USER MOD reduce.3.24.130724 H: found=0, std=0, add=1222, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1222 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 130 SER OG : rot -128:sc= 0.69 USER MOD Set 1.2: A 132 GLN : amide:sc= 0.427 K(o=1.1,f=-0.87) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 158:sc= 1.18 (180deg=0.931) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 164:sc= 1.93 (180deg=1.32) USER MOD Single : A 18 GLN : amide:sc= -0.0976 K(o=-0.098,f=-2.6!) USER MOD Single : A 20 TYR OH : rot -120:sc= -0.837 USER MOD Single : A 33 MET CE :methyl 164:sc= -0.122 (180deg=-0.64) USER MOD Single : A 34 THR OG1 : rot -57:sc= 0.709 USER MOD Single : A 35 HIS : no HE2:sc= 1.14 K(o=1.1,f=-5.1!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -160:sc= 0.717 (180deg=-1.32!) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot -170:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -1.45 K(o=-1.4,f=-9.9!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 129:sc= 1.18 USER MOD Single : A 109 THR OG1 : rot 78:sc= 0.00332 USER MOD Single : A 110 TYR OH : rot 180:sc= -0.308 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= 0.671 K(o=0.67,f=-0.66) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 138 MET CE :methyl -164:sc= -1.75 (180deg=-2.49) USER MOD Single : A 141 LYS NZ :NH3+ 168:sc= 1.26 (180deg=0.798) USER MOD Single : A 144 GLN : amide:sc= -1.42 X(o=-1.4,f=-1) USER MOD Single : A 150 HIS : no HE2:sc= 0.118 K(o=0.12,f=-5.5!) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 152 HIS : no HE2:sc= 1.02 K(o=1,f=-6.1!) USER MOD Single : A 153 HIS : no HD1:sc= -0.517 X(o=-0.52,f=-0.062) USER MOD Single : A 154 HIS : no HD1:sc= -0.0658 X(o=-0.066,f=-0.014) USER MOD Single : A 155 HIS : no HD1:sc= -0.497 X(o=-0.5,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.458 15.703 18.450 1.00 35.42 N ATOM 2 CA MET A 1 5.005 14.310 18.229 1.00 4.20 C ATOM 3 C MET A 1 3.800 14.288 17.301 1.00 53.54 C ATOM 4 O MET A 1 2.779 14.921 17.575 1.00 21.43 O ATOM 5 CB MET A 1 4.651 13.633 19.559 1.00 21.33 C ATOM 6 CG MET A 1 5.861 13.249 20.400 1.00 13.15 C ATOM 7 SD MET A 1 6.889 14.661 20.849 1.00 13.55 S ATOM 8 CE MET A 1 8.183 13.845 21.780 1.00 52.03 C ATOM 0 H1 MET A 1 6.005 15.754 19.333 1.00 35.42 H new ATOM 0 H2 MET A 1 6.056 16.004 17.654 1.00 35.42 H new ATOM 0 H3 MET A 1 4.631 16.330 18.518 1.00 35.42 H new ATOM 0 HA MET A 1 5.823 13.758 17.766 1.00 4.20 H new ATOM 0 HB2 MET A 1 4.017 14.304 20.139 1.00 21.33 H new ATOM 0 HB3 MET A 1 4.065 12.737 19.354 1.00 21.33 H new ATOM 0 HG2 MET A 1 5.521 12.751 21.308 1.00 13.15 H new ATOM 0 HG3 MET A 1 6.465 12.528 19.849 1.00 13.15 H new ATOM 0 HE1 MET A 1 8.902 14.586 22.129 1.00 52.03 H new ATOM 0 HE2 MET A 1 7.746 13.331 22.637 1.00 52.03 H new ATOM 0 HE3 MET A 1 8.689 13.121 21.142 1.00 52.03 H new ATOM 20 N GLY A 2 3.936 13.578 16.194 1.00 14.13 N ATOM 21 CA GLY A 2 2.855 13.453 15.242 1.00 12.41 C ATOM 22 C GLY A 2 3.069 12.276 14.319 1.00 52.13 C ATOM 23 O GLY A 2 3.191 12.439 13.105 1.00 24.25 O ATOM 0 H GLY A 2 4.788 13.080 15.935 1.00 14.13 H new ATOM 0 HA2 GLY A 2 1.911 13.334 15.774 1.00 12.41 H new ATOM 0 HA3 GLY A 2 2.777 14.368 14.655 1.00 12.41 H new ATOM 27 N GLU A 3 3.135 11.086 14.900 1.00 3.05 N ATOM 28 CA GLU A 3 3.381 9.878 14.132 1.00 25.42 C ATOM 29 C GLU A 3 2.072 9.251 13.670 1.00 43.54 C ATOM 30 O GLU A 3 1.334 8.666 14.463 1.00 31.13 O ATOM 31 CB GLU A 3 4.173 8.865 14.957 1.00 35.03 C ATOM 32 CG GLU A 3 5.535 9.363 15.402 1.00 13.00 C ATOM 33 CD GLU A 3 6.286 8.323 16.196 1.00 54.11 C ATOM 34 OE1 GLU A 3 5.996 8.168 17.396 1.00 35.23 O ATOM 35 OE2 GLU A 3 7.164 7.644 15.621 1.00 15.43 O ATOM 0 H GLU A 3 3.021 10.933 15.902 1.00 3.05 H new ATOM 0 HA GLU A 3 3.966 10.156 13.255 1.00 25.42 H new ATOM 0 HB2 GLU A 3 3.591 8.594 15.838 1.00 35.03 H new ATOM 0 HB3 GLU A 3 4.304 7.956 14.370 1.00 35.03 H new ATOM 0 HG2 GLU A 3 6.121 9.644 14.527 1.00 13.00 H new ATOM 0 HG3 GLU A 3 5.413 10.262 16.006 1.00 13.00 H new ATOM 42 N THR A 4 1.794 9.372 12.387 1.00 3.23 N ATOM 43 CA THR A 4 0.625 8.760 11.801 1.00 33.44 C ATOM 44 C THR A 4 1.053 7.875 10.646 1.00 23.41 C ATOM 45 O THR A 4 1.689 8.333 9.697 1.00 61.05 O ATOM 46 CB THR A 4 -0.388 9.818 11.308 1.00 14.43 C ATOM 47 OG1 THR A 4 -0.924 10.546 12.426 1.00 63.22 O ATOM 48 CG2 THR A 4 -1.529 9.174 10.531 1.00 14.24 C ATOM 0 H THR A 4 2.370 9.895 11.727 1.00 3.23 H new ATOM 0 HA THR A 4 0.129 8.164 12.567 1.00 33.44 H new ATOM 0 HB THR A 4 0.141 10.500 10.642 1.00 14.43 H new ATOM 0 HG1 THR A 4 -1.564 11.215 12.104 1.00 63.22 H new ATOM 0 HG21 THR A 4 -2.224 9.945 10.198 1.00 14.24 H new ATOM 0 HG22 THR A 4 -1.128 8.649 9.664 1.00 14.24 H new ATOM 0 HG23 THR A 4 -2.053 8.466 11.174 1.00 14.24 H new ATOM 56 N VAL A 5 0.727 6.604 10.752 1.00 50.42 N ATOM 57 CA VAL A 5 1.030 5.645 9.712 1.00 23.41 C ATOM 58 C VAL A 5 -0.172 5.516 8.789 1.00 3.21 C ATOM 59 O VAL A 5 -1.304 5.386 9.251 1.00 65.05 O ATOM 60 CB VAL A 5 1.413 4.284 10.330 1.00 42.14 C ATOM 61 CG1 VAL A 5 1.470 3.184 9.282 1.00 14.31 C ATOM 62 CG2 VAL A 5 2.734 4.400 11.073 1.00 64.13 C ATOM 0 H VAL A 5 0.246 6.208 11.559 1.00 50.42 H new ATOM 0 HA VAL A 5 1.884 5.990 9.130 1.00 23.41 H new ATOM 0 HB VAL A 5 0.635 4.006 11.041 1.00 42.14 H new ATOM 0 HG11 VAL A 5 1.743 2.242 9.758 1.00 14.31 H new ATOM 0 HG12 VAL A 5 0.494 3.082 8.808 1.00 14.31 H new ATOM 0 HG13 VAL A 5 2.214 3.438 8.528 1.00 14.31 H new ATOM 0 HG21 VAL A 5 2.994 3.434 11.505 1.00 64.13 H new ATOM 0 HG22 VAL A 5 3.516 4.710 10.379 1.00 64.13 H new ATOM 0 HG23 VAL A 5 2.640 5.140 11.868 1.00 64.13 H new ATOM 72 N VAL A 6 0.067 5.573 7.491 1.00 31.02 N ATOM 73 CA VAL A 6 -1.018 5.646 6.532 1.00 14.41 C ATOM 74 C VAL A 6 -1.618 4.273 6.267 1.00 11.52 C ATOM 75 O VAL A 6 -0.945 3.374 5.762 1.00 14.54 O ATOM 76 CB VAL A 6 -0.550 6.264 5.196 1.00 71.40 C ATOM 77 CG1 VAL A 6 -1.716 6.400 4.228 1.00 15.41 C ATOM 78 CG2 VAL A 6 0.108 7.615 5.430 1.00 32.14 C ATOM 0 H VAL A 6 1.000 5.570 7.079 1.00 31.02 H new ATOM 0 HA VAL A 6 -1.782 6.288 6.971 1.00 14.41 H new ATOM 0 HB VAL A 6 0.188 5.595 4.753 1.00 71.40 H new ATOM 0 HG11 VAL A 6 -1.364 6.837 3.294 1.00 15.41 H new ATOM 0 HG12 VAL A 6 -2.142 5.416 4.031 1.00 15.41 H new ATOM 0 HG13 VAL A 6 -2.479 7.044 4.665 1.00 15.41 H new ATOM 0 HG21 VAL A 6 0.430 8.033 4.476 1.00 32.14 H new ATOM 0 HG22 VAL A 6 -0.606 8.291 5.900 1.00 32.14 H new ATOM 0 HG23 VAL A 6 0.972 