER A 74 -15.322 -3.830 -2.509 1.00 0.00 H new ATOM 0 HG SER A 74 -16.831 -5.557 -2.162 1.00 0.00 H new ATOM 1157 N ASN A 75 -12.904 -3.452 -1.341 1.00 0.00 N ATOM 1158 CA ASN A 75 -11.529 -3.925 -1.448 1.00 0.00 C ATOM 1159 C ASN A 75 -10.726 -3.552 -0.206 1.00 0.00 C ATOM 1160 O ASN A 75 -10.183 -4.419 0.478 1.00 0.00 O ATOM 1161 CB ASN A 75 -10.862 -3.339 -2.695 1.00 0.00 C ATOM 1162 CG ASN A 75 -11.334 -4.007 -3.972 1.00 0.00 C ATOM 1163 OD1 ASN A 75 -11.414 -5.233 -4.050 1.00 0.00 O ATOM 1164 ND2 ASN A 75 -11.650 -3.202 -4.979 1.00 0.00 N ATOM 0 H ASN A 75 -13.161 -2.742 -2.027 1.00 0.00 H new ATOM 0 HA ASN A 75 -11.551 -5.012 -1.531 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -11.072 -2.271 -2.748 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -9.781 -3.447 -2.610 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.975 -3.594 -5.863 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -11.568 -2.191 -4.869 1.00 0.00 H new ATOM 1171 N TRP A 76 -10.658 -2.257 0.080 1.00 0.00 N ATOM 1172 CA TRP A 76 -9.922 -1.769 1.241 1.00 0.00 C ATOM 1173 C TRP A 76 -10.188 -2.643 2.462 1.00 0.00 C ATOM 1174 O TRP A 76 -9.258 -3.109 3.118 1.00 0.00 O ATOM 1175 CB TRP A 76 -10.308 -0.319 1.543 1.00 0.00 C ATOM 1176 CG TRP A 76 -9.477 0.683 0.801 1.00 0.00 C ATOM 1177 CD1 TRP A 76 -9.806 1.322 -0.360 1.00 0.00 C ATOM 1178 CD2 TRP A 76 -8.178 1.160 1.169 1.00 0.00 C ATOM 1179 NE1 TRP A 76 -8.790 2.167 -0.736 1.00 0.00 N ATOM 1180 CE2 TRP A 76 -7.780 2.087 0.186 1.00 0.00 C ATOM 1181 CE3 TRP A 76 -7.313 0.896 2.235 1.00 0.00 C ATOM 1182 CZ2 TRP A 76 -6.555 2.747 0.238 1.00 0.00 C ATOM 1183 CZ3 TRP A 76 -6.098 1.552 2.285 1.00 0.00 C ATOM 1184 CH2 TRP A 76 -5.728 2.469 1.292 1.00 0.00 C ATOM 0 H TRP A 76 -11.103 -1.526 -0.475 1.00 0.00 H new ATOM 0 HA TRP A 76 -8.858 -1.814 1.010 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -11.357 -0.169 1.289 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -10.210 -0.140 2.614 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -10.729 1.184 -0.903 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -8.788 2.758 -1.567 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -7.590 0.192 3.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -6.268 3.453 -0.527 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -5.422 1.355 3.104 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -4.772 2.966 1.360 1.00 0.00 H new ATOM 1195 N GLY A 77 -11.466 -2.862 2.760 1.00 0.00 N ATOM 1196 CA GLY A 77 -11.831 -3.681 3.902 1.00 0.00 C ATOM 1197 C GLY A 77 -11.001 -4.945 3.997 1.00 0.00 C ATOM 1198 O GLY A 77 -10.548 -5.319 5.080 1.00 0.00 O ATOM 0 H GLY A 77 -12.254 -2.487 2.232 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -11.708 -3.100 4.816 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.886 -3.947 3.832 1.00 0.00 H new ATOM 1202 N HIS A 78 -10.801 -5.608 2.862 1.00 0.00 N ATOM 1203 CA HIS A 78 -10.020 -6.839 2.823 1.00 0.00 C ATOM 1204 C HIS A 78 -8.555 -6.564 3.147 1.00 0.00 C ATOM 1205 O HIS A 78 -7.938 -7.280 3.936 1.00 0.00 O ATOM 1206 CB HIS A 78 -10.136 -7.497 1.448 1.00 0.00 C ATOM 1207 CG HIS A 78 -11.447 -8.185 1.221 1.00 0.00 C ATOM 1208 ND1 HIS A 78 -11.932 -8.484 -0.034 1.00 0.00 N ATOM 1209 CD2 HIS A 78 -12.375 -8.633 2.099 1.00 0.00 C ATOM 1210 CE1 HIS A 78 -13.103 -9.086 0.081 1.00 0.00 C ATOM 1211 NE2 HIS A 78 -13.394 -9.189 1.365 1.00 0.00 N ATOM 0 H HIS A 78 -11.169 -5.313 1.958 1.00 0.00 H new ATOM 0 HA HIS A 78 -10.419 -7.517 3.577 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -9.995 -6.738 0.678 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -9.330 -8.222 1.332 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -12.324 -8.566 3.176 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -13.717 -9.434 -0.736 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -14.239 -9.613 1.749 1.00 0.00 H new ATOM 1220 N LEU A 79 -8.004 -5.523 2.533 1.00 0.00 N ATOM 1221 CA LEU A 79 -6.610 -5.154 2.755 1.00 0.00 C ATOM 1222 C LEU A 79 -6.353 -4.859 4.229 1.00 0.00 C ATOM 1223 O LEU A 79 -5.217 -4.921 4.696 1.00 0.00 O ATOM 1224 CB LEU A 79 -6.244 -3.933 1.908 1.00 0.00 C ATOM 1225 CG LEU A 79 -4.755 -3.740 1.618 1.00 0.00 C ATOM 1226 CD1 LEU A 79 -4.348 -4.517 0.376 1.00 0.00 C ATOM 1227 CD2 LEU A 79 -4.432 -2.262 1.455 1.00 0.00 C ATOM 0 H LEU A 79 -8.501 -4.920 1.878 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.985 -5.996 2.457 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.773 -4.003 0.957 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.614 -3.041 2.413 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.186 -4.125 2.464 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.285 -4.368 0.185 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.543 -5.578 0.530 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -4.923 -4.163 -0.479 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.368 -2.143 1.249 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.010 -1.852 0.627 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.686 -1.731 2.372 1.00 0.00 H new ATOM 1239 N ASN A 80 -7.418 -4.540 4.958 1.00 0.00 N ATOM 1240 CA ASN A 80 -7.309 -4.238 6.380 1.00 0.00 C ATOM 1241 C ASN A 80 -7.099 -5.512 7.193 1.00 0.00 C ATOM 1242 O ASN A 80 -6.477 -5.487 8.255 1.00 0.00 O ATOM 1243 CB ASN A 80 -8.564 -3.510 6.867 1.00 0.00 C ATOM 1244 CG ASN A 80 -8.336 -2.774 8.173 1.00 0.00 C ATOM 1245 OD1 ASN A 80 -7.758 -3.320 9.113 1.00 0.00 O ATOM 1246 ND2 ASN A 80 -8.790 -1.528 8.236 1.00 0.00 N ATOM 0 H ASN A 80 -8.366 -4.484 4.587 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.444 -3.591 6.522 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -8.888 -2.801 6.105 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -9.372 -4.231 6.996 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -8.666 -0.982 9.089 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -9.263 -1.116 7.432 1.00 0.00 H new ATOM 1253 N ARG A 81 -7.621 -6.624 6.685 1.00 0.00 N ATOM 1254 CA ARG A 81 -7.491 -7.907 7.364 1.00 0.00 C ATOM 1255 C ARG A 81 -6.552 -8.835 6.597 1.00 0.00 C ATOM 1256 O ARG A 81 -6.367 -9.994 6.969 1.00 0.00 O ATOM 1257 CB ARG A 81 -8.863 -8.567 7.519 1.00 0.00 C ATOM 1258 CG ARG A 81 -9.748 -7.896 8.556 1.00 0.00 C ATOM 1259 CD ARG A 81 -10.860 -8.822 9.023 1.00 0.00 C ATOM 1260 NE ARG A 81 -11.964 -8.875 8.069 1.00 0.00 N ATOM 1261 CZ ARG A 81 -13.172 -9.341 8.368 1.00 0.00 C ATOM 1262 NH1 ARG A 81 -13.429 -9.792 9.588 1.00 0.00 N ATOM 1263 NH2 ARG A 81 -14.125 -9.357 7.445 1.00 0.00 N ATOM 0 H ARG A 81 -8.137 -6.662 5.806 1.00 0.00 H new ATOM 0 HA ARG A 81 -7.068 -7.726 8.352 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.373 -8.555 6.556 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.725 -9.613 7.794 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -9.143 -7.592 9.410 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.181 -6.989 8.134 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -10.459 -9.825 9.170 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -11.232 -8.483 9.990 1.00 0.00 H new ATOM 0 HE ARG A 81 -11.799 -8.536 7.121 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -12.699 -9.782 10.300 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -14.357 -10.149 9.815 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -13.931 -9.011 6.505 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -15.052 -9.715 7.675 1.00 0.00 H new ATOM 1277 N LYS A 82 -5.963 -8.317 5.525 1.00 0.00 N ATOM 1278 CA LYS A 82 -5.042 -9.097 4.706 1.00 0.00 C ATOM 1279 C LYS A 82 -3.633 -8.518 4.770 1.00 0.00 C ATOM 1280 O LYS A 82 -2.647 -9.255 4.759 1.00 0.00 O ATOM 1281 CB LYS A 82 -5.525 -9.133 3.254 1.00 0.00 C ATOM 1282 CG LYS A 82 -6.855 -9.845 3.073 1.00 0.00 C ATOM 1283 CD LYS A 82 -6.722 -11.341 3.305 1.00 0.00 C ATOM 1284 CE LYS A 82 -8.008 -11.934 3.862 1.00 0.00 C ATOM 1285 NZ LYS A 82 -8.919 -12.399 2.780 1.00 0.00 N ATOM 0 H LYS A 82 -6.107 -7.360 5.203 1.00 0.00 H new ATOM 0 HA LYS A 82 -5.016 -10.113 5.100 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.616 -8.112 2.885 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.771 -9.628 2.641 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -7.587 -9.432 3.767 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.232 -9.664 2.066 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.468 -11.835 2.367 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.902 -11.532 3.997 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -7.768 -12.770 4.519 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -8.518 -11.187 4.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -9.783 -12.796 3.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -9.169 -11.596 2.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -8.442 -13.130 2.215 1.00 0.00 H new ATOM 1299 N VAL A 83 -3.545 -7.193 4.837 1.00 0.00 N ATOM 1300 CA VAL A 83 -2.256 -6.515 4.905 1.00 0.00 C ATOM 1301 C VAL A 83 -2.014 -5.931 6.293 1.00 0.00 C ATOM 1302 O VAL A 83 -1.220 -6.461 7.072 1.00 0.00 O ATOM 1303 CB VAL A 83 -2.159 -5.387 3.862 1.00 0.00 C ATOM 1304 CG1 VAL A 83 -0.929 -4.529 4.115 1.00 0.00 C ATOM 1305 CG2 VAL A 83 -2.136 -5.964 2.454 1.00 0.00 C ATOM 0 H VAL A 83 -4.351 -6.568 4.846 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.494 -7.264 4.691 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.040 -4.753 3.956 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.878 -3.737 3.368 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.992 -4.086 5.109 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.034 -5.148 4.050 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.067 -5.153 1.729 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.274 -6.622 2.345 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.050 -6.531 2.278 1.00 0.00 H new ATOM 1315 N LEU A 84 -2.705 -4.838 6.596 1.00 0.00 N ATOM 1316 CA LEU A 84 -2.566 -4.181 7.892 1.00 0.00 C ATOM 1317 C LEU A 84 -2.381 -5.206 9.005 1.00 0.00 C ATOM 1318 O LEU A 84 -1.383 -5.184 9.725 1.00 0.00 O ATOM 1319 CB LEU A 84 -3.794 -3.314 8.179 1.00 0.00 C ATOM 1320 CG LEU A 84 -4.170 -2.303 7.096 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -5.434 -1.550 7.485 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -3.024 -1.333 6.850 1.00 0.00 C ATOM 0 H LEU A 84 -3.366 -4.388 5.963 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.680 -3.547 7.858 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.647 -3.972 8.346 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.622 -2.773 9.109 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.364 -2.846 6.171 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.687 -0.835 6.702 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.255 -2.257 7.610 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.267 -1.019 8.422 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.310 -0.621 6.076 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.798 -0.796 7.771 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.142 -1.886 6.526 1.00 0.00 H new ATOM 1334 N LYS A 85 -3.349 -6.106 9.141 1.00 0.00 N ATOM 1335 CA LYS A 85 -3.293 -7.144 10.164 1.00 0.00 C ATOM 1336 C LYS A 85 -1.863 -7.637 10.361 1.00 0.00 C ATOM 1337 O LYS A 85 -1.330 -7.598 11.470 1.00 0.00 O ATOM 1338 CB LYS A 85 -4.200 -8.316 9.782 1.00 0.00 C ATOM 1339 CG LYS A 85 -4.648 -9.150 10.969 1.00 0.00 C ATOM 1340 CD LYS A 85 -5.746 -8.454 11.757 1.00 0.00 C ATOM 1341 CE LYS A 85 -6.049 -9.185 13.056 1.00 0.00 C ATOM 1342 NZ LYS A 85 -7.136 -8.519 13.826 1.00 0.00 N ATOM 0 H LYS A 85 -4.183 -6.138 8.555 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.643 -6.713 11.102 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.080 -7.931 9.267 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -3.673 -8.958 9.076 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -5.007 -10.118 10.620 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.797 -9.342 11.622 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.444 -7.430 11.976 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.650 -8.397 11.151 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.337 -10.213 12.836 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.147 -9.231 13.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.313 -9.047 14.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.851 -7.546 14.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -8.004 -8.498 13.254 1.00 0.00 H new ATOM 1356 N ARG A 86 -1.247 -8.099 9.277 1.00 0.00 N ATOM 1357 CA ARG A 86 0.122 -8.599 9.332 1.00 0.00 C ATOM 1358 C ARG A 86 1.075 -7.521 9.839 1.00 0.00 C ATOM 1359 O ARG A 86 2.035 -7.812 10.554 1.00 0.00 O ATOM 1360 CB ARG A 86 0.567 -9.078 7.949 1.00 0.00 C ATOM 1361 CG ARG A 86 -0.307 -10.182 7.377 1.00 0.00 C ATOM 1362 CD ARG A 86 0.059 -11.540 7.956 1.00 0.00 C ATOM 1363 NE ARG A 86 -0.644 -11.808 9.208 1.00 0.00 N ATOM 1364 CZ ARG A 86 -1.902 -12.231 9.268 1.00 0.00 C ATOM 1365 NH1 ARG A 86 -2.591 -12.432 8.153 1.00 0.00 N ATOM 1366 NH2 ARG A 86 -2.473 -12.453 10.445 1.00 0.00 N ATOM 0 H ARG A 86 -1.674 -8.137 8.351 1.00 0.00 H new ATOM 0 HA ARG A 86 0.148 -9.438 10.027 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.564 -8.231 7.262 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.595 -9.435 8.011 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.354 -9.965 7.589 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.200 -10.207 6.293 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -0.180 -12.319 7.232 1.00 0.00 H new ATOM 0 HD3 ARG A 86 1.135 -11.583 8.128 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.142 -11.662 10.084 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -2.155 -12.262 7.247 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -3.557 -12.757 8.202 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.946 -12.299 11.305 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -3.439 -12.778 10.490 1.00 0.00 H new ATOM 1380 N LEU A 87 0.804 -6.275 9.465 1.00 0.00 N ATOM 1381 CA LEU A 87 1.637 -5.153 9.882 1.00 0.00 C ATOM 1382 C LEU A 87 1.187 -4.614 11.236 1.00 0.00 C ATOM 1383 O LEU A 87 1.374 -3.436 11.540 1.00 0.00 O ATOM 1384 CB LEU A 87 1.587 -4.038 8.835 1.00 0.00 C ATOM 1385 CG LEU A 87 2.184 -4.375 7.468 1.00 0.00 C ATOM 1386 CD1 LEU A 87 1.617 -3.455 6.397 1.00 0.00 C ATOM 1387 CD2 LEU A 87 3.702 -4.275 7.510 1.00 0.00 C ATOM 0 H LEU A 87 0.014 -6.017 8.874 1.00 0.00 H new ATOM 0 HA LEU A 87 2.663 -5.510 9.976 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.546 -3.746 8.693 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.110 -3.169 9.234 1.00 0.00 H new ATOM 0 HG LEU A 87 1.914 -5.401 7.217 1.00 0.00 H new ATOM 0 HD11 LEU A 87 2.053 -3.709 5.431 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.535 -3.575 6.350 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.857 -2.420 6.642 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.110 -4.518 6.529 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.992 -3.260 7.782 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.092 -4.975 8.249 1.00 0.00 H new ATOM 1399 N ASN A 88 0.597 -5.485 12.048 1.00 0.00 N ATOM 1400 CA ASN A 88 0.122 -5.098 13.371 1.00 0.00 C ATOM 1401 C ASN A 88 -0.495 -3.703 13.340 1.00 0.00 C ATOM 1402 O ASN A 88 -0.381 -2.940 14.301 1.00 0.00 O ATOM 1403 CB ASN A 88 1.272 -5.137 14.380 1.00 0.00 C ATOM 1404 CG ASN A 88 0.786 -5.329 15.803 1.00 0.00 C ATOM 1405 OD1 ASN A 88 0.667 -4.369 16.565 1.00 0.00 O ATOM 1406 ND2 ASN A 88 0.502 -6.573 16.169 1.00 0.00 N ATOM 0 H ASN A 88 0.436 -6.464 11.813 1.00 0.00 H new ATOM 0 HA ASN A 88 -0.645 -5.809 13.677 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.953 -5.947 14.119 1.00 0.00 H new ATOM 0 HB3 ASN A 88 1.840 -4.209 14.315 1.00 0.00 H new ATOM 0 HD21 ASN A 88 0.170 -6.763 17.115 1.00 0.00 H new ATOM 0 HD22 ASN A 88 0.615 -7.339 15.505 1.00 0.00 H new ATOM 1413 N PHE A 89 -1.149 -3.375 12.231 1.00 0.00 N ATOM 1414 CA PHE A 89 -1.784 -2.072 12.075 1.00 0.00 C ATOM 1415 C PHE A 89 -3.303 -2.193 12.158 1.00 0.00 C ATOM 1416 O PHE A 89 -3.852 -3.294 12.112 1.00 0.00 O ATOM 1417 CB PHE A 89 -1.384 -1.443 10.738 1.00 0.00 C ATOM 1418 CG PHE A 89 -1.380 0.059 10.759 1.00 0.00 C ATOM 1419 CD1 PHE A 89 -0.371 0.752 11.408 1.00 0.00 C ATOM 1420 CD2 PHE A 89 -2.385 0.777 10.131 1.00 0.00 C ATOM 1421 CE1 PHE A 89 -0.363 2.135 11.429 1.00 0.00 C ATOM 1422 CE2 PHE A 89 -2.382 2.159 10.149 1.00 0.00 C ATOM 1423 CZ PHE A 89 -1.371 2.838 10.799 1.00 0.00 C ATOM 0 H PHE A 89 -1.253 -3.994 11.427 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.443 -1.430 12.888 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.391 -1.797 10.462 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.071 -1.786 9.964 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.418 0.206 11.903 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.179 0.251 9.622 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.430 2.664 11.937 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.170 2.707 9.655 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.368 3.918 10.815 1.00 0.00 H new ATOM 1433 N SER A 90 -3.976 -1.053 12.283 1.00 0.00 N ATOM 1434 CA SER A 90 -5.430 -1.031 12.378 1.00 0.00 C ATOM 1435 C SER A 90 -5.983 0.319 11.932 1.00 0.00 C ATOM 1436 O SER A 90 -5.402 1.366 12.217 1.00 0.00 O ATOM 1437 CB SER A 90 -5.874 -1.328 13.812 1.00 0.00 C ATOM 1438 OG SER A 90 -5.682 -0.200 14.649 1.00 0.00 O ATOM 0 H SER A 90 -3.537 -0.133 12.321 1.00 0.00 H new ATOM 0 HA SER A 90 -5.824 -1.802 11.716 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.926 -1.615 13.818 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.310 -2.175 14.203 1.00 0.00 H new ATOM 0 HG SER A 90 -5.975 -0.415 15.559 1.00 0.00 H new ATOM 1444 N VAL A 91 -7.111 0.287 11.229 1.00 0.00 N ATOM 1445 CA VAL A 91 -7.745 1.507 10.743 1.00 0.00 C ATOM 1446 C VAL A 91 -9.264 1.407 10.826 1.00 0.00 C ATOM 1447 O VAL A 91 -9.871 0.426 10.397 1.00 0.00 O ATOM 1448 CB VAL A 91 -7.339 1.809 9.288 1.00 0.00 C ATOM 1449 CG1 VAL A 91 -8.325 2.775 8.649 1.00 0.00 C ATOM 1450 CG2 VAL A 91 -5.924 2.365 9.235 1.00 0.00 C ATOM 0 H VAL A 91 -7.605 -0.571 10.983 1.00 0.00 H new ATOM 0 HA VAL A 91 -7.402 2.319 11.384 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.360 0.878 8.721 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.022 2.977 7.621 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -9.322 2.334 8.654 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.338 3.707 9.213 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.653 2.573 8.200 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.873 3.286 9.815 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.230 1.635 9.652 1.00 0.00 H new ATOM 1460 N PRO A 92 -9.895 2.448 11.389 1.00 0.00 N ATOM 1461 CA PRO A 92 -11.352 2.503 11.540 1.00 0.00 C ATOM 1462 C PRO A 92 -12.068 2.667 10.204 1.00 0.00 C ATOM 1463 O PRO A 92 -11.471 3.099 9.218 1.00 0.00 O ATOM 1464 CB PRO A 92 -11.571 3.737 12.419 1.00 0.00 C ATOM 1465 CG PRO A 92 -10.379 4.595 12.172 1.00 0.00 C ATOM 1466 CD PRO A 92 -9.235 3.652 11.922 1.00 0.00 C ATOM 0 HA PRO A 92 -11.752 1.583 11.965 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.493 4.254 12.153 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.651 3.464 13.471 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -10.540 5.249 11.315 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -10.176 5.237 13.029 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.521 4.067 11.211 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.685 3.436 12.838 1.00 0.00 H new ATOM 1474 N ASP A 93 -13.350 2.319 10.178 1.00 0.00 N ATOM 1475 CA ASP A 93 -14.148 2.429 8.962 1.00 0.00 C ATOM 1476 C ASP A 93 -14.264 3.884 8.518 1.00 0.00 C ATOM 1477 O ASP A 93 -14.267 4.180 7.323 1.00 0.00 O ATOM 1478 CB ASP A 93 -15.541 1.839 9.186 1.00 0.00 C ATOM 1479 CG ASP A 93 -15.493 0.482 9.861 1.00 0.00 C ATOM 1480 OD1 ASP A 93 -15.140 -0.506 9.183 1.00 0.00 O ATOM 1481 OD2 ASP A 93 -15.808 0.408 11.067 1.00 0.00 O ATOM 0 H ASP A 93 -13.859 1.958 10.985 1.00 0.00 H new ATOM 0 HA ASP A 93 -13.646 1.867 8.175 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -16.129 2.525 9.796 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -16.052 1.747 8.228 1.00 0.00 H new ATOM 1486 N ASP A 94 -14.359 4.787 9.488 1.00 0.00 N ATOM 1487 CA ASP A 94 -14.475 6.211 9.197 1.00 0.00 C ATOM 1488 C ASP A 94 -13.318 6.684 8.323 1.00 0.00 C ATOM 1489 O ASP A 94 -13.527 7.224 7.237 1.00 0.00 O ATOM 1490 CB ASP A 94 -14.512 7.018 10.497 1.00 0.00 C ATOM 1491 CG ASP A 94 -15.645 6.593 11.410 1.00 0.00 C ATOM 1492 OD1 ASP A 94 -16.816 6.854 11.064 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -15.360 5.999 12.471 1.00 0.00 O ATOM 0 H ASP A 94 -14.358 4.558 10.482 1.00 0.00 H new ATOM 0 HA ASP A 94 -15.406 6.370 8.653 