7.491 6.082 1.00 32.14 H new ATOM 88 N ARG A 7 -2.879 4.111 6.639 1.00 73.50 N ATOM 89 CA ARG A 7 -3.642 2.944 6.235 1.00 24.31 C ATOM 90 C ARG A 7 -4.652 3.368 5.182 1.00 4.24 C ATOM 91 O ARG A 7 -5.631 4.046 5.498 1.00 61.23 O ATOM 92 CB ARG A 7 -4.395 2.311 7.417 1.00 15.40 C ATOM 93 CG ARG A 7 -3.522 1.682 8.496 1.00 14.52 C ATOM 94 CD ARG A 7 -2.919 2.714 9.437 1.00 24.22 C ATOM 95 NE ARG A 7 -2.389 2.093 10.656 1.00 32.45 N ATOM 96 CZ ARG A 7 -1.825 2.764 11.666 1.00 25.23 C ATOM 97 NH1 ARG A 7 -1.729 4.088 11.625 1.00 14.24 N ATOM 98 NH2 ARG A 7 -1.379 2.105 12.729 1.00 11.45 N ATOM 0 H ARG A 7 -3.393 4.773 7.219 1.00 73.50 H new ATOM 0 HA ARG A 7 -2.947 2.202 5.844 1.00 24.31 H new ATOM 0 HB2 ARG A 7 -5.017 3.077 7.880 1.00 15.40 H new ATOM 0 HB3 ARG A 7 -5.067 1.546 7.028 1.00 15.40 H new ATOM 0 HG2 ARG A 7 -4.117 0.974 9.073 1.00 14.52 H new ATOM 0 HG3 ARG A 7 -2.720 1.114 8.024 1.00 14.52 H new ATOM 0 HD2 ARG A 7 -2.120 3.250 8.925 1.00 24.22 H new ATOM 0 HD3 ARG A 7 -3.677 3.450 9.704 1.00 24.22 H new ATOM 0 HE ARG A 7 -2.455 1.079 10.739 1.00 32.45 H new ATOM 0 HH11 ARG A 7 -2.087 4.601 10.819 1.00 14.24 H new ATOM 0 HH12 ARG A 7 -1.297 4.592 12.400 1.00 14.24 H new ATOM 0 HH21 ARG A 7 -1.467 1.090 12.774 1.00 11.45 H new ATOM 0 HH22 ARG A 7 -0.948 2.614 13.501 1.00 11.45 H new ATOM 112 N ASP A 8 -4.423 2.980 3.941 1.00 52.20 N ATOM 113 CA ASP A 8 -5.346 3.310 2.868 1.00 74.20 C ATOM 114 C ASP A 8 -5.338 2.200 1.833 1.00 63.41 C ATOM 115 O ASP A 8 -4.535 1.269 1.921 1.00 14.21 O ATOM 116 CB ASP A 8 -5.002 4.655 2.224 1.00 14.24 C ATOM 117 CG ASP A 8 -6.237 5.351 1.681 1.00 13.23 C ATOM 118 OD1 ASP A 8 -6.710 4.980 0.590 1.00 1.24 O ATOM 119 OD2 ASP A 8 -6.757 6.258 2.361 1.00 23.32 O ATOM 0 H ASP A 8 -3.609 2.438 3.651 1.00 52.20 H new ATOM 0 HA ASP A 8 -6.347 3.402 3.290 1.00 74.20 H new ATOM 0 HB2 ASP A 8 -4.517 5.297 2.959 1.00 14.24 H new ATOM 0 HB3 ASP A 8 -4.287 4.499 1.416 1.00 14.24 H new ATOM 124 N ALA A 9 -6.226 2.290 0.865 1.00 4.34 N ATOM 125 CA ALA A 9 -6.434 1.198 -0.060 1.00 30.35 C ATOM 126 C ALA A 9 -6.602 1.698 -1.480 1.00 44.33 C ATOM 127 O ALA A 9 -7.006 2.833 -1.707 1.00 52.40 O ATOM 128 CB ALA A 9 -7.656 0.406 0.359 1.00 23.35 C ATOM 0 H ALA A 9 -6.814 3.107 0.699 1.00 4.34 H new ATOM 0 HA ALA A 9 -5.553 0.557 -0.036 1.00 30.35 H new ATOM 0 HB1 ALA A 9 -7.813 -0.417 -0.338 1.00 23.35 H new ATOM 0 HB2 ALA A 9 -7.505 0.008 1.362 1.00 23.35 H new ATOM 0 HB3 ALA A 9 -8.530 1.057 0.355 1.00 23.35 H new ATOM 134 N VAL A 10 -6.277 0.845 -2.432 1.00 31.22 N ATOM 135 CA VAL A 10 -6.492 1.148 -3.832 1.00 72.01 C ATOM 136 C VAL A 10 -7.162 -0.032 -4.523 1.00 52.11 C ATOM 137 O VAL A 10 -6.864 -1.191 -4.229 1.00 65.21 O ATOM 138 CB VAL A 10 -5.178 1.528 -4.551 1.00 1.43 C ATOM 139 CG1 VAL A 10 -4.703 2.897 -4.100 1.00 32.40 C ATOM 140 CG2 VAL A 10 -4.095 0.492 -4.299 1.00 20.05 C ATOM 0 H VAL A 10 -5.860 -0.070 -2.258 1.00 31.22 H new ATOM 0 HA VAL A 10 -7.149 2.016 -3.888 1.00 72.01 H new ATOM 0 HB VAL A 10 -5.380 1.557 -5.622 1.00 1.43 H new ATOM 0 HG11 VAL A 10 -3.777 3.149 -4.616 1.00 32.40 H new ATOM 0 HG12 VAL A 10 -5.463 3.642 -4.335 1.00 32.40 H new ATOM 0 HG13 VAL A 10 -4.527 2.885 -3.024 1.00 32.40 H new ATOM 0 HG21 VAL A 10 -3.182 0.786 -4.817 1.00 20.05 H new ATOM 0 HG22 VAL A 10 -3.899 0.424 -3.229 1.00 20.05 H new ATOM 0 HG23 VAL A 10 -4.426 -0.478 -4.670 1.00 20.05 H new ATOM 150 N THR A 11 -8.086 0.266 -5.420 1.00 54.04 N ATOM 151 CA THR A 11 -8.878 -0.761 -6.073 1.00 32.31 C ATOM 152 C THR A 11 -8.442 -0.959 -7.517 1.00 72.23 C ATOM 153 O THR A 11 -8.522 -0.040 -8.334 1.00 33.34 O ATOM 154 CB THR A 11 -10.370 -0.397 -6.047 1.00 15.13 C ATOM 155 OG1 THR A 11 -10.773 -0.068 -4.712 1.00 74.12 O ATOM 156 CG2 THR A 11 -11.214 -1.547 -6.567 1.00 5.23 C ATOM 0 H THR A 11 -8.307 1.217 -5.714 1.00 54.04 H new ATOM 0 HA THR A 11 -8.719 -1.689 -5.523 1.00 32.31 H new ATOM 0 HB THR A 11 -10.522 0.467 -6.694 1.00 15.13 H new ATOM 0 HG1 THR A 11 -11.725 0.164 -4.706 1.00 74.12 H new ATOM 0 HG21 THR A 11 -12.267 -1.267 -6.539 1.00 5.23 H new ATOM 0 HG22 THR A 11 -10.926 -1.775 -7.593 1.00 5.23 H new ATOM 0 HG23 THR A 11 -11.056 -2.426 -5.942 1.00 5.23 H new ATOM 164 N ILE A 12 -7.982 -2.159 -7.820 1.00 5.34 N ATOM 165 CA ILE A 12 -7.544 -2.495 -9.165 1.00 64.25 C ATOM 166 C ILE A 12 -8.327 -3.699 -9.675 1.00 21.41 C ATOM 167 O ILE A 12 -8.620 -4.626 -8.914 1.00 62.42 O ATOM 168 CB ILE A 12 -6.025 -2.815 -9.226 1.00 24.20 C ATOM 169 CG1 ILE A 12 -5.187 -1.711 -8.580 1.00 14.31 C ATOM 170 CG2 ILE A 12 -5.579 -3.013 -10.663 1.00 45.24 C ATOM 171 CD1 ILE A 12 -5.114 -1.800 -7.075 1.00 52.01 C ATOM 0 H ILE A 12 -7.901 -2.923 -7.149 1.00 5.34 H new ATOM 0 HA ILE A 12 -7.729 -1.624 -9.793 1.00 64.25 H new ATOM 0 HB ILE A 12 -5.868 -3.736 -8.665 1.00 24.20 H new ATOM 0 HG12 ILE A 12 -4.176 -1.751 -8.986 1.00 14.31 H new ATOM 0 HG13 ILE A 12 -5.604 -0.743 -8.857 1.00 14.31 H new ATOM 0 HG21 ILE A 12 -4.512 -3.236 -10.685 1.00 45.24 H new ATOM 0 HG22 ILE A 12 -6.132 -3.842 -11.105 1.00 45.24 H new ATOM 0 HG23 ILE A 12 -5.771 -2.104 -11.232 1.00 45.24 H new ATOM 0 HD11 ILE A 12 -4.503 -0.983 -6.691 1.00 52.01 H new ATOM 0 HD12 ILE A 12 -6.118 -1.729 -6.657 1.00 52.01 H new ATOM 0 HD13 ILE A 12 -4.668 -2.752 -6.788 1.00 52.01 H new ATOM 183 N GLY A 13 -8.670 -3.689 -10.954 1.00 51.13 N ATOM 184 CA GLY A 13 -9.407 -4.797 -11.536 1.00 74.02 C ATOM 185 C GLY A 13 -8.509 -5.973 -11.883 1.00 0.23 C ATOM 186 O GLY A 13 -8.533 -6.480 -13.009 1.00 52.51 O ATOM 0 H GLY A 13 -8.452 -2.933 -11.603 1.00 51.13 H new ATOM 0 HA2 GLY A 13 -10.176 -5.125 -10.837 1.00 74.02 H new ATOM 0 HA3 GLY A 13 -9.919 -4.456 -12.436 1.00 74.02 H new ATOM 190 N LYS A 14 -7.722 -6.408 -10.905 1.00 54.13 N ATOM 191 CA LYS A 14 -6.806 -7.531 -11.073 1.00 73.44 C ATOM 192 C LYS A 14 -6.985 -8.499 -9.907 1.00 75.11 C ATOM 193 O LYS A 14 -7.226 -8.062 -8.786 1.00 24.42 O ATOM 194 CB LYS A 14 -5.360 -7.044 -11.167 1.00 40.33 C ATOM 195 CG LYS A 14 -5.092 -6.249 -12.435 1.00 13.44 C ATOM 196 CD LYS A 14 -3.615 -5.979 -12.622 1.00 52.03 C ATOM 197 CE LYS A 14 -3.353 -5.182 -13.893 1.00 42.24 C ATOM 198 NZ LYS A 14 -1.906 -4.881 -14.080 1.00 23.31 N ATOM 0 H LYS A 14 -7.701 -5.992 -9.974 1.00 54.13 H new ATOM 0 HA LYS A 14 -7.035 -8.048 -12.005 1.00 73.44 H new ATOM 0 HB2 LYS A 14 -5.132 -6.425 -10.299 1.00 40.33 H new ATOM 0 HB3 LYS A 14 -4.689 -7.902 -11.132 1.00 40.33 H new ATOM 0 HG2 LYS A 14 -5.474 -6.797 -13.296 1.00 13.44 H new ATOM 0 HG3 LYS A 14 -5.633 -5.304 -12.393 1.00 13.44 H new ATOM 0 HD2 LYS A 14 -3.232 -5.431 -11.761 1.00 52.03 H new ATOM 0 HD3 LYS A 14 -3.073 -6.924 -12.665 1.00 52.03 H new ATOM 0 HE2 LYS A 14 -3.720 -5.742 -14.753 1.00 42.24 H new ATOM 0 HE3 LYS A 14 -3.915 -4.249 -13.857 1.00 42.24 H new ATOM 0 HZ1 LYS A 14 -1.737 -4.586 -15.063 1.00 23.31 H new ATOM 0 HZ2 LYS A 14 -1.625 -4.115 -13.435 1.00 23.31 H new ATOM 0 HZ3 LYS A 14 -1.345 -5.732 -13.872 1.00 23.31 H new ATOM 212 N PRO A 15 -6.866 -9.817 -10.151 1.00 61.22 N ATOM 213 CA PRO A 15 -7.229 -10.846 -9.160 1.00 50.43 C ATOM 214 C PRO A 15 -6.526 -10.678 -7.809 1.00 23.33 C ATOM 215 O PRO A 15 -7.188 -10.506 -6.788 1.00 71.34 O ATOM 216 CB PRO A 15 -6.782 -12.150 -9.828 1.00 41.10 C ATOM 217 CG PRO A 15 -6.779 -11.852 -11.287 1.00 31.13 C ATOM 218 CD PRO A 15 -6.378 -10.411 -11.410 1.00 73.11 C ATOM 0 HA PRO A 15 -8.291 -10.800 -8.919 1.00 50.43 H new ATOM 0 HB2 PRO A 15 -5.792 -12.451 -9.484 1.00 41.10 H new ATOM 0 HB3 PRO A 15 -7.463 -12.968 -9.593 1.00 41.10 H new ATOM 0 HG2 PRO A 15 -6.080 -12.499 -11.817 1.00 31.13 H new ATOM 0 HG3 PRO A 15 -7.763 -12.022 -11.723 1.00 31.13 H new ATOM 0 HD2 PRO A 15 -5.299 -10.301 -11.515 1.00 73.11 H new ATOM 0 HD3 PRO A 15 -6.833 -9.939 -12.281 1.00 73.11 H new ATOM 226 N ALA A 16 -5.188 -10.699 -7.824 1.00 23.41 N ATOM 227 CA ALA A 16 -4.379 -10.551 -6.607 1.00 63.14 C ATOM 228 C ALA A 16 -2.906 -10.774 -6.917 1.00 42.43 C ATOM 229 O ALA A 16 -2.057 -9.946 -6.606 1.00 0.21 O ATOM 230 CB ALA A 16 -4.821 -11.531 -5.523 1.00 33.22 C ATOM 0 H ALA A 16 -4.638 -10.818 -8.674 1.00 23.41 H new ATOM 0 HA ALA A 16 -4.525 -9.535 -6.239 1.00 63.14 H new ATOM 0 HB1 ALA A 16 -4.202 -11.396 -4.636 1.00 33.22 H new ATOM 0 HB2 ALA A 16 -5.865 -11.346 -5.269 1.00 33.22 H new ATOM 0 HB3 ALA A 16 -4.712 -12.552 -5.889 1.00 33.22 H new ATOM 236 N GLU A 17 -2.625 -11.908 -7.546 1.00 52.12 N ATOM 237 CA GLU A 17 -1.259 -12.331 -7.838 1.00 1.13 C ATOM 238 C GLU A 17 -0.507 -11.283 -8.664 1.00 2.23 C ATOM 239 O GLU A 17 0.631 -10.932 -8.352 1.00 1.40 O ATOM 240 CB GLU A 17 -1.298 -13.667 -8.580 1.00 44.15 C ATOM 241 CG GLU A 17 0.060 -14.317 -8.771 1.00 32.11 C ATOM 242 CD GLU A 17 -0.039 -15.603 -9.559 1.00 43.24 C ATOM 243 OE1 GLU A 17 -0.066 -15.535 -10.807 1.00 23.30 O ATOM 244 OE2 GLU A 17 -0.110 -16.684 -8.938 1.00 3.14 O ATOM 0 H GLU A 17 -3.338 -12.562 -7.869 1.00 52.12 H new ATOM 0 HA GLU A 17 -0.722 -12.445 -6.896 1.00 1.13 H new ATOM 0 HB2 GLU A 17 -1.943 -14.354 -8.032 1.00 44.15 H new ATOM 0 HB3 GLU A 17 -1.754 -13.513 -9.558 1.00 44.15 H new ATOM 0 HG2 GLU A 17 0.725 -13.625 -9.287 1.00 32.11 H new ATOM 0 HG3 GLU A 17 0.506 -14.521 -7.797 1.00 32.11 H new ATOM 251 N GLN A 18 -1.158 -10.771 -9.702 1.00 44.31 N ATOM 252 CA GLN A 18 -0.552 -9.780 -10.590 1.00 3.11 C ATOM 253 C GLN A 18 -0.341 -8.438 -9.889 1.00 72.42 C ATOM 254 O GLN A 18 0.307 -7.543 -10.432 1.00 70.54 O ATOM 255 CB GLN A 18 -1.414 -9.585 -11.842 1.00 12.33 C ATOM 256 CG GLN A 18 -1.217 -10.659 -12.910 1.00 11.21 C ATOM 257 CD GLN A 18 -1.647 -12.045 -12.463 1.00 55.11 C ATOM 258 OE1 GLN A 18 -2.574 -12.202 -11.662 1.00 72.34 O ATOM 259 NE2 GLN A 18 -0.972 -13.061 -12.972 1.00 0.24 N ATOM 0 H GLN A 18 -2.113 -11.027 -9.952 1.00 44.31 H new ATOM 0 HA GLN A 18 0.427 -10.162 -10.880 1.00 3.11 H new ATOM 0 HB2 GLN A 18 -2.464 -9.569 -11.548 1.00 12.33 H new ATOM 0 HB3 GLN A 18 -1.189 -8.611 -12.276 1.00 12.33 H new ATOM 0 HG2 GLN A 18 -1.781 -10.382 -13.801 1.00 11.21 H new ATOM 0 HG3 GLN A 18 -0.165 -10.688 -13.195 1.00 11.21 H new ATOM 0 HE21 GLN A 18 -0.213 -12.890 -13.631 1.00 0.24 H new ATOM 0 HE22 GLN A 18 -1.211 -14.016 -12.706 1.00 0.24 H new ATOM 268 N LEU A 19 -0.879 -8.295 -8.687 1.00 11.43 N ATOM 269 CA LEU A 19 -0.749 -7.052 -7.946 1.00 61.21 C ATOM 270 C LEU A 19 0.609 -6.968 -7.257 1.00 45.24 C ATOM 271 O LEU A 19 1.071 -5.880 -6.932 1.00 14.41 O ATOM 272 CB LEU A 19 -1.891 -6.901 -6.939 1.00 2.35 C ATOM 273 CG LEU A 19 -3.283 -6.792 -7.569 1.00 51.11 C ATOM 274 CD1 LEU A 19 -4.358 -6.757 -6.498 1.00 73.22 C ATOM 275 CD2 LEU A 19 -3.378 -5.556 -8.450 1.00 4.13 C ATOM 0 H LEU A 19 -1.408 -9.023 -8.206 1.00 11.43 H new ATOM 0 HA LEU A 19 -0.813 -6.225 -8.653 1.00 61.21 H new ATOM 0 HB2 LEU A 19 -1.878 -7.756 -6.263 1.00 2.35 H new ATOM 0 HB3 LEU A 19 -1.710 -6.013 -6.333 1.00 2.35 H new ATOM 0 HG LEU A 19 -3.442 -7.674 -8.189 1.00 51.11 H new ATOM 0 HD11 LEU A 19 -5.338 -6.679 -6.969 1.00 73.22 H new ATOM 0 HD12 LEU A 19 -4.311 -7.671 -5.906 1.00 73.22 H new ATOM 0 HD13 LEU A 19 -4.198 -5.896 -5.850 1.00 73.22 H new ATOM 0 HD21 LEU A 19 -4.374 -5.497 -8.888 1.00 4.13 H new ATOM 0 HD22 LEU A 19 -3.193 -4.666 -7.849 1.00 4.13 H new ATOM 0 HD23 LEU A 19 -2.635 -5.618 -9.245 1.00 4.13 H new ATOM 287 N TYR A 20 1.261 -8.113 -7.060 1.00 51.43 N ATOM 288 CA TYR A 20 2.617 -8.121 -6.511 1.00 31.12 C ATOM 289 C TYR A 20 3.595 -7.582 -7.549 1.00 70.13 C ATOM 290 O TYR A 20 4.616 -6.982 -7.218 1.00 41.33 O ATOM 291 CB TYR A 20 3.066 -9.533 -6.115 1.00 42.40 C ATOM 292 CG TYR A 20 2.189 -10.246 -5.111 1.00 34.53 C ATOM 293 CD1 TYR A 20 1.920 -9.705 -3.857 1.00 24.35 C ATOM 294 CD2 TYR A 20 1.654 -11.488 -5.416 1.00 43.11 C ATOM 295 CE1 TYR A 20 1.136 -10.387 -2.945 1.00 50.42 C ATOM 296 CE2 TYR A 20 0.876 -12.175 -4.511 1.00 32.03 C ATOM 297 CZ TYR A 20 0.620 -11.624 -3.278 1.00 72.14 C ATOM 298 OH TYR A 20 -0.155 -12.316 -2.375 1.00 62.30 O ATOM 0 H TYR A 20 0.879 -9.036 -7.269 1.00 51.43 H new ATOM 0 HA TYR A 20 2.609 -7.494 -5.620 1.00 31.12 H new ATOM 0 HB2 TYR A 20 3.122 -10.142 -7.017 1.00 42.40 H new ATOM 0 HB3 TYR A 20 4.075 -9.472 -5.708 1.00 42.40 H new ATOM 0 HD1 TYR A 20 2.329 -8.741 -3.593 1.00 24.35 H new ATOM 0 HD2 TYR A 20 1.851 -11.926 -6.383 1.00 43.11 H new ATOM 0 HE1 TYR A 20 0.928 -9.955 -1.977 1.00 50.42 H new ATOM 0 HE2 TYR A 20 0.469 -13.142 -4.769 1.00 32.03 H new ATOM 0 HH TYR A 20 0.268 -13.177 -2.173 1.00 62.30 H new ATOM 308 N ALA A 21 3.255 -7.786 -8.816 1.00 14.20 N ATOM 309 CA ALA A 21 4.133 -7.437 -9.928 1.00 20.33 C ATOM 310 C ALA A 21 4.237 -5.925 -10.125 1.00 22.44 C ATOM 311 O ALA A 21 5.010 -5.451 -10.965 1.00 43.35 O ATOM 312 CB ALA A 21 3.633 -8.099 -11.200 1.00 42.05 C ATOM 0 H ALA A 21 2.366 -8.197 -9.102 1.00 14.20 H new ATOM 0 HA ALA A 21 5.133 -7.801 -9.691 1.00 20.33 H new ATOM 0 HB1 ALA A 21 4.290 -7.837 -12.029 1.00 42.05 H new