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -13.563 6.901 11.021 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -14.617 8.077 10.261 1.00 0.00 H new ATOM 1498 N VAL A 95 -12.096 6.478 8.805 1.00 0.00 N ATOM 1499 CA VAL A 95 -10.905 6.883 8.068 1.00 0.00 C ATOM 1500 C VAL A 95 -10.871 6.243 6.685 1.00 0.00 C ATOM 1501 O VAL A 95 -10.522 6.891 5.699 1.00 0.00 O ATOM 1502 CB VAL A 95 -9.620 6.505 8.828 1.00 0.00 C ATOM 1503 CG1 VAL A 95 -8.390 6.922 8.036 1.00 0.00 C ATOM 1504 CG2 VAL A 95 -9.613 7.138 10.211 1.00 0.00 C ATOM 0 H VAL A 95 -11.905 6.033 9.703 1.00 0.00 H new ATOM 0 HA VAL A 95 -10.951 7.967 7.963 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.595 5.422 8.949 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.491 6.647 8.588 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.391 6.417 7.070 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.405 8.001 7.882 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.698 6.860 10.734 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.661 8.223 10.115 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -10.475 6.785 10.777 1.00 0.00 H new ATOM 1514 N MET A 96 -11.238 4.967 6.620 1.00 0.00 N ATOM 1515 CA MET A 96 -11.251 4.240 5.356 1.00 0.00 C ATOM 1516 C MET A 96 -12.120 4.954 4.326 1.00 0.00 C ATOM 1517 O MET A 96 -11.712 5.146 3.181 1.00 0.00 O ATOM 1518 CB MET A 96 -11.760 2.813 5.569 1.00 0.00 C ATOM 1519 CG MET A 96 -10.774 1.919 6.302 1.00 0.00 C ATOM 1520 SD MET A 96 -10.984 0.174 5.897 1.00 0.00 S ATOM 1521 CE MET A 96 -11.545 -0.473 7.470 1.00 0.00 C ATOM 0 H MET A 96 -11.530 4.416 7.427 1.00 0.00 H new ATOM 0 HA MET A 96 -10.229 4.201 4.978 1.00 0.00 H new ATOM 0 HB2 MET A 96 -12.693 2.849 6.132 1.00 0.00 H new ATOM 0 HB3 MET A 96 -11.989 2.369 4.600 1.00 0.00 H new ATOM 0 HG2 MET A 96 -9.758 2.226 6.054 1.00 0.00 H new ATOM 0 HG3 MET A 96 -10.895 2.056 7.377 1.00 0.00 H new ATOM 0 HE1 MET A 96 -11.382 -1.550 7.499 1.00 0.00 H new ATOM 0 HE2 MET A 96 -10.987 0.000 8.278 1.00 0.00 H new ATOM 0 HE3 MET A 96 -12.608 -0.263 7.591 1.00 0.00 H new ATOM 1531 N ARG A 97 -13.321 5.346 4.742 1.00 0.00 N ATOM 1532 CA ARG A 97 -14.248 6.037 3.855 1.00 0.00 C ATOM 1533 C ARG A 97 -13.544 7.163 3.102 1.00 0.00 C ATOM 1534 O ARG A 97 -13.528 7.187 1.872 1.00 0.00 O ATOM 1535 CB ARG A 97 -15.425 6.602 4.652 1.00 0.00 C ATOM 1536 CG ARG A 97 -16.295 5.532 5.293 1.00 0.00 C ATOM 1537 CD ARG A 97 -17.253 4.916 4.286 1.00 0.00 C ATOM 1538 NE ARG A 97 -18.454 4.386 4.927 1.00 0.00 N ATOM 1539 CZ ARG A 97 -19.518 5.125 5.221 1.00 0.00 C ATOM 1540 NH1 ARG A 97 -19.531 6.419 4.931 1.00 0.00 N ATOM 1541 NH2 ARG A 97 -20.573 4.570 5.804 1.00 0.00 N ATOM 0 H ARG A 97 -13.674 5.196 5.687 1.00 0.00 H new ATOM 0 HA ARG A 97 -14.622 5.315 3.129 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -15.042 7.262 5.431 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -16.041 7.212 3.991 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -15.662 4.753 5.718 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -16.861 5.967 6.116 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -17.537 5.667 3.549 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -16.747 4.116 3.746 1.00 0.00 H new ATOM 0 HE ARG A 97 -18.477 3.394 5.162 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -18.723 6.849 4.481 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -20.349 6.984 5.158 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -20.568 3.575 6.027 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -21.389 5.139 6.029 1.00 0.00 H new ATOM 1555 N LYS A 98 -12.962 8.094 3.851 1.00 0.00 N ATOM 1556 CA LYS A 98 -12.255 9.222 3.256 1.00 0.00 C ATOM 1557 C LYS A 98 -11.205 8.742 2.259 1.00 0.00 C ATOM 1558 O LYS A 98 -11.108 9.264 1.148 1.00 0.00 O ATOM 1559 CB LYS A 98 -11.590 10.066 4.347 1.00 0.00 C ATOM 1560 CG LYS A 98 -12.579 10.803 5.233 1.00 0.00 C ATOM 1561 CD LYS A 98 -11.996 11.079 6.609 1.00 0.00 C ATOM 1562 CE LYS A 98 -12.995 11.797 7.503 1.00 0.00 C ATOM 1563 NZ LYS A 98 -12.895 13.277 7.370 1.00 0.00 N ATOM 0 H LYS A 98 -12.966 8.089 4.871 1.00 0.00 H new ATOM 0 HA LYS A 98 -12.982 9.835 2.723 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -10.971 9.419 4.968 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -10.924 10.791 3.879 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -12.861 11.744 4.761 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -13.489 10.212 5.334 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -11.699 10.139 7.075 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -11.095 11.684 6.509 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -14.005 11.477 7.249 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -12.823 11.513 8.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -13.592 13.730 7.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.938 13.586 7.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -13.085 13.551 6.385 1.00 0.00 H new ATOM 1577 N ILE A 99 -10.424 7.747 2.663 1.00 0.00 N ATOM 1578 CA ILE A 99 -9.384 7.196 1.803 1.00 0.00 C ATOM 1579 C ILE A 99 -9.933 6.864 0.420 1.00 0.00 C ATOM 1580 O ILE A 99 -9.425 7.344 -0.593 1.00 0.00 O ATOM 1581 CB ILE A 99 -8.762 5.926 2.414 1.00 0.00 C ATOM 1582 CG1 ILE A 99 -8.121 6.246 3.767 1.00 0.00 C ATOM 1583 CG2 ILE A 99 -7.736 5.329 1.464 1.00 0.00 C ATOM 1584 CD1 ILE A 99 -7.822 5.019 4.599 1.00 0.00 C ATOM 0 H ILE A 99 -10.491 7.306 3.580 1.00 0.00 H new ATOM 0 HA ILE A 99 -8.613 7.961 1.711 1.00 0.00 H new ATOM 0 HB ILE A 99 -9.552 5.192 2.572 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.195 6.796 3.600 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -8.785 6.903 4.329 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.306 4.432 1.910 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.220 5.069 0.522 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.946 6.057 1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.369 5.321 5.543 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.748 4.479 4.797 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.133 4.371 4.057 1.00 0.00 H new ATOM 1596 N ALA A 100 -10.975 6.040 0.385 1.00 0.00 N ATOM 1597 CA ALA A 100 -11.596 5.646 -0.874 1.00 0.00 C ATOM 1598 C ALA A 100 -12.122 6.862 -1.630 1.00 0.00 C ATOM 1599 O ALA A 100 -12.357 6.799 -2.836 1.00 0.00 O ATOM 1600 CB ALA A 100 -12.721 4.654 -0.620 1.00 0.00 C ATOM 0 H ALA A 100 -11.407 5.632 1.214 1.00 0.00 H new ATOM 0 HA ALA A 100 -10.836 5.167 -1.491 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -13.176 4.369 -1.569 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -12.320 3.768 -0.128 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.474 5.114 0.019 1.00 0.00 H new ATOM 1606 N GLN A 101 -12.305 7.966 -0.913 1.00 0.00 N ATOM 1607 CA GLN A 101 -12.804 9.195 -1.517 1.00 0.00 C ATOM 1608 C GLN A 101 -11.654 10.066 -2.011 1.00 0.00 C ATOM 1609 O GLN A 101 -11.777 11.288 -2.090 1.00 0.00 O ATOM 1610 CB GLN A 101 -13.654 9.974 -0.512 1.00 0.00 C ATOM 1611 CG GLN A 101 -14.944 9.267 -0.128 1.00 0.00 C ATOM 1612 CD GLN A 101 -16.056 10.234 0.228 1.00 0.00 C ATOM 1613 OE1 GLN A 101 -15.890 11.099 1.088 1.00 0.00 O ATOM 1614 NE2 GLN A 101 -17.198 10.092 -0.433 1.00 0.00 N ATOM 0 H GLN A 101 -12.115 8.034 0.087 1.00 0.00 H new ATOM 0 HA GLN A 101 -13.423 8.924 -2.372 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -13.065 10.152 0.388 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -13.896 10.950 -0.933 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -15.268 8.636 -0.955 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -14.755 8.609 0.720 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -17.292 9.361 -1.138 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -17.982 10.714 -0.236 1.00 0.00 H new ATOM 1623 N CYS A 102 -10.536 9.428 -2.342 1.00 0.00 N ATOM 1624 CA CYS A 102 -9.362 10.145 -2.828 1.00 0.00 C ATOM 1625 C CYS A 102 -9.173 11.455 -2.070 1.00 0.00 C ATOM 1626 O CYS A 102 -8.988 12.511 -2.673 1.00 0.00 O ATOM 1627 CB CYS A 102 -9.492 10.422 -4.326 1.00 0.00 C ATOM 1628 SG CYS A 102 -10.748 11.655 -4.743 1.00 0.00 S ATOM 0 H CYS A 102 -10.418 8.417 -2.283 1.00 0.00 H new ATOM 0 HA CYS A 102 -8.487 9.518 -2.657 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -8.528 10.758 -4.707 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -9.730 9.489 -4.838 1.00 0.00 H new ATOM 0 HG CYS A 102 -11.560 11.805 -3.738 1.00 0.00 H new ATOM 1634 N ALA A 103 -9.223 11.378 -0.744 1.00 0.00 N ATOM 1635 CA ALA A 103 -9.057 12.557 0.096 1.00 0.00 C ATOM 1636 C ALA A 103 -7.582 12.839 0.361 1.00 0.00 C ATOM 1637 O ALA A 103 -6.838 11.984 0.842 1.00 0.00 O ATOM 1638 CB ALA A 103 -9.807 12.381 1.408 1.00 0.00 C ATOM 0 H ALA A 103 -9.377 10.511 -0.229 1.00 0.00 H new ATOM 0 HA ALA A 103 -9.474 13.413 -0.435 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.674 13.269 2.025 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.868 12.236 1.204 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.417 11.511 1.936 1.00 0.00 H new ATOM 1644 N PRO A 104 -7.147 14.067 0.041 1.00 0.00 N ATOM 1645 CA PRO A 104 -5.757 14.490 0.237 1.00 0.00 C ATOM 1646 C PRO A 104 -5.398 14.640 1.711 1.00 0.00 C ATOM 1647 O PRO A 104 -6.164 15.202 2.492 1.00 0.00 O ATOM 1648 CB PRO A 104 -5.696 15.846 -0.470 1.00 0.00 C ATOM 1649 CG PRO A 104 -7.097 16.352 -0.440 1.00 0.00 C ATOM 1650 CD PRO A 104 -7.978 15.137 -0.535 1.00 0.00 C ATOM 0 HA PRO A 104 -5.050 13.758 -0.153 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -5.017 16.529 0.041 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -5.334 15.743 -1.493 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -7.293 16.905 0.479 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -7.283 17.035 -1.269 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -8.906 15.269 0.022 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -8.254 14.920 -1.567 1.00 0.00 H new ATOM 1658 N GLY A 105 -4.227 14.134 2.085 1.00 0.00 N ATOM 1659 CA GLY A 105 -3.787 14.223 3.466 1.00 0.00 C ATOM 1660 C GLY A 105 -4.291 13.070 4.310 1.00 0.00 C ATOM 1661 O GLY A 105 -3.645 12.671 5.279 1.00 0.00 O ATOM 0 H GLY A 105 -3.575 13.664 1.457 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -2.698 14.243 3.496 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.135 15.163 3.895 1.00 0.00 H new ATOM 1665 N VAL A 106 -5.450 12.532 3.943 1.00 0.00 N ATOM 1666 CA VAL A 106 -6.041 11.417 4.674 1.00 0.00 C ATOM 1667 C VAL A 106 -5.226 10.142 4.486 1.00 0.00 C ATOM 1668 O VAL A 106 -4.512 9.710 5.390 1.00 0.00 O ATOM 1669 CB VAL A 106 -7.491 11.158 4.225 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -8.058 9.936 4.932 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -8.356 12.382 4.484 1.00 0.00 C ATOM 0 H VAL A 106 -5.998 12.850 3.144 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.039 11.693 5.728 1.00 0.00 H new ATOM 0 HB VAL A 106 -7.491 10.962 3.153 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.083 9.768 4.602 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -7.452 9.063 4.691 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -8.046 10.101 6.009 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.377 12.181 4.161 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.351 12.612 5.549 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -7.960 13.232 3.928 1.00 0.00 H new ATOM 1681 N VAL A 107 -5.338 9.545 3.304 1.00 0.00 N ATOM 1682 CA VAL A 107 -4.611 8.319 2.995 1.00 0.00 C ATOM 1683 C VAL A 107 -3.142 8.439 3.385 1.00 0.00 C ATOM 1684 O VAL A 107 -2.469 7.437 3.621 1.00 0.00 O ATOM 1685 CB VAL A 107 -4.707 7.972 1.497 1.00 0.00 C ATOM 1686 CG1 VAL A 107 -4.247 9.147 0.646 1.00 0.00 C ATOM 1687 CG2 VAL A 107 -3.891 6.727 1.186 1.00 0.00 C ATOM 0 H VAL A 107 -5.925 9.890 2.545 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.074 7.521 3.575 1.00 0.00 H new ATOM 0 HB VAL A 107 -5.750 7.765 1.256 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -4.322 8.883 -0.409 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -4.878 10.012 0.849 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -3.212 9.388 0.887 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -3.970 6.496 0.124 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -2.846 6.903 1.442 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.271 5.888 1.769 1.00 0.00 H new ATOM 1697 N GLU A 108 -2.651 9.673 3.450 1.00 0.00 N ATOM 1698 CA GLU A 108 -1.261 9.924 3.811 1.00 0.00 C ATOM 1699 C GLU A 108 -0.993 9.517 5.257 1.00 0.00 C ATOM 1700 O GLU A 108 0.053 8.946 5.570 1.00 0.00 O ATOM 1701 CB GLU A 108 -0.918 11.402 3.614 1.00 0.00 C ATOM 1702 CG GLU A 108 -0.701 11.787 2.160 1.00 0.00 C ATOM 1703 CD GLU A 108 -0.054 13.150 2.008 1.00 0.00 C ATOM 1704 OE1 GLU A 108 1.144 13.277 2.339 1.00 0.00 O ATOM 1705 OE2 GLU A 108 -0.744 14.089 1.560 1.00 0.00 O ATOM 0 H GLU A 108 -3.195 10.514 3.257 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.629 9.322 3.159 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.722 12.011 4.026 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -0.017 11.636 4.182 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -0.075 11.036 1.679 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -1.659 11.784 1.640 1.00 0.00 H new ATOM 1712 N LEU A 109 -1.944 9.816 6.136 1.00 0.00 N ATOM 1713 CA LEU A 109 -1.811 9.482 7.550 1.00 0.00 C ATOM 1714 C LEU A 109 -1.560 7.989 7.736 1.00 0.00 C ATOM 1715 O LEU A 109 -1.056 7.559 8.773 1.00 0.00 O ATOM 1716 CB LEU A 109 -3.071 9.898 8.312 1.00 0.00 C ATOM 1717 CG LEU A 109 -3.423 11.385 8.267 1.00 0.00 C ATOM 1718 CD1 LEU A 109 -4.891 11.596 8.602 1.00 0.00 C ATOM 1719 CD2 LEU A 109 -2.538 12.172 9.221 1.00 0.00 C ATOM 0 H LEU A 109 -2.815 10.289 5.894 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.955 10.027 7.948 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.915 9.333 