ATOM 0 HB2 ALA A 21 3.628 -9.181 -11.069 1.00 42.05 H new ATOM 0 HB3 ALA A 21 2.622 -7.755 -11.416 1.00 42.05 H new ATOM 318 N VAL A 22 3.460 -5.179 -9.345 1.00 32.24 N ATOM 319 CA VAL A 22 3.437 -3.718 -9.432 1.00 14.23 C ATOM 320 C VAL A 22 4.814 -3.124 -9.138 1.00 33.50 C ATOM 321 O VAL A 22 5.132 -2.024 -9.589 1.00 23.35 O ATOM 322 CB VAL A 22 2.400 -3.106 -8.456 1.00 32.20 C ATOM 323 CG1 VAL A 22 2.802 -3.351 -7.008 1.00 71.01 C ATOM 324 CG2 VAL A 22 2.216 -1.618 -8.727 1.00 53.43 C ATOM 0 H VAL A 22 2.832 -5.564 -8.639 1.00 32.24 H new ATOM 0 HA VAL A 22 3.150 -3.469 -10.454 1.00 14.23 H new ATOM 0 HB VAL A 22 1.444 -3.601 -8.625 1.00 32.20 H new ATOM 0 HG11 VAL A 22 2.057 -2.911 -6.344 1.00 71.01 H new ATOM 0 HG12 VAL A 22 2.864 -4.424 -6.824 1.00 71.01 H new ATOM 0 HG13 VAL A 22 3.773 -2.894 -6.818 1.00 71.01 H new ATOM 0 HG21 VAL A 22 1.484 -1.209 -8.031 1.00 53.43 H new ATOM 0 HG22 VAL A 22 3.168 -1.104 -8.596 1.00 53.43 H new ATOM 0 HG23 VAL A 22 1.864 -1.475 -9.749 1.00 53.43 H new ATOM 334 N TRP A 23 5.630 -3.872 -8.398 1.00 10.12 N ATOM 335 CA TRP A 23 6.955 -3.415 -7.995 1.00 13.23 C ATOM 336 C TRP A 23 7.818 -3.010 -9.188 1.00 11.51 C ATOM 337 O TRP A 23 8.488 -1.976 -9.149 1.00 13.34 O ATOM 338 CB TRP A 23 7.674 -4.495 -7.187 1.00 40.01 C ATOM 339 CG TRP A 23 7.287 -4.517 -5.740 1.00 1.24 C ATOM 340 CD1 TRP A 23 6.280 -5.233 -5.161 1.00 0.34 C ATOM 341 CD2 TRP A 23 7.914 -3.781 -4.686 1.00 54.14 C ATOM 342 NE1 TRP A 23 6.243 -4.985 -3.810 1.00 60.22 N ATOM 343 CE2 TRP A 23 7.236 -4.095 -3.495 1.00 1.22 C ATOM 344 CE3 TRP A 23 8.986 -2.881 -4.635 1.00 42.34 C ATOM 345 CZ2 TRP A 23 7.596 -3.547 -2.266 1.00 63.33 C ATOM 346 CZ3 TRP A 23 9.341 -2.339 -3.414 1.00 25.35 C ATOM 347 CH2 TRP A 23 8.649 -2.672 -2.245 1.00 73.35 C ATOM 0 H TRP A 23 5.392 -4.806 -8.064 1.00 10.12 H new ATOM 0 HA TRP A 23 6.806 -2.531 -7.375 1.00 13.23 H new ATOM 0 HB2 TRP A 23 7.460 -5.469 -7.627 1.00 40.01 H new ATOM 0 HB3 TRP A 23 8.750 -4.340 -7.265 1.00 40.01 H new ATOM 0 HD1 TRP A 23 5.610 -5.897 -5.687 1.00 0.34 H new ATOM 0 HE1 TRP A 23 5.584 -5.396 -3.149 1.00 60.22 H new ATOM 0 HE3 TRP A 23 9.525 -2.616 -5.533 1.00 42.34 H new ATOM 0 HZ2 TRP A 23 7.064 -3.803 -1.362 1.00 63.33 H new ATOM 0 HZ3 TRP A 23 10.168 -1.646 -3.362 1.00 25.35 H new ATOM 0 HH2 TRP A 23 8.951 -2.230 -1.307 1.00 73.35 H new ATOM 358 N ARG A 24 7.799 -3.806 -10.252 1.00 14.14 N ATOM 359 CA ARG A 24 8.685 -3.545 -11.380 1.00 13.55 C ATOM 360 C ARG A 24 7.935 -2.959 -12.575 1.00 31.32 C ATOM 361 O ARG A 24 8.015 -1.760 -12.828 1.00 12.15 O ATOM 362 CB ARG A 24 9.446 -4.810 -11.804 1.00 1.33 C ATOM 363 CG ARG A 24 10.630 -4.514 -12.719 1.00 73.35 C ATOM 364 CD ARG A 24 11.341 -5.782 -13.169 1.00 14.20 C ATOM 365 NE ARG A 24 12.598 -5.488 -13.864 1.00 50.30 N ATOM 366 CZ ARG A 24 12.928 -5.967 -15.066 1.00 54.54 C ATOM 367 NH1 ARG A 24 12.090 -6.743 -15.741 1.00 45.02 N ATOM 368 NH2 ARG A 24 14.107 -5.670 -15.597 1.00 0.32 N ATOM 0 H ARG A 24 7.194 -4.620 -10.357 1.00 14.14 H new ATOM 0 HA ARG A 24 9.408 -2.803 -11.039 1.00 13.55 H new ATOM 0 HB2 ARG A 24 9.802 -5.329 -10.914 1.00 1.33 H new ATOM 0 HB3 ARG A 24 8.760 -5.486 -12.314 1.00 1.33 H new ATOM 0 HG2 ARG A 24 10.282 -3.965 -13.594 1.00 73.35 H new ATOM 0 HG3 ARG A 24 11.337 -3.869 -12.198 1.00 73.35 H new ATOM 0 HD2 ARG A 24 11.544 -6.411 -12.302 1.00 14.20 H new ATOM 0 HD3 ARG A 24 10.686 -6.351 -13.829 1.00 14.20 H new ATOM 0 HE ARG A 24 13.267 -4.875 -13.397 1.00 50.30 H new ATOM 0 HH11 ARG A 24 11.181 -6.980 -15.343 1.00 45.02 H new ATOM 0 HH12 ARG A 24 12.354 -7.102 -16.658 1.00 45.02 H new ATOM 0 HH21 ARG A 24 14.761 -5.076 -15.087 1.00 0.32 H new ATOM 0 HH22 ARG A 24 14.360 -6.036 -16.515 1.00 0.32 H new ATOM 382 N ASP A 25 7.199 -3.797 -13.301 1.00 61.22 N ATOM 383 CA ASP A 25 6.650 -3.376 -14.592 1.00 74.20 C ATOM 384 C ASP A 25 5.303 -4.041 -14.893 1.00 25.35 C ATOM 385 O ASP A 25 4.710 -3.810 -15.945 1.00 22.43 O ATOM 386 CB ASP A 25 7.674 -3.707 -15.686 1.00 24.33 C ATOM 387 CG ASP A 25 7.354 -3.077 -17.025 1.00 54.34 C ATOM 388 OD1 ASP A 25 7.768 -1.921 -17.260 1.00 11.23 O ATOM 389 OD2 ASP A 25 6.716 -3.739 -17.861 1.00 64.14 O ATOM 0 H ASP A 25 6.971 -4.753 -13.027 1.00 61.22 H new ATOM 0 HA ASP A 25 6.463 -2.303 -14.560 1.00 74.20 H new ATOM 0 HB2 ASP A 25 8.660 -3.373 -15.363 1.00 24.33 H new ATOM 0 HB3 ASP A 25 7.728 -4.789 -15.806 1.00 24.33 H new ATOM 394 N LEU A 26 4.812 -4.831 -13.941 1.00 75.33 N ATOM 395 CA LEU A 26 3.579 -5.610 -14.123 1.00 14.14 C ATOM 396 C LEU A 26 3.684 -6.571 -15.316 1.00 65.24 C ATOM 397 O LEU A 26 2.944 -6.444 -16.294 1.00 63.54 O ATOM 398 CB LEU A 26 2.381 -4.675 -14.322 1.00 14.45 C ATOM 399 CG LEU A 26 2.016 -3.814 -13.113 1.00 45.03 C ATOM 400 CD1 LEU A 26 1.112 -2.669 -13.533 1.00 60.04 C ATOM 401 CD2 LEU A 26 1.336 -4.658 -12.047 1.00 44.33 C ATOM 0 H LEU A 26 5.249 -4.952 -13.028 1.00 75.33 H new ATOM 0 HA LEU A 26 3.434 -6.203 -13.220 1.00 14.14 H new ATOM 0 HB2 LEU A 26 2.591 -4.017 -15.166 1.00 14.45 H new ATOM 0 HB3 LEU A 26 1.513 -5.276 -14.594 1.00 14.45 H new ATOM 0 HG LEU A 26 2.933 -3.399 -12.695 1.00 45.03 H new ATOM 0 HD11 LEU A 26 0.861 -2.065 -12.661 1.00 60.04 H new ATOM 0 HD12 LEU A 26 1.627 -2.050 -14.267 1.00 60.04 H new ATOM 0 HD13 LEU A 26 0.198 -3.069 -13.973 1.00 60.04 H new ATOM 0 HD21 LEU A 26 1.082 -4.030 -11.193 1.00 44.33 H new ATOM 0 HD22 LEU A 26 0.427 -5.098 -12.457 1.00 44.33 H new ATOM 0 HD23 LEU A 26 2.011 -5.452 -11.726 1.00 44.33 H new ATOM 413 N PRO A 27 4.598 -7.554 -15.246 1.00 5.12 N ATOM 414 CA PRO A 27 4.787 -8.530 -16.307 1.00 64.33 C ATOM 415 C PRO A 27 4.025 -9.834 -16.055 1.00 55.52 C ATOM 416 O PRO A 27 3.678 -10.161 -14.914 1.00 53.24 O ATOM 417 CB PRO A 27 6.292 -8.765 -16.245 1.00 22.23 C ATOM 418 CG PRO A 27 6.659 -8.580 -14.802 1.00 1.23 C ATOM 419 CD PRO A 27 5.547 -7.784 -14.151 1.00 24.50 C ATOM 0 HA PRO A 27 4.416 -8.185 -17.272 1.00 64.33 H new ATOM 0 HB2 PRO A 27 6.549 -9.766 -16.592 1.00 22.23 H new ATOM 0 HB3 PRO A 27 6.827 -8.060 -16.881 1.00 22.23 H new ATOM 0 HG2 PRO A 27 6.779 -9.545 -14.310 1.00 1.23 H new ATOM 0 HG3 PRO A 27 7.610 -8.055 -14.712 1.00 1.23 H new ATOM 0 HD2 PRO A 27 5.087 -8.335 -13.331 1.00 24.50 H new ATOM 0 HD3 PRO A 27 5.916 -6.846 -13.737 1.00 24.50 H new ATOM 427 N GLY A 28 3.780 -10.586 -17.120 1.00 51.24 N ATOM 428 CA GLY A 28 3.079 -11.851 -16.992 1.00 23.25 C ATOM 429 C GLY A 28 4.016 -12.997 -16.681 1.00 