7.915 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.954 9.604 9.355 1.00 0.00 H new ATOM 0 HG LEU A 109 -3.246 11.750 7.255 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -5.123 12.660 8.565 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.509 11.064 7.879 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -5.094 11.215 9.603 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.803 13.228 9.175 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.682 11.805 10.237 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.494 12.047 8.935 1.00 0.00 H new ATOM 1731 N VAL A 110 -1.912 7.204 6.723 1.00 0.00 N ATOM 1732 CA VAL A 110 -1.721 5.760 6.773 1.00 0.00 C ATOM 1733 C VAL A 110 -0.436 5.350 6.062 1.00 0.00 C ATOM 1734 O VAL A 110 0.175 4.334 6.397 1.00 0.00 O ATOM 1735 CB VAL A 110 -2.908 5.014 6.134 1.00 0.00 C ATOM 1736 CG1 VAL A 110 -2.859 3.534 6.481 1.00 0.00 C ATOM 1737 CG2 VAL A 110 -4.226 5.631 6.580 1.00 0.00 C ATOM 0 H VAL A 110 -2.331 7.544 5.858 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.653 5.487 7.826 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.835 5.111 5.051 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.705 3.024 6.021 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.930 3.103 6.108 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.907 3.412 7.563 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.054 5.092 6.120 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -4.309 5.566 7.665 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.260 6.677 6.275 1.00 0.00 H new ATOM 1747 N LEU A 111 -0.031 6.146 5.080 1.00 0.00 N ATOM 1748 CA LEU A 111 1.183 5.868 4.320 1.00 0.00 C ATOM 1749 C LEU A 111 2.425 6.101 5.174 1.00 0.00 C ATOM 1750 O LEU A 111 3.311 5.248 5.246 1.00 0.00 O ATOM 1751 CB LEU A 111 1.239 6.745 3.069 1.00 0.00 C ATOM 1752 CG LEU A 111 0.114 6.539 2.054 1.00 0.00 C ATOM 1753 CD1 LEU A 111 -0.019 7.754 1.149 1.00 0.00 C ATOM 1754 CD2 LEU A 111 0.362 5.283 1.231 1.00 0.00 C ATOM 0 H LEU A 111 -0.525 6.990 4.791 1.00 0.00 H new ATOM 0 HA LEU A 111 1.161 4.820 4.020 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.233 7.789 3.381 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.191 6.568 2.568 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.822 6.414 2.599 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.825 7.588 0.434 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.244 8.634 1.752 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.916 7.912 0.612 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.448 5.152 0.514 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.307 5.379 0.697 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.405 4.417 1.892 1.00 0.00 H new ATOM 1766 N ILE A 112 2.483 7.260 5.822 1.00 0.00 N ATOM 1767 CA ILE A 112 3.614 7.604 6.673 1.00 0.00 C ATOM 1768 C ILE A 112 4.007 6.431 7.566 1.00 0.00 C ATOM 1769 O ILE A 112 5.136 5.941 7.529 1.00 0.00 O ATOM 1770 CB ILE A 112 3.303 8.825 7.558 1.00 0.00 C ATOM 1771 CG1 ILE A 112 3.724 10.115 6.850 1.00 0.00 C ATOM 1772 CG2 ILE A 112 4.005 8.699 8.902 1.00 0.00 C ATOM 1773 CD1 ILE A 112 3.049 11.353 7.399 1.00 0.00 C ATOM 0 H ILE A 112 1.759 7.977 5.773 1.00 0.00 H new ATOM 0 HA ILE A 112 4.444 7.848 6.010 1.00 0.00 H new ATOM 0 HB ILE A 112 2.228 8.863 7.734 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.804 10.231 6.936 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.497 10.028 5.788 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.775 9.570 9.516 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.662 7.797 9.409 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.082 8.640 8.746 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.394 12.229 6.850 1.00 0.00 H new ATOM 0 HD12 ILE A 112 1.969 11.258 7.288 1.00 0.00 H new ATOM 0 HD13 ILE A 112 3.297 11.465 8.455 1.00 0.00 H new ATOM 1785 N PRO A 113 3.053 5.967 8.387 1.00 0.00 N ATOM 1786 CA PRO A 113 3.274 4.844 9.303 1.00 0.00 C ATOM 1787 C PRO A 113 3.424 3.517 8.567 1.00 0.00 C ATOM 1788 O PRO A 113 4.374 2.769 8.802 1.00 0.00 O ATOM 1789 CB PRO A 113 2.011 4.837 10.167 1.00 0.00 C ATOM 1790 CG PRO A 113 0.968 5.478 9.318 1.00 0.00 C ATOM 1791 CD PRO A 113 1.685 6.503 8.483 1.00 0.00 C ATOM 0 HA PRO A 113 4.196 4.958 9.873 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.727 3.822 10.445 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.162 5.390 11.094 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.470 4.741 8.688 1.00 0.00 H new ATOM 0 HG3 PRO A 113 0.198 5.945 9.932 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.226 6.613 7.500 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.671 7.486 8.953 1.00 0.00 H new ATOM 1799 N LEU A 114 2.482 3.230 7.676 1.00 0.00 N ATOM 1800 CA LEU A 114 2.509 1.992 6.905 1.00 0.00 C ATOM 1801 C LEU A 114 3.897 1.744 6.323 1.00 0.00 C ATOM 1802 O LEU A 114 4.466 0.665 6.487 1.00 0.00 O ATOM 1803 CB LEU A 114 1.474 2.045 5.780 1.00 0.00 C ATOM 1804 CG LEU A 114 1.416 0.824 4.863 1.00 0.00 C ATOM 1805 CD1 LEU A 114 -0.015 0.551 4.426 1.00 0.00 C ATOM 1806 CD2 LEU A 114 2.316 1.023 3.652 1.00 0.00 C ATOM 0 H LEU A 114 1.689 3.838 7.469 1.00 0.00 H new ATOM 0 HA LEU A 114 2.264 1.169 7.577 1.00 0.00 H new ATOM 0 HB2 LEU A 114 0.489 2.187 6.226 1.00 0.00 H new ATOM 0 HB3 LEU A 114 1.676 2.924 5.168 1.00 0.00 H new ATOM 0 HG LEU A 114 1.775 -0.041 5.420 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.036 -0.322 3.774 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.634 0.363 5.303 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.402 1.416 3.887 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.262 0.144 3.010 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.987 1.900 3.094 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.344 1.168 3.983 1.00 0.00 H new ATOM 1818 N ARG A 115 4.436 2.751 5.643 1.00 0.00 N ATOM 1819 CA ARG A 115 5.758 2.642 5.037 1.00 0.00 C ATOM 1820 C ARG A 115 6.818 2.348 6.094 1.00 0.00 C ATOM 1821 O ARG A 115 7.652 1.459 5.920 1.00 0.00 O ATOM 1822 CB ARG A 115 6.109 3.932 4.293 1.00 0.00 C ATOM 1823 CG ARG A 115 7.489 3.912 3.658 1.00 0.00 C ATOM 1824 CD ARG A 115 7.941 5.310 3.264 1.00 0.00 C ATOM 1825 NE ARG A 115 8.619 5.995 4.361 1.00 0.00 N ATOM 1826 CZ ARG A 115 8.757 7.315 4.430 1.00 0.00 C ATOM 1827 NH1 ARG A 115 8.266 8.087 3.470 1.00 0.00 N ATOM 1828 NH2 ARG A 115 9.387 7.864 5.460 1.00 0.00 N ATOM 0 H ARG A 115 3.978 3.651 5.498 1.00 0.00 H new ATOM 0 HA ARG A 115 5.738 1.815 4.327 1.00 0.00 H new ATOM 0 HB2 ARG A 115 5.364 4.108 3.517 1.00 0.00 H new ATOM 0 HB3 ARG A 115 6.050 4.770 4.988 1.00 0.00 H new ATOM 0 HG2 ARG A 115 8.206 3.480 4.356 1.00 0.00 H new ATOM 0 HG3 ARG A 115 7.476 3.271 2.777 1.00 0.00 H new ATOM 0 HD2 ARG A 115 8.611 5.246 2.407 1.00 0.00 H new ATOM 0 HD3 ARG A 115 7.077 5.895 2.950 1.00 0.00 H new ATOM 0 HE ARG A 115 9.008 5.429 5.116 1.00 0.00 H new ATOM 0 HH11 ARG A 115 7.781 7.668 2.676 