62.24 C ATOM 430 O GLY A 28 4.028 -14.004 -17.390 1.00 25.53 O ATOM 0 H GLY A 28 4.054 -10.343 -18.072 1.00 51.24 H new ATOM 0 HA2 GLY A 28 2.331 -11.771 -16.203 1.00 23.25 H new ATOM 0 HA3 GLY A 28 2.544 -12.063 -17.918 1.00 23.25 H new ATOM 434 N LEU A 29 4.810 -12.842 -15.630 1.00 44.20 N ATOM 435 CA LEU A 29 5.731 -13.885 -15.205 1.00 0.30 C ATOM 436 C LEU A 29 5.386 -14.395 -13.806 1.00 31.55 C ATOM 437 O LEU A 29 5.974 -13.958 -12.824 1.00 70.23 O ATOM 438 CB LEU A 29 7.181 -13.378 -15.210 1.00 60.40 C ATOM 439 CG LEU A 29 7.862 -13.262 -16.579 1.00 2.30 C ATOM 440 CD1 LEU A 29 7.782 -14.581 -17.330 1.00 63.51 C ATOM 441 CD2 LEU A 29 7.273 -12.128 -17.406 1.00 13.34 C ATOM 0 H LEU A 29 4.834 -12.000 -15.055 1.00 44.20 H new ATOM 0 HA LEU A 29 5.633 -14.704 -15.917 1.00 0.30 H new ATOM 0 HB2 LEU A 29 7.201 -12.397 -14.735 1.00 60.40 H new ATOM 0 HB3 LEU A 29 7.778 -14.045 -14.588 1.00 60.40 H new ATOM 0 HG LEU A 29 8.912 -13.026 -16.407 1.00 2.30 H new ATOM 0 HD11 LEU A 29 8.271 -14.478 -18.299 1.00 63.51 H new ATOM 0 HD12 LEU A 29 8.281 -15.359 -16.753 1.00 63.51 H new ATOM 0 HD13 LEU A 29 6.737 -14.853 -17.478 1.00 63.51 H new ATOM 0 HD21 LEU A 29 7.781 -12.078 -18.369 1.00 13.34 H new ATOM 0 HD22 LEU A 29 6.210 -12.308 -17.566 1.00 13.34 H new ATOM 0 HD23 LEU A 29 7.405 -11.185 -16.876 1.00 13.34 H new ATOM 453 N PRO A 30 4.403 -15.299 -13.683 1.00 42.41 N ATOM 454 CA PRO A 30 4.111 -15.970 -12.416 1.00 54.40 C ATOM 455 C PRO A 30 5.091 -17.108 -12.146 1.00 33.30 C ATOM 456 O PRO A 30 5.196 -17.608 -11.028 1.00 50.23 O ATOM 457 CB PRO A 30 2.689 -16.528 -12.610 1.00 45.31 C ATOM 458 CG PRO A 30 2.223 -16.026 -13.940 1.00 43.23 C ATOM 459 CD PRO A 30 3.461 -15.701 -14.729 1.00 64.54 C ATOM 0 HA PRO A 30 4.196 -15.293 -11.566 1.00 54.40 H new ATOM 0 HB2 PRO A 30 2.691 -17.618 -12.584 1.00 45.31 H new ATOM 0 HB3 PRO A 30 2.026 -16.191 -11.813 1.00 45.31 H new ATOM 0 HG2 PRO A 30 1.623 -16.779 -14.451 1.00 43.23 H new ATOM 0 HG3 PRO A 30 1.594 -15.143 -13.823 1.00 43.23 H new ATOM 0 HD2 PRO A 30 3.822 -16.562 -15.292 1.00 64.54 H new ATOM 0 HD3 PRO A 30 3.286 -14.901 -15.448 1.00 64.54 H new ATOM 467 N LEU A 31 5.830 -17.490 -13.181 1.00 12.44 N ATOM 468 CA LEU A 31 6.704 -18.655 -13.115 1.00 40.22 C ATOM 469 C LEU A 31 8.140 -18.264 -12.780 1.00 71.10 C ATOM 470 O LEU A 31 9.045 -19.087 -12.865 1.00 4.25 O ATOM 471 CB LEU A 31 6.688 -19.422 -14.448 1.00 4.44 C ATOM 472 CG LEU A 31 5.317 -19.916 -14.930 1.00 51.35 C ATOM 473 CD1 LEU A 31 4.550 -18.804 -15.633 1.00 50.13 C ATOM 474 CD2 LEU A 31 5.480 -21.115 -15.850 1.00 40.41 C ATOM 0 H LEU A 31 5.841 -17.007 -14.080 1.00 12.44 H new ATOM 0 HA LEU A 31 6.323 -19.295 -12.319 1.00 40.22 H new ATOM 0 HB2 LEU A 31 7.110 -18.778 -15.219 1.00 4.44 H new ATOM 0 HB3 LEU A 31 7.349 -20.284 -14.355 1.00 4.44 H new ATOM 0 HG LEU A 31 4.741 -20.221 -14.057 1.00 51.35 H new ATOM 0 HD11 LEU A 31 3.583 -19.182 -15.964 1.00 50.13 H new ATOM 0 HD12 LEU A 31 4.398 -17.974 -14.943 1.00 50.13 H new ATOM 0 HD13 LEU A 31 5.119 -18.459 -16.496 1.00 50.13 H new ATOM 0 HD21 LEU A 31 4.499 -21.454 -16.183 1.00 40.41 H new ATOM 0 HD22 LEU A 31 6.079 -20.831 -16.715 1.00 40.41 H new ATOM 0 HD23 LEU A 31 5.979 -21.921 -15.312 1.00 40.41 H new ATOM 486 N LEU A 32 8.353 -17.018 -12.377 1.00 32.23 N ATOM 487 CA LEU A 32 9.706 -16.544 -12.095 1.00 20.03 C ATOM 488 C LEU A 32 10.249 -17.120 -10.786 1.00 55.34 C ATOM 489 O LEU A 32 11.444 -17.025 -10.506 1.00 13.25 O ATOM 490 CB LEU A 32 9.767 -15.004 -12.091 1.00 4.22 C ATOM 491 CG LEU A 32 8.639 -14.269 -11.348 1.00 15.13 C ATOM 492 CD1 LEU A 32 8.714 -14.489 -9.849 1.00 75.01 C ATOM 493 CD2 LEU A 32 8.686 -12.781 -11.661 1.00 22.44 C ATOM 0 H LEU A 32 7.619 -16.324 -12.239 1.00 32.23 H new ATOM 0 HA LEU A 32 10.348 -16.904 -12.899 1.00 20.03 H new ATOM 0 HB2 LEU A 32 10.717 -14.702 -11.650 1.00 4.22 H new ATOM 0 HB3 LEU A 32 9.772 -14.661 -13.126 1.00 4.22 H new ATOM 0 HG LEU A 32 7.692 -14.682 -11.696 1.00 15.13 H new ATOM 0 HD11 LEU A 32 7.900 -13.953 -9.361 1.00 75.01 H new ATOM 0 HD12 LEU A 32 8.628 -15.554 -9.633 1.00 75.01 H new ATOM 0 HD13 LEU A 32 9.668 -14.118 -9.474 1.00 75.01 H new ATOM 0 HD21 LEU A 32 7.882 -12.272 -11.129 1.00 22.44 H new ATOM 0 HD22 LEU A 32 9.646 -12.373 -11.345 1.00 22.44 H new ATOM 0 HD23 LEU A 32 8.563 -12.631 -12.734 1.00 22.44 H new ATOM 505 N MET A 33 9.374 -17.731 -9.995 1.00 63.42 N ATOM 506 CA MET A 33 9.775 -18.259 -8.696 1.00 70.11 C ATOM 507 C MET A 33 9.858 -19.787 -8.713 1.00 1.11 C ATOM 508 O MET A 33 10.278 -20.405 -7.733 1.00 34.04 O ATOM 509 CB MET A 33 8.801 -17.787 -7.607 1.00 50.12 C ATOM 510 CG MET A 33 9.247 -18.129 -6.188 1.00 53.11 C ATOM 511 SD MET A 33 8.104 -17.533 -4.926 1.00 21.43 S ATOM 512 CE MET A 33 6.616 -18.431 -5.360 1.00 73.32 C ATOM 0 H MET A 33 8.391 -17.872 -10.227 1.00 63.42 H new ATOM 0 HA MET A 33 10.771 -17.876 -8.472 1.00 70.11 H new ATOM 0 HB2 MET A 33 8.677 -16.707 -7.688 1.00 50.12 H new ATOM 0 HB3 MET A 33 7.824 -18.235 -7.788 1.00 50.12 H new ATOM 0 HG2 MET A 33 9.349 -19.210 -6.096 1.00 53.11 H new ATOM 0 HG3 MET A 33 10.233 -17.699 -6.010 1.00 53.11 H new ATOM 0 HE1 MET A 33 5.914 -18.396 -4.527 1.00 73.32 H new ATOM 0 HE2 MET A 33 6.159 -17.975 -6.238 1.00 73.32 H new ATOM 0 HE3 MET A 33 6.868 -19.469 -5.579 1.00 73.32 H new ATOM 522 N THR A 34 9.473 -20.400 -9.824 1.00 72.12 N ATOM 523 CA THR A 34 9.511 -21.850 -9.921 1.00 31.52 C ATOM 524 C THR A 34 10.928 -22.325 -10.226 1.00 1.41 C ATOM 525 O THR A 34 11.599 -22.888 -9.360 1.00 1.34 O ATOM 526 CB THR A 34 8.526 -22.380 -10.983 1.00 3.14 C ATOM 527 OG1 THR A 34 8.753 -21.737 -12.242 1.00 11.20 O ATOM 528 CG2 THR A 34 7.088 -22.147 -10.543 1.00 50.01 C ATOM 0 H THR A 34 9.135 -19.922 -10.660 1.00 72.12 H new ATOM 0 HA THR A 34 9.201 -22.252 -8.956 1.00 31.52 H new ATOM 0 HB THR A 34 8.693 -23.451 -11.094 1.00 3.14 H new ATOM 0 HG1 THR A 34 8.665 -20.767 -12.134 1.00 11.20 H new ATOM 0 HG21 THR A 34 6.408 -22.528 -11.305 1.00 50.01 H new ATOM 0 HG22 THR A 34 6.906 -22.667 -9.602 1.00 50.01 H new ATOM 0 HG23 THR A 34 6.918 -21.079 -10.406 1.00 50.01 H new ATOM 536 N HIS A 35 11.385 -22.085 -11.450 1.00 72.12 N ATOM 537 CA HIS A 35 12.751 -22.409 -11.838 1.00 2.12 C ATOM 538 C HIS A 35 13.083 -21.823 -13.207 1.00 24.54 C ATOM 539 O HIS A 35 12.759 -22.406 -14.240 1.00 13.24 O ATOM 540 CB HIS A 35 12.985 -23.928 -11.841 1.00 1.13 C ATOM 541 CG HIS A 35 14.375 -24.323 -12.246 1.00 5.11 C ATOM 542 ND1 HIS A 35 15.496 -23.997 -11.514 1.00 75.02 N ATOM 543 CD2 HIS A 35 14.823 -25.005 -13.327 1.00 21.05 C ATOM 544 CE1 HIS A 35 16.568 -24.459 -12.126 1.00 21.30 C ATOM 545 NE2 HIS A 35 16.191 -25.077 -13.231 1.00 52.41 N ATOM 0 H HIS A 35 10.826 -21.665 -12.193 1.00 72.12 H new ATOM 0 HA HIS A 35 13.415 -21.963 -11.098 1.00 2.12 H new ATOM 0 HB2 HIS A 35 12.781 -24.320 -10.845 1.00 1.13 H new ATOM 0 HB3 HIS A 35 12.272 -24.395 -12.520 1.00 1.13 H new ATOM 0 HD1 HIS A 35 15.496 -23.479 -10.635 1.00 75.02 H new ATOM 0 HD2 HIS A 35 14.216 -25.417 -14.119 1.00 21.05 H new ATOM 0 HE1 HIS A 35 17.586 -24.350 -11.781 1.00 21.30 H new ATOM 554 N LEU A 36 13.710 -20.656 -13.192 1.00 44.12 N ATOM 555 CA LEU A 36 14.221 -20.013 -14.401 1.00 63.00 C ATOM 556 C LEU A 36 15.133 -18.856 -14.012 1.00 75.43 C ATOM 557 O LEU A 36 16.064 -18.505 -14.737 1.00 43.34 O ATOM 558 CB LEU A 36 13.084 -19.561 -15.340 1.00 11.14 C ATOM 559 CG LEU A 36 11.904 -18.817 -14.699 1.00 62.43 C ATOM 560 CD1 LEU A 36 12.248 -17.365 -14.407 1.00 21.14 C ATOM 561 CD2 LEU A 36 10.685 -18.903 -15.605 1.00 1.44 C ATOM 0 H LEU A 36 13.881 -20.123 -12.339 1.00 44.12 H new ATOM 0 HA LEU A 36 14.802 -20.742 -14.965 1.00 63.00 H new ATOM 0 HB2 LEU A 36 13.514 -18.917 -16.107 1.00 11.14 H new ATOM 0 HB3 LEU A 36 12.693 -20.443 -15.847 1.00 11.14 H new ATOM 0 HG LEU A 36 11.679 -19.297 -13.747 1.00 62.43 H new ATOM 0 HD11 LEU A 36 11.388 -16.871 -13.954 1.00 21.14 H new ATOM 0 HD12 LEU A 36 13.094 -17.322 -13.721 1.00 21.14 H new ATOM 0 HD13 LEU A 36 12.509 -16.859 -15.336 1.00 21.14 H new ATOM 0 HD21 LEU A 36 9.851 -18.373 -15.144 1.00 1.44 H new ATOM 0 HD22 LEU A 36 10.915 -18.449 -16.569 1.00 1.44 H new ATOM 0 HD23 LEU A 36 10.414 -19.948 -15.752 1.00 1.44 H new ATOM 573 N ARG A 37 14.839 -18.265 -12.851 1.00 30.35 N ATOM 574 CA ARG A 37 15.734 -17.317 -12.188 1.00 12.34 C ATOM 575 C ARG A 37 15.876 -15.997 -12.945 1.00 72.23 C ATOM 576 O ARG A 37 16.711 -15.162 -12.598 1.00 72.20 O ATOM 577 CB ARG A 37 17.105 -17.959 -11.962 1.00 0.22 C ATOM 578 CG ARG A 37 17.043 -19.195 -11.078 1.00 71.24 C ATOM 579 CD ARG A 37 18.411 -19.823 -10.883 1.00 71.41 C ATOM 580 NE ARG A 37 19.338 -18.922 -10.208 1.00 11.41 N ATOM 581 CZ ARG A 37 19.977 -19.216 -9.077 1.00 21.20 C ATOM 582 NH1 ARG A 37 19.714 -20.339 -8.417 1.00 41.34 N ATOM 583 NH2 ARG A 37 20.854 -18.360 -8.580 1.00 13.50 N ATOM 0 H ARG A 37 13.970 -18.432 -12.344 1.00 30.35 H new ATOM 0 HA ARG A 37 15.282 -17.072 -11.227 1.00 12.34 H new ATOM 0 HB2 ARG A 37 17.537 -18.229 -12.926 1.00 0.22 H new ATOM 0 HB3 ARG A 37 17.773 -17.227 -11.508 1.00 0.22 H new ATOM 0 HG2 ARG A 37 16.626 -18.926 -10.108 1.00 71.24 H new ATOM 0 HG3 ARG A 37 16.368 -19.926 -11.524 1.00 71.24 H new ATOM 0 HD2 ARG A 37 18.309 -20.739 -10.302 1.00 71.41 H new ATOM 0 HD3 ARG A 37 18.821 -20.105 -11.853 1.00 71.41 H new ATOM 0 HE ARG A 37 19.508 -18.009 -10.629 1.00 11.41 H new ATOM 0 HH11 ARG A 37 19.015 -20.989 -8.775 1.00 41.34 H new ATOM 0 HH12 ARG A 37 20.211 -20.551 -7.552 1.00 41.34 H new ATOM 0 HH21 ARG A 37 21.038 -17.480 -9.062 1.00 13.50 H new ATOM 0 HH22 ARG A 37 21.347 -18.579 -7.714 1.00 13.50 H new ATOM 597 N SER A 38 15.059 -15.803 -13.968 1.00 72.24 N ATOM 598 CA SER A 38 15.036 -14.538 -14.684 1.00 63.13 C ATOM 599 C SER A 38 14.137 -13.543 -13.962 1.00 45.25 C ATOM 600 O SER A 38 12.927 -13.504 -14.191 1.00 45.14 O ATOM 601 CB SER A 38 14.558 -14.743 -16.121 1.00 32.24 C ATOM 602 OG SER A 38 15.406 -15.650 -16.804 1.00 65.35 O ATOM 0 H SER A 38 14.405 -16.503 -14.320 1.00 72.24 H new ATOM 0 HA SER A 38 16.049 -14.137 -14.714 1.00 63.13 H new ATOM 0 HB2 SER A 38 13.536 -15.123 -16.119 1.00 32.24 H new ATOM 0 HB3 SER A 38 14.542 -13.787 -16.645 1.00 32.24 H new ATOM 0 HG SER A 38 15.084 -15.771 -17.722 1.00 65.35 H new ATOM 608 N VAL A 39 14.731 -12.774 -13.060 1.00 2.44 N ATOM 609 CA VAL A 39 14.000 -11.784 -12.290 1.00 35.13 C ATOM 610 C VAL A 39 14.969 -10.745 -11.726 1.00 23.15 C ATOM 611 O VAL A 39 16.134 -11.047 -11.458 1.00 14.44 O ATOM 612 CB VAL A 39 13.187 -12.443 -11.145 1.00 14.44 C ATOM 613 CG1 VAL A 39 14.104 -13.047 -10.090 1.00 4.41 C ATOM 614 CG2 VAL A 39 12.218 -11.448 -10.515 1.00 31.42 C ATOM 0 H VAL A 39 15.727 -12.820 -12.844 1.00 2.44 H new ATOM 0 HA VAL A 39 13.292 -11.291 -12.956 1.00 35.13 H new ATOM 0 HB VAL A 39 12.603 -13.253 -11.583 1.00 14.44 H new ATOM 0 HG11 VAL A 39 13.503 -13.501 -9.302 1.00 4.41 H new ATOM 0 HG12 VAL A 39 14.735 -13.808 -10.549 1.00 4.41 H new ATOM 0 HG13 VAL A 39 14.732 -12.265 -9.663 1.00 4.41 H new ATOM 0 HG21 VAL A 39 11.662 -11.938 -9.716 1.00 31.42 H new ATOM 0 HG22 VAL A 39 12.776 -10.606 -10.105 1.00 31.42 H new ATOM 0 HG23 VAL A 39 11.522 -11.088 -11.273 1.00 31.42 H new ATOM 624 N GLU A 40 14.486 -9.526 -11.566 1.00 43.32 N ATOM 625 CA GLU A 40 15.299 -8.422 -11.082 1.00 23.35 C ATOM 626 C GLU A 40 15.052 -8.218 -9.586 1.00 63.12 C ATOM 627 O GLU A 40 14.559 -9.129 -8.916 1.00 11.15 O ATOM 628 CB GLU A 40 14.956 -7.169 -11.890 1.00 11.33 C ATOM 629 CG GLU A 40 16.043 -6.108 -11.901 1.00 22.44 C ATOM 630 CD GLU A 40 15.877 -5.141 -13.054 1.00 75.12 C ATOM 631 OE1 GLU A 40 14.965 -4.290 -12.995 1.00 45.30 O ATOM 632 OE2 GLU A 40 16.631 -5.258 -14.044 1.00 15.44 O ATOM 0 H GLU A 40 13.519 -9.272 -11.768 1.00 43.32 H new ATOM 0 HA GLU A 40 16.359 -8.639 -11.213 1.00 23.35 H new ATOM 0 HB2 GLU A 40 14.742 -7.462 -12.918 1.00 11.33 H new ATOM 0 HB3 GLU A 40 14.043 -6.731 -11.487 1.00 11.33 H new ATOM 0 HG2 GLU A 40 16.023 -5.558 -10.960 1.00 22.44 H new ATOM 0 HG3 GLU A 40 17.019 -6.589 -11.968 1.00 22.44 H new ATOM 639 N VAL A 41 15.434 -7.050 -9.062 1.00 45.12 N ATOM 640 CA VAL A 41 15.202 -6.706 -7.655 1.00 13.24 C ATOM 641 C VAL A 41 13.782 -7.076 -7.232 1.00 31.43 C ATOM 642 O VAL A 41 12.813 -6.738 -7.917 1.00 53.22 O ATOM 643 CB VAL A 41 15.446 -5.202 -7.403 1.00 50.34 C ATOM 644 CG1 VAL A 41 15.199 -4.844 -5.946 1.00 75.01 C ATOM 645 CG2 VAL A 41 16.859 -4.827 -7.810 1.00 1.20 C ATOM 0 H VAL A 41 15.909 -6.321 -9.595 1.00 45.12 H new ATOM 0 HA VAL A 41 15.910 -7.279 -7.056 1.00 13.24 H new ATOM 0 HB VAL A 41 14.741 -4.635 -8.011 1.00 50.34 H new ATOM 0 HG11 VAL A 41 15.378 -3.779 -5.798 1.00 75.01 H new ATOM 0 HG12 VAL A 41 14.167 -5.078 -5.684 1.00 75.01 H new ATOM 0 HG13 VAL A 41 15.874 -5.418 -5.311 1.00 75.01 H new ATOM 0 HG21 VAL A 41 17.020 -3.764 -7.628 1.00 1.20 H new ATOM 