1.00 0.00 H new ATOM 0 HH12 ARG A 115 8.373 9.100 3.525 1.00 0.00 H new ATOM 0 HH21 ARG A 115 9.766 7.273 6.200 1.00 0.00 H new ATOM 0 HH22 ARG A 115 9.492 8.877 5.512 1.00 0.00 H new ATOM 1842 N GLN A 116 6.779 3.100 7.190 1.00 0.00 N ATOM 1843 CA GLN A 116 7.738 2.920 8.274 1.00 0.00 C ATOM 1844 C GLN A 116 7.879 1.445 8.635 1.00 0.00 C ATOM 1845 O GLN A 116 8.958 0.991 9.017 1.00 0.00 O ATOM 1846 CB GLN A 116 7.304 3.719 9.504 1.00 0.00 C ATOM 1847 CG GLN A 116 7.752 5.172 9.474 1.00 0.00 C ATOM 1848 CD GLN A 116 6.981 6.040 10.448 1.00 0.00 C ATOM 1849 OE1 GLN A 116 6.047 6.745 10.065 1.00 0.00 O ATOM 1850 NE2 GLN A 116 7.368 5.994 11.718 1.00 0.00 N ATOM 0 H GLN A 116 6.094 3.839 7.350 1.00 0.00 H new ATOM 0 HA GLN A 116 8.707 3.287 7.934 1.00 0.00 H new ATOM 0 HB2 GLN A 116 6.218 3.684 9.585 1.00 0.00 H new ATOM 0 HB3 GLN A 116 7.706 3.242 10.398 1.00 0.00 H new ATOM 0 HG2 GLN A 116 8.815 5.225 9.708 1.00 0.00 H new ATOM 0 HG3 GLN A 116 7.628 5.566 8.465 1.00 0.00 H new ATOM 0 HE21 GLN A 116 8.147 5.396 11.992 1.00 0.00 H new ATOM 0 HE22 GLN A 116 6.886 6.557 12.419 1.00 0.00 H new ATOM 1859 N ARG A 117 6.784 0.702 8.512 1.00 0.00 N ATOM 1860 CA ARG A 117 6.786 -0.721 8.828 1.00 0.00 C ATOM 1861 C ARG A 117 7.491 -1.519 7.735 1.00 0.00 C ATOM 1862 O ARG A 117 8.384 -2.320 8.013 1.00 0.00 O ATOM 1863 CB ARG A 117 5.354 -1.229 9.002 1.00 0.00 C ATOM 1864 CG ARG A 117 4.847 -1.141 10.432 1.00 0.00 C ATOM 1865 CD ARG A 117 4.623 0.302 10.857 1.00 0.00 C ATOM 1866 NE ARG A 117 5.815 0.883 11.468 1.00 0.00 N ATOM 1867 CZ ARG A 117 6.363 0.428 12.589 1.00 0.00 C ATOM 1868 NH1 ARG A 117 5.829 -0.610 13.218 1.00 0.00 N ATOM 1869 NH2 ARG A 117 7.448 1.011 13.083 1.00 0.00 N ATOM 0 H ARG A 117 5.884 1.062 8.196 1.00 0.00 H new ATOM 0 HA ARG A 117 7.329 -0.859 9.763 1.00 0.00 H new ATOM 0 HB2 ARG A 117 4.692 -0.654 8.355 1.00 0.00 H new ATOM 0 HB3 ARG A 117 5.302 -2.266 8.670 1.00 0.00 H new ATOM 0 HG2 ARG A 117 3.914 -1.697 10.523 1.00 0.00 H new ATOM 0 HG3 ARG A 117 5.565 -1.612 11.103 1.00 0.00 H new ATOM 0 HD2 ARG A 117 4.335 0.895 9.989 1.00 0.00 H new ATOM 0 HD3 ARG A 117 3.794 0.347 11.564 1.00 0.00 H new ATOM 0 HE ARG A 117 6.251 1.683 11.009 1.00 0.00 H new ATOM 0 HH11 ARG A 117 4.995 -1.061 12.841 1.00 0.00 H new ATOM 0 HH12 ARG A 117 6.252 -0.957 14.079 1.00 0.00 H new ATOM 0 HH21 ARG A 117 7.862 1.809 12.602 1.00 0.00 H new ATOM 0 HH22 ARG A 117 7.868 0.661 13.944 1.00 0.00 H new ATOM 1883 N LEU A 118 7.083 -1.295 6.490 1.00 0.00 N ATOM 1884 CA LEU A 118 7.675 -1.993 5.354 1.00 0.00 C ATOM 1885 C LEU A 118 9.186 -2.117 5.518 1.00 0.00 C ATOM 1886 O LEU A 118 9.754 -3.192 5.328 1.00 0.00 O ATOM 1887 CB LEU A 118 7.350 -1.258 4.053 1.00 0.00 C ATOM 1888 CG LEU A 118 5.886 -1.292 3.610 1.00 0.00 C ATOM 1889 CD1 LEU A 118 5.715 -0.577 2.279 1.00 0.00 C ATOM 1890 CD2 LEU A 118 5.391 -2.727 3.515 1.00 0.00 C ATOM 0 H LEU A 118 6.345 -0.636 6.242 1.00 0.00 H new ATOM 0 HA LEU A 118 7.249 -2.996 5.313 1.00 0.00 H new ATOM 0 HB2 LEU A 118 7.651 -0.216 4.163 1.00 0.00 H new ATOM 0 HB3 LEU A 118 7.960 -1.684 3.256 1.00 0.00 H new ATOM 0 HG LEU A 118 5.287 -0.772 4.358 1.00 0.00 H new ATOM 0 HD11 LEU A 118 4.667 -0.611 1.980 1.00 0.00 H new ATOM 0 HD12 LEU A 118 6.030 0.462 2.381 1.00 0.00 H new ATOM 0 HD13 LEU A 118 6.325 -1.068 1.521 1.00 0.00 H new ATOM 0 HD21 LEU A 118 4.348 -2.732 3.199 1.00 0.00 H new ATOM 0 HD22 LEU A 118 5.993 -3.272 2.788 1.00 0.00 H new ATOM 0 HD23 LEU A 118 5.477 -3.207 4.490 1.00 0.00 H new ATOM 1902 N GLU A 119 9.830 -1.010 5.874 1.00 0.00 N ATOM 1903 CA GLU A 119 11.276 -0.996 6.064 1.00 0.00 C ATOM 1904 C GLU A 119 11.688 -1.962 7.171 1.00 0.00 C ATOM 1905 O GLU A 119 12.699 -2.655 7.059 1.00 0.00 O ATOM 1906 CB GLU A 119 11.755 0.418 6.401 1.00 0.00 C ATOM 1907 CG GLU A 119 11.979 1.292 5.179 1.00 0.00 C ATOM 1908 CD GLU A 119 12.825 2.513 5.483 1.00 0.00 C ATOM 1909 OE1 GLU A 119 13.610 2.466 6.453 1.00 0.00 O ATOM 1910 OE2 GLU A 119 12.701 3.517 4.750 1.00 0.00 O ATOM 0 H GLU A 119 9.374 -0.112 6.037 1.00 0.00 H new ATOM 0 HA GLU A 119 11.743 -1.317 5.133 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.021 0.896 7.050 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.685 0.353 6.966 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.464 0.704 4.400 1.00 0.00 H new ATOM 0 HG3 GLU A 119 11.015 1.612 4.784 1.00 0.00 H new ATOM 1917 N GLU A 120 10.898 -2.001 8.240 1.00 0.00 N ATOM 1918 CA GLU A 120 11.181 -2.880 9.368 1.00 0.00 C ATOM 1919 C GLU A 120 11.174 -4.343 8.932 1.00 0.00 C ATOM 1920 O GLU A 120 12.051 -5.119 9.312 1.00 0.00 O ATOM 1921 CB GLU A 120 10.156 -2.663 10.482 1.00 0.00 C ATOM 1922 CG GLU A 120 10.415 -3.507 11.719 1.00 0.00 C ATOM 1923 CD GLU A 120 9.153 -3.772 12.519 1.00 0.00 C ATOM 1924 OE1 GLU A 120 8.052 -3.689 11.936 1.00 0.00 O ATOM 1925 OE2 GLU A 120 9.268 -4.063 13.728 1.00 0.00 O ATOM 0 H GLU A 120 10.057 -1.434 8.348 1.00 0.00 H new ATOM 0 HA GLU A 120 12.174 -2.636 9.746 1.00 0.00 H new ATOM 0 HB2 GLU A 120 10.156 -1.610 10.764 1.00 0.00 H new ATOM 0 HB3 GLU A 120 9.161 -2.891 10.099 1.00 0.00 H new ATOM 0 HG2 GLU A 120 10.857 -4.457 11.420 1.00 0.00 H new ATOM 0 HG3 GLU A 120 11.143 -3.002 12.353 1.00 0.00 H new ATOM 1932 N ARG A 121 10.178 -4.711 8.134 1.00 0.00 N ATOM 1933 CA ARG A 121 10.055 -6.080 7.648 1.00 0.00 C ATOM 1934 C ARG A 121 11.140 -6.393 6.621 1.00 0.00 C ATOM 1935 O ARG A 121 11.668 -7.503 6.582 1.00 0.00 O ATOM 1936 CB ARG A 121 8.674 -6.302 7.029 1.00 0.00 C ATOM 1937 CG ARG A 121 7.542 -6.284 8.044 1.00 0.00 C ATOM 1938 CD ARG A 121 6.370 -7.139 7.586 1.00 0.00 C ATOM 1939 NE ARG A 121 5.617 -7.683 8.713 1.00 0.00 N ATOM 1940 CZ ARG A 121 6.109 -8.576 9.564 1.00 0.00 C ATOM 1941 NH1 ARG A 121 7.348 -9.024 9.417 1.00 0.00 N ATOM 1942 NH2 ARG A 121 5.361 -9.023 10.565 1.00 0.00 N ATOM 0 H ARG A 121 9.444 -4.081 7.810 1.00 0.00 H new ATOM 0 HA ARG A 121 10.178 -6.752 8.497 1.00 0.00 H new ATOM 0 HB2 ARG A 121 8.492 -5.531 6.281 1.00 0.00 H new ATOM 0 HB3 ARG A 121 8.668 -7.259 6.508 1.00 0.00 H new ATOM 0 HG2 ARG A 121 7.907 -6.649 9.004 1.00 0.00 H new ATOM 0 HG3 ARG A 121 7.207 -5.258 8.199 1.00 0.00 H new ATOM 0 HD2 ARG A 121 5.707 -6.540 6.962 1.00 0.00 H new ATOM 0 HD3 ARG A 121 6.738 -7.957 6.967 1.00 0.00 H new ATOM 0 HE ARG A 121 4.660 -7.359 8.854 1.00 0.00 H new ATOM 0 HH11 ARG A 121 7.926 -8.683 8.649 1.00 0.00 H new ATOM 0 HH12 ARG A 121 7.723 -9.710 10.072 1.00 0.00 H new ATOM 0 HH21 ARG A 121 4.407 -8.681 10.681 1.00 0.00 H new ATOM 0 HH22 ARG A 121 5.740 -9.709 11.218 1.00 0.00 H new ATOM 1956 N GLN A 122 11.465 -5.405 5.793 1.00 0.00 N ATOM 1957 CA GLN A 122 12.486 -5.576 4.766 1.00 0.00 C ATOM 1958 C GLN A 122 13.759 -6.172 5.357 1.00 0.00 C ATOM 1959 O GLN A 122 14.144 -7.293 5.025 1.00 0.00 O ATOM 1960 CB GLN A 122 12.798 -4.235 4.099 1.00 0.00 C ATOM 1961 CG GLN A 122 14.036 -4.267 3.217 1.00 0.00 C ATOM 1962 CD GLN A 122 13.810 -5.022 1.922 1.00 0.00 C ATOM 1963 OE1 GLN A 122 13.942 -6.245 1.872 1.00 0.00 O ATOM 1964 NE2 GLN A 122 13.468 -4.295 0.865 1.00 0.00 N ATOM 0 H GLN A 122 11.037 -4.479 5.813 1.00 0.00 H new ATOM 0 HA GLN A 122 12.099 -6.266 4.016 1.00 0.00 H new ATOM 0 HB2 GLN A 122 11.942 -3.930 3.498 1.00 0.00 H new ATOM 0 HB3 GLN A 122 12.932 -3.477 4.871 1.00 0.00 H new ATOM 0 HG2 GLN A 122 14.342 -3.246 2.989 1.00 0.00 H new ATOM 0 HG3 GLN A 122 14.856 -4.731 3.765 1.00 0.00 H new ATOM 0 HE21 GLN A 122 13.370 -3.283 0.952 1.00 0.00 H new ATOM 0 HE22 GLN A 122 13.303 -4.748 -0.034 1.00 0.00 H new ATOM 1973 N ARG A 123 14.409 -5.414 6.234 1.00 0.00 N ATOM 1974 CA ARG A 123 15.640 -5.866 6.871 1.00 0.00 C ATOM 1975 C ARG A 123 15.342 -6.877 7.975 1.00 0.00 C ATOM 1976 O ARG A 123 14.182 -7.172 8.263 1.00 0.00 O ATOM 1977 CB ARG A 123 16.409 -4.676 7.448 1.00 0.00 C ATOM 1978 CG ARG A 123 15.987 -4.307 8.861 1.00 0.00 C ATOM 1979 CD ARG A 123 16.387 -2.881 9.207 1.00 0.00 C ATOM 1980 NE ARG A 123 17.732 -2.812 9.773 1.00 0.00 N ATOM 1981 CZ ARG A 123 18.839 -2.802 9.040 1.00 0.00 C ATOM 1982 NH1 ARG A 123 18.762 -2.856 7.717 1.00 0.00 N ATOM 1983 NH2 ARG A 123 20.026 -2.738 9.629 1.00 0.00 N ATOM 0 H ARG A 123 14.103 -4.484 6.520 1.00 0.00 H new ATOM 0 HA ARG A 123 16.254 -6.352 6.113 1.00 0.00 H new ATOM 0 HB2 ARG A 123 17.474 -4.906 7.444 1.00 0.00 H new ATOM 0 HB3 ARG A 123 16.267 -3.813 6.798 1.00 0.00 H new ATOM 0 HG2 ARG A 123 14.907 -4.417 8.960 1.00 0.00 H new ATOM 0 HG3 ARG A 123 16.444 -4.997 9.570 1.00 0.00 H new ATOM 0 HD2 ARG A 123 16.339 -2.263 8.310 1.00 0.00 H new ATOM 0 HD3 ARG A 123 15.673 -2.466 9.918 1.00 0.00 H new ATOM 0 HE ARG A 123 17.826 -2.769 10.788 1.00 0.00 H new ATOM 0 HH11 ARG A 123 17.851 -2.905 7.261 1.00 0.00 H new ATOM 0 HH12 ARG A 123 19.614 -2.848 7.156 1.00 0.00 H new ATOM 0 HH21 ARG A 123 20.089 -2.696 10.646 1.00 0.00 H new ATOM 0 HH22 ARG A 123 20.876 -2.730 9.065 1.00 0.00 H new ATOM 1997 N ARG A 124 16.397 -7.404 8.588 1.00 0.00 N ATOM 1998 CA ARG A 124 16.248 -8.382 9.658 1.00 0.00 C ATOM 1999 C ARG A 124 17.529 -8.489 10.480 1.00 0.00 C ATOM 2000 O ARG A 124 18.540 -7.864 10.156 1.00 0.00 O ATOM 2001 CB ARG A 124 15.884 -9.751 9.080 1.00 0.00 C ATOM 2002 CG ARG A 124 16.932 -10.309 8.130 1.00 0.00 C ATOM 2003 CD ARG A 124 16.420 -11.538 7.396 1.00 0.00 C ATOM 2004 NE ARG A 124 15.298 -11.223 6.516 1.00 0.00 N ATOM 2005 CZ ARG A 124 14.946 -11.973 5.478 1.00 0.00 C ATOM 2006 NH1 ARG A 124 15.624 -13.076 5.192 1.00 0.00 N ATOM 2007 NH2 ARG A 124 13.913 -11.620 4.723 1.00 0.00 N ATOM 0 H ARG A 124 17.364 -7.170 8.362 1.00 0.00 H new ATOM 0 HA ARG A 124 15.444 -8.046 10.313 1.00 0.00 H new ATOM 0 HB2 ARG A 124 15.737 -10.455 9.899 1.00 0.00 H new ATOM 0 HB3 ARG A 124 14.933 -9.672 8.553 1.00 0.00 H new ATOM 0 HG2 ARG A 124 17.214 -9.543 7.407 1.00 0.00 H new ATOM 0 HG3 ARG A 124 17.832 -10.566 8.689 1.00 0.00 H new ATOM 0 HD2 ARG A 124 17.229 -11.973 6.810 1.00 0.00 H new ATOM 0 HD3 ARG A 124 16.111 -12.291 8.121 1.00 0.00 H new ATOM 0 HE ARG A 124 14.755 -10.381 6.709 1.00 0.00 H new ATOM 0 HH11 ARG A 124 16.418 -13.351 5.770 1.00 0.00 H new ATOM 0 HH12 ARG A 124 15.351 -13.650 4.394 1.00 0.00 H new ATOM 0 HH21 ARG A 124 13.389 -10.772 4.940 1.00 0.00 H new ATOM 0 HH22 ARG A 124 13.643 -12.196 3.926 1.00 0.00 H new ATOM 2021 N ARG A 125 17.480 -9.284 11.543 1.00 0.00 N ATOM 2022 CA ARG A 125 18.636 -9.471 12.412 1.00 0.00 C ATOM 2023 C ARG A 125 19.211 -10.876 12.257 1.00 0.00 C ATOM 2024 O ARG A 125 18.556 -11.866 12.586 1.00 0.00 O ATOM 2025 CB ARG A 125 18.250 -9.225 13.871 1.00 0.00 C ATOM 2026 CG ARG A 125 19.342 -9.594 14.861 1.00 0.00 C ATOM 2027 CD ARG A 125 20.560 -8.696 14.708 1.00 0.00 C ATOM 2028 NE ARG A 125 21.448 -8.776 15.864 1.00 0.00 N ATOM 2029 CZ ARG A 125 21.157 -8.257 17.052 1.00 0.00 C ATOM 2030 NH1 ARG A 125 20.007 -7.625 17.239 1.00 0.00 N ATOM 2031 NH2 ARG A 125 22.018 -8.372 18.056 1.00 0.00 N ATOM 0 H ARG A 125 16.652 -9.809 11.824 1.00 0.00 H new ATOM 0 HA ARG A 125 19.399 -8.750 12.119 1.00 0.00 H new ATOM 0 HB2 ARG A 125 17.997 -8.173 13.998 1.00 0.00 H new ATOM 0 HB3 ARG A 125 17.353 -9.799 14.102 1.00 0.00 H new ATOM 0 HG2 ARG A 125 18.955 -9.514 15.877 1.00 0.00 H new ATOM 0 HG3 ARG A 125 19.634 -10.633 14.711 1.00 0.00 H new ATOM 0 HD2 ARG A 125 21.108 -8.979 13.810 1.00 0.00 H new ATOM 0 HD3 ARG A 125 20.235 -7.665 14.571 1.00 0.00 H new ATOM 0 HE ARG A 125 22.341 -9.257 15.754 1.00 0.00 H new ATOM 0 HH11 ARG A 125 19.343 -7.536 16.470 1.00 0.00 H new ATOM 0 HH12 ARG A 125 19.786 -7.228 18.152 1.00 0.00 H new ATOM 0 HH21 ARG A 125 22.903 -8.859 17.915 1.00 0.00 H new ATOM 0 HH22 ARG A 125 21.794 -7.973 18.968 1.00 0.00 H new ATOM 2045 N LYS A 126 20.438 -10.956 11.753 1.00 0.00 N ATOM 2046 CA LYS A 126 21.102 -12.239 11.555 1.00 0.00 C ATOM 2047 C LYS A 126 21.471 -12.873 12.892 1.00 0.00 C ATOM 2048 O LYS A 126 22.050 -12.220 13.759 1.00 0.00 O ATOM 2049 CB LYS A 126 22.358 -12.059 10.700 1.00 0.00 C ATOM 2050 CG LYS A 126 22.951 -13.368 10.207 1.00 0.00 C ATOM 2051 CD LYS A 126 22.307 -13.817 8.906 1.00 0.00 C ATOM 2052 CE LYS A 126 20.879 -14.291 9.125 1.00 0.00 C ATOM 2053 NZ LYS A 126 20.447 -15.254 8.075 1.00 0.00 N ATOM 0 H LYS A 126 20.993 -10.147 11.474 1.00 0.00 H new ATOM 0 HA LYS A 126 20.409 -12.903 11.038 1.00 0.00 H new ATOM 0 HB2 LYS A 126 22.116 -11.433 9.841 1.00 0.00 H new ATOM 0 HB3 LYS A 126 23.110 -11.525 11.281 1.00 0.00 H new ATOM 0 HG2 LYS A 126 24.025 -13.250 10.061 1.00 0.00 H new ATOM 0 HG3 LYS A 126 22.816 -14.139 10.966 1.00 0.00 H new ATOM 0 HD2 LYS A 126 22.312 -12.993 8.193 1.00 0.00 H new ATOM 0 HD3 LYS A 126 22.895 -14.623 8.467 1.00 0.00 H new ATOM 0 HE2 LYS A 126 20.799 -14.762 10.105 1.00 0.00 H new ATOM 0 HE3 LYS A 126 20.208 -13.432 9.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 19.468 -15.553 8.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 20.499 -14.797 7.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 21.072 -16.085 8.088 1.00 0.00 H new ATOM 2067 N GLN A 127 21.132 -14.149 13.051 1.00 0.00 N ATOM 2068 CA GLN A 127 21.429 -14.870 14.283 1.00 0.00 C ATOM 2069 C GLN A 127 22.877 -15.348 14.298 1.00 0.00 C ATOM 2070 O GLN A 127 23.358 -15.874 15.303 1.00 0.00 O ATOM 2071 CB GLN A 127 20.484 -16.063 14.440 1.00 0.00 C ATOM 2072 CG GLN A 127 19.102 -15.682 14.946 1.00 0.00 C ATOM 2073 CD GLN A 127 18.236 -16.890 15.243 1.00 0.00 C ATOM 2074 OE1 GLN A 127 17.902 -17.664 14.345 1.00 0.00 O ATOM 2075 NE2 GLN A 127 17.867 -17.059 16.507 1.00 0.00 N ATOM 0 H GLN A 127 20.652 -14.704 12.342 1.00 0.00 H new ATOM 0 HA GLN A 127 21.283 -14.186 15.119 1.00 0.00 H new ATOM 0 HB2 GLN A 127 20.384 -16.566 13.478 1.00 0.00 H new ATOM 0 HB3 GLN A 127 20.929 -16.780 15.129 1.00 0.00 H new ATOM 0 HG2 GLN A 127 19.203 -15.081 15.850 1.00 0.00 H new ATOM 0 HG3 GLN A 127 18.606 -15.058 14.202 1.00 0.00 H new ATOM 0 HE21 GLN A 127 18.167 -16.393 17.219 1.00 0.00 H new ATOM 0 HE22 GLN A 127 17.284 -17.855 16.766 1.00 0.00 H new TER 2084 GLN A 127