0 HG22 VAL A 41 17.572 -5.408 -7.225 1.00 1.20 H new ATOM 0 HG23 VAL A 41 17.001 -5.039 -8.870 1.00 1.20 H new ATOM 655 N LEU A 42 13.670 -7.765 -6.106 1.00 30.31 N ATOM 656 CA LEU A 42 12.418 -8.393 -5.722 1.00 62.50 C ATOM 657 C LEU A 42 12.048 -8.038 -4.278 1.00 53.04 C ATOM 658 O LEU A 42 11.000 -7.440 -4.038 1.00 54.44 O ATOM 659 CB LEU A 42 12.553 -9.914 -5.925 1.00 41.02 C ATOM 660 CG LEU A 42 11.255 -10.726 -5.959 1.00 51.44 C ATOM 661 CD1 LEU A 42 10.821 -11.106 -4.558 1.00 53.35 C ATOM 662 CD2 LEU A 42 10.156 -9.953 -6.670 1.00 60.22 C ATOM 0 H LEU A 42 14.433 -7.903 -5.443 1.00 30.31 H new ATOM 0 HA LEU A 42 11.606 -8.022 -6.348 1.00 62.50 H new ATOM 0 HB2 LEU A 42 13.085 -10.086 -6.861 1.00 41.02 H new ATOM 0 HB3 LEU A 42 13.179 -10.309 -5.125 1.00 41.02 H new ATOM 0 HG LEU A 42 11.443 -11.643 -6.517 1.00 51.44 H new ATOM 0 HD11 LEU A 42 9.897 -11.682 -4.607 1.00 53.35 H new ATOM 0 HD12 LEU A 42 11.599 -11.707 -4.087 1.00 53.35 H new ATOM 0 HD13 LEU A 42 10.655 -10.203 -3.971 1.00 53.35 H new ATOM 0 HD21 LEU A 42 9.243 -10.548 -6.683 1.00 60.22 H new ATOM 0 HD22 LEU A 42 9.971 -9.016 -6.144 1.00 60.22 H new ATOM 0 HD23 LEU A 42 10.465 -9.740 -7.693 1.00 60.22 H new ATOM 674 N ASP A 43 12.906 -8.428 -3.328 1.00 3.35 N ATOM 675 CA ASP A 43 12.742 -8.088 -1.898 1.00 72.31 C ATOM 676 C ASP A 43 11.618 -8.875 -1.221 1.00 15.13 C ATOM 677 O ASP A 43 11.773 -9.330 -0.089 1.00 52.24 O ATOM 678 CB ASP A 43 12.523 -6.581 -1.690 1.00 21.45 C ATOM 679 CG ASP A 43 13.814 -5.783 -1.706 1.00 62.41 C ATOM 680 OD1 ASP A 43 14.290 -5.422 -2.803 1.00 41.44 O ATOM 681 OD2 ASP A 43 14.353 -5.496 -0.616 1.00 5.42 O ATOM 0 H ASP A 43 13.736 -8.988 -3.523 1.00 3.35 H new ATOM 0 HA ASP A 43 13.679 -8.377 -1.422 1.00 72.31 H new ATOM 0 HB2 ASP A 43 11.861 -6.205 -2.470 1.00 21.45 H new ATOM 0 HB3 ASP A 43 12.016 -6.422 -0.738 1.00 21.45 H new ATOM 686 N ASP A 44 10.500 -9.030 -1.921 1.00 3.11 N ATOM 687 CA ASP A 44 9.327 -9.756 -1.407 1.00 40.22 C ATOM 688 C ASP A 44 9.712 -11.105 -0.799 1.00 5.14 C ATOM 689 O ASP A 44 9.215 -11.486 0.261 1.00 33.30 O ATOM 690 CB ASP A 44 8.300 -9.963 -2.529 1.00 14.53 C ATOM 691 CG ASP A 44 7.209 -10.954 -2.161 1.00 32.45 C ATOM 692 OD1 ASP A 44 6.250 -10.570 -1.464 1.00 22.30 O ATOM 693 OD2 ASP A 44 7.312 -12.133 -2.562 1.00 71.33 O ATOM 0 H ASP A 44 10.373 -8.658 -2.862 1.00 3.11 H new ATOM 0 HA ASP A 44 8.887 -9.149 -0.616 1.00 40.22 H new ATOM 0 HB2 ASP A 44 7.844 -9.005 -2.777 1.00 14.53 H new ATOM 0 HB3 ASP A 44 8.814 -10.313 -3.424 1.00 14.53 H new ATOM 698 N LYS A 45 10.593 -11.824 -1.475 1.00 32.23 N ATOM 699 CA LYS A 45 11.100 -13.080 -0.973 1.00 31.33 C ATOM 700 C LYS A 45 12.618 -13.054 -0.926 1.00 12.44 C ATOM 701 O LYS A 45 13.288 -13.861 -1.576 1.00 53.23 O ATOM 702 CB LYS A 45 10.604 -14.240 -1.824 1.00 20.21 C ATOM 703 CG LYS A 45 9.148 -14.546 -1.572 1.00 54.11 C ATOM 704 CD LYS A 45 8.895 -14.687 -0.081 1.00 23.05 C ATOM 705 CE LYS A 45 7.427 -14.553 0.255 1.00 45.05 C ATOM 706 NZ LYS A 45 6.876 -13.224 -0.124 1.00 0.14 N ATOM 0 H LYS A 45 10.972 -11.551 -2.382 1.00 32.23 H new ATOM 0 HA LYS A 45 10.727 -13.224 0.041 1.00 31.33 H new ATOM 0 HB2 LYS A 45 10.747 -14.003 -2.878 1.00 20.21 H new ATOM 0 HB3 LYS A 45 11.202 -15.126 -1.612 1.00 20.21 H new ATOM 0 HG2 LYS A 45 8.525 -13.750 -1.981 1.00 54.11 H new ATOM 0 HG3 LYS A 45 8.868 -15.466 -2.085 1.00 54.11 H new ATOM 0 HD2 LYS A 45 9.259 -15.657 0.259 1.00 23.05 H new ATOM 0 HD3 LYS A 45 9.462 -13.927 0.457 1.00 23.05 H new ATOM 0 HE2 LYS A 45 6.867 -15.335 -0.258 1.00 45.05 H new ATOM 0 HE3 LYS A 45 7.286 -14.710 1.324 1.00 45.05 H new ATOM 0 HZ1 LYS A 45 6.001 -13.046 0.409 1.00 0.14 H new ATOM 0 HZ2 LYS A 45 7.572 -12.484 0.097 1.00 0.14 H new ATOM 0 HZ3 LYS A 45 6.669 -13.212 -1.143 1.00 0.14 H new ATOM 720 N ARG A 46 13.136 -12.093 -0.165 1.00 44.42 N ATOM 721 CA ARG A 46 14.572 -11.918 0.054 1.00 54.45 C ATOM 722 C ARG A 46 15.274 -11.334 -1.172 1.00 74.24 C ATOM 723 O ARG A 46 14.782 -11.412 -2.302 1.00 2.33 O ATOM 724 CB ARG A 46 15.265 -13.226 0.472 1.00 12.15 C ATOM 725 CG ARG A 46 14.953 -13.683 1.892 1.00 55.22 C ATOM 726 CD ARG A 46 13.612 -14.385 1.983 1.00 10.51 C ATOM 727 NE ARG A 46 13.565 -15.570 1.127 1.00 62.10 N ATOM 728 CZ ARG A 46 12.543 -16.423 1.086 1.00 30.32 C ATOM 729 NH1 ARG A 46 11.496 -16.265 1.889 1.00 14.13 N ATOM 730 NH2 ARG A 46 12.573 -17.455 0.252 1.00 4.20 N ATOM 0 H ARG A 46 12.564 -11.404 0.324 1.00 44.42 H new ATOM 0 HA ARG A 46 14.659 -11.207 0.876 1.00 54.45 H new ATOM 0 HB2 ARG A 46 14.973 -14.014 -0.222 1.00 12.15 H new ATOM 0 HB3 ARG A 46 16.343 -13.098 0.374 1.00 12.15 H new ATOM 0 HG2 ARG A 46 15.738 -14.356 2.237 1.00 55.22 H new ATOM 0 HG3 ARG A 46 14.957 -12.821 2.559 1.00 55.22 H new ATOM 0 HD2 ARG A 46 13.422 -14.674 3.017 1.00 10.51 H new ATOM 0 HD3 ARG A 46 12.819 -13.695 1.694 1.00 10.51 H new ATOM 0 HE ARG A 46 14.366 -15.755 0.523 1.00 62.10 H new ATOM 0 HH11 ARG A 46 11.470 -15.484 2.545 1.00 14.13 H new ATOM 0 HH12 ARG A 46 10.719 -16.924 1.849 1.00 14.13 H new ATOM 0 HH21 ARG A 46 13.379 -17.595 -0.358 1.00 4.20 H new ATOM 0 HH22 ARG A 46 11.790 -18.108 0.221 1.00 4.20 H new ATOM 744 N SER A 47 16.422 -10.731 -0.922 1.00 41.24 N ATOM 745 CA SER A 47 17.259 -10.176 -1.969 1.00 0.22 C ATOM 746 C SER A 47 18.527 -11.013 -2.118 1.00 21.55 C ATOM 747 O SER A 47 19.570 -10.515 -2.552 1.00 75.24 O ATOM 748 CB SER A 47 17.623 -8.737 -1.607 1.00 1.25 C ATOM 749 OG SER A 47 16.477 -8.011 -1.195 1.00 20.20 O ATOM 0 H SER A 47 16.801 -10.612 0.017 1.00 41.24 H new ATOM 0 HA SER A 47 16.718 -10.188 -2.915 1.00 0.22 H new ATOM 0 HB2 SER A 47 18.365 -8.736 -0.809 1.00 1.25 H new ATOM 0 HB3 SER A 47 18.079 -8.246 -2.467 1.00 1.25 H new ATOM 0 HG SER A 47 16.735 -7.094 -0.967 1.00 20.20 H new ATOM 755 N ARG A 48 18.420 -12.296 -1.788 1.00 72.12 N ATOM 756 CA ARG A 48 19.579 -13.189 -1.765 1.00 5.04 C ATOM 757 C ARG A 48 19.893 -13.714 -3.169 1.00 21.20 C ATOM 758 O ARG A 48 20.208 -14.889 -3.352 1.00 63.24 O ATOM 759 CB ARG A 48 19.324 -14.357 -0.802 1.00 31.44 C ATOM 760 CG ARG A 48 20.542 -14.735 0.035 1.00 63.12 C ATOM 761 CD ARG A 48 20.951 -16.189 -0.168 1.00 12.31 C ATOM 762 NE ARG A 48 21.328 -16.457 -1.553 1.00 62.02 N ATOM 763 CZ ARG A 48 22.071 -17.488 -1.953 1.00 1.25 C ATOM 764 NH1 ARG A 48 22.543 -18.370 -1.080 1.00 61.23 N ATOM 765 NH2 ARG A 48 22.343 -17.632 -3.240 1.00 54.42 N ATOM 0 H ARG A 48 17.540 -12.744 -1.532 1.00 72.12 H new ATOM 0 HA ARG A 48 20.443 -12.623 -1.415 1.00 5.04 H new ATOM 0 HB2 ARG A 48 18.503 -14.095 -0.135 1.00 31.44 H new ATOM 0 HB3 ARG A 48 19.004 -15.227 -1.376 1.00 31.44 H new ATOM 0 HG2 ARG A 48 21.377 -14.085 -0.227 1.00 63.12 H new ATOM 0 HG3 ARG A 48 20.323 -14.565 1.089 1.00 63.12 H new ATOM 0 HD2 ARG A 48 21.788 -16.427 0.489 1.00 12.31 H new ATOM 0 HD3 ARG A 48 20.126 -16.842 0.117 1.00 12.31 H new ATOM 0 HE ARG A 48 20.998 -15.807 -2.267 1.00 62.02 H new ATOM 0 HH11 ARG A 48 22.338 -18.264 -0.086 1.00 61.23 H new ATOM 0 HH12 ARG A 48 23.110 -19.154 -1.403 1.00 61.23 H new ATOM 0 HH21 ARG A 48 21.985 -16.957 -3.916 1.00 54.42 H new ATOM 0 HH22 ARG A 48 22.911 -18.418 -3.556 1.00 54.42 H new ATOM 779 N TRP A 49 19.825 -12.813 -4.145 1.00 25.01 N ATOM 780 CA TRP A 49 20.111 -13.118 -5.545 1.00 22.43 C ATOM 781 C TRP A 49 19.116 -14.129 -6.115 1.00 31.04 C ATOM 782 O TRP A 49 19.359 -15.340 -6.106 1.00 73.34 O ATOM 783 CB TRP A 49 21.555 -13.607 -5.730 1.00 73.12 C ATOM 784 CG TRP A 49 21.944 -13.767 -7.170 1.00 5.03 C ATOM 785 CD1 TRP A 49 21.727 -12.872 -8.177 1.00 41.05 C ATOM 786 CD2 TRP A 49 22.625 -14.880 -7.763 1.00 54.14 C ATOM 787 NE1 TRP A 49 22.216 -13.365 -9.360 1.00 51.10 N ATOM 788 CE2 TRP A 49 22.779 -14.592 -9.132 1.00 43.53 C ATOM 789 CE3 TRP A 49 23.121 -16.092 -7.270 1.00 1.10 C ATOM 790 CZ2 TRP A 49 23.404 -15.471 -10.012 1.00 31.03 C ATOM 791 CZ3 TRP A 49 23.742 -16.962 -8.145 1.00 24.44 C ATOM 792 CH2 TRP A 49 23.880 -16.647 -9.502 1.00 74.31 C ATOM 0 H TRP A 49 19.567 -11.839 -3.985 1.00 25.01 H new ATOM 0 HA TRP A 49 19.998 -12.190 -6.105 1.00 22.43 H new ATOM 0 HB2 TRP A 49 22.235 -12.901 -5.253 1.00 73.12 H new ATOM 0 HB3 TRP A 49 21.677 -14.562 -5.219 1.00 73.12 H new ATOM 0 HD1 TRP A 49 21.241 -11.915 -8.060 1.00 41.05 H new ATOM 0 HE1 TRP A 49 22.168 -12.894 -10.263 1.00 51.10 H new ATOM 0 HE3 TRP A 49 23.020 -16.343 -6.224 1.00 1.10 H new ATOM 0 HZ2 TRP A 49 23.509 -15.233 -11.060 1.00 31.03 H new ATOM 0 HZ3 TRP A 49 24.128 -17.901 -7.776 1.00 24.44 H new ATOM 0 HH2 TRP A 49 24.373 -17.348 -10.160 1.00 74.31 H new ATOM 803 N THR A 50 17.990 -13.606 -6.599 1.00 63.10 N ATOM 804 CA THR A 50 16.962 -14.406 -7.266 1.00 32.33 C ATOM 805 C THR A 50 16.145 -15.254 -6.278 1.00 60.22 C ATOM 806 O THR A 50 16.659 -15.738 -5.268 1.00 11.14 O ATOM 807 CB THR A 50 17.581 -15.318 -8.344 1.00 24.31 C ATOM 808 OG1 THR A 50 18.422 -14.544 -9.213 1.00 41.22 O ATOM 809 CG2 THR A 50 16.499 -16.001 -9.166 1.00 55.12 C ATOM 0 H THR A 50 17.764 -12.613 -6.540 1.00 63.10 H new ATOM 0 HA THR A 50 16.282 -13.698 -7.740 1.00 32.33 H new ATOM 0 HB THR A 50 18.173 -16.083 -7.842 1.00 24.31 H new ATOM 0 HG1 THR A 50 18.814 -15.129 -9.895 1.00 41.22 H new ATOM 0 HG21 THR A 50 16.962 -16.638 -9.919 1.00 55.12 H new ATOM 0 HG22 THR A 50 15.874 -16.608 -8.512 1.00 55.12 H new ATOM 0 HG23 THR A 50 15.885 -15.247 -9.657 1.00 55.12 H new ATOM 817 N VAL A 51 14.863 -15.421 -6.581 1.00 71.01 N ATOM 818 CA VAL A 51 13.974 -16.228 -5.757 1.00 12.33 C ATOM 819 C VAL A 51 14.065 -17.713 -6.118 1.00 72.53 C ATOM 820 O VAL A 51 13.335 -18.215 -6.972 1.00 11.10 O ATOM 821 CB VAL A 51 12.512 -15.742 -5.860 1.00 42.11 C ATOM 822 CG1 VAL A 51 12.329 -14.449 -5.085 1.00 25.11 C ATOM 823 CG2 VAL A 51 12.099 -15.535 -7.311 1.00 51.33 C ATOM 0 H VAL A 51 14.415 -15.005 -7.397 1.00 71.01 H new ATOM 0 HA VAL A 51 14.303 -16.108 -4.725 1.00 12.33 H new ATOM 0 HB VAL A 51 11.875 -16.514 -5.429 1.00 42.11 H new ATOM 0 HG11 VAL A 51 11.293 -14.119 -5.167 1.00 25.11 H new ATOM 0 HG12 VAL A 51 12.575 -14.616 -4.036 1.00 25.11 H new ATOM 0 HG13 VAL A 51 12.987 -13.683 -5.495 1.00 25.11 H new ATOM 0 HG21 VAL A 51 11.065 -15.193 -7.350 1.00 51.33 H new ATOM 0 HG22 VAL A 51 12.746 -14.788 -7.770 1.00 51.33 H new ATOM 0 HG23 VAL A 51 12.190 -16.476 -7.853 1.00 51.33 H new ATOM 833 N GLU A 52 14.993 -18.398 -5.467 1.00 21.12 N ATOM 834 CA GLU A 52 15.189 -19.832 -5.652 1.00 2.42 C ATOM 835 C GLU A 52 16.175 -20.341 -4.611 1.00 60.04 C ATOM 836 O GLU A 52 16.065 -21.466 -4.119 1.00 2.43 O ATOM 837 CB GLU A 52 15.715 -20.150 -7.061 1.00 63.53 C ATOM 838 CG GLU A 52 15.926 -21.640 -7.302 1.00 73.21 C ATOM 839 CD GLU A 52 16.433 -21.961 -8.694 1.00 13.34 C ATOM 840 OE1 GLU A 52 17.668 -21.988 -8.892 1.00 13.21 O ATOM 841 OE2 GLU A 52 15.600 -22.199 -9.595 1.00 73.24 O ATOM 0 H GLU A 52 15.633 -17.977 -4.794 1.00 21.12 H new ATOM 0 HA GLU A 52 14.226 -20.329 -5.533 1.00 2.42 H new ATOM 0 HB2 GLU A 52 15.012 -19.765 -7.800 1.00 63.53 H new ATOM 0 HB3 GLU A 52 16.658 -19.626 -7.216 1.00 63.53 H new ATOM 0 HG2 GLU A 52 16.636 -22.022 -6.568 1.00 73.21 H new ATOM 0 HG3 GLU A 52 14.984 -22.164 -7.137 1.00 73.21 H new ATOM 848 N ALA A 53 17.130 -19.481 -4.281 1.00 32.14 N ATOM 849 CA ALA A 53 18.179 -19.799 -3.326 1.00 64.43 C ATOM 850 C ALA A 53 17.611 -20.099 -1.940 1.00 43.32 C ATOM 851 O ALA A 53 16.561 -19.574 -1.561 1.00 45.15 O ATOM 852 CB ALA A 53 19.168 -18.649 -3.252 1.00 23.22 C ATOM 0 H ALA A 53 17.197 -18.541 -4.670 1.00 32.14 H new ATOM 0 HA ALA A 53 18.689 -20.698 -3.671 1.00 64.43 H new ATOM 0 HB1 ALA A 53 19.953 -18.890 -2.535 1.00 23.22 H new ATOM 0 HB2 ALA A 53 19.611 -18.486 -4.235 1.00 23.22 H new ATOM 0 HB3 ALA A 53 18.651 -17.744 -2.933 1.00 23.22 H new ATOM 858 N PRO A 54 18.293 -20.969 -1.180 1.00 40.32 N ATOM 859 CA PRO A 54 17.892 -21.323 0.177 1.00 32.12 C ATOM 860 C PRO A 54 18.452 -20.361 1.223 1.00 21.05 C ATOM 861 O PRO A 54 19.137 -19.393 0.879 1.00 12.22 O ATOM 862 CB PRO A 54 18.504 -22.707 0.347 1.00 74.43 C ATOM 863 CG PRO A 54 19.756 -22.666 -0.461 1.00 44.11 C ATOM 864 CD PRO A 54 19.510 -21.695 -1.591 1.00 11.01 C ATOM 0 HA PRO A 54 16.812 -21.285 0.316 1.00 32.12 H new ATOM 0 HB2 PRO A 54 18.715 -22.921 1.395 1.00 74.43 H new ATOM 0 HB3 PRO A 54 17.829 -23.486 -0.008 1.00 74.43 H new ATOM 0 HG2 PRO A 54 20.600 -22.344 0.149 1.00 44.11 H new ATOM 0 HG3 PRO A 54 20.000 -23.656 -0.847 1.00 44.11 H new ATOM 0 HD2 PRO A 54 20.353 -21.017 -1.725 1.00 11.01 H new ATOM 0 HD3 PRO A 54 19.364 -22.214 -2.538 1.00 11.01 H new ATOM 872 N ALA A 55 18.158 -20.655 2.496 1.00 72.14 N ATOM 873 CA ALA A 55 18.602 -19.848 3.636 1.00 22.24 C ATOM 874 C ALA A 55 17.846 -18.523 3.706 1.00 22.50 C ATOM 875 O ALA A 55 17.497 -17.937 2.682 1.00 60.41 O ATOM 876 CB ALA A 55 20.107 -19.616 3.596 1.00 70.20 C ATOM 0 H ALA A 55 17.601 -21.466 2.764 1.00 72.14 H new ATOM 0 HA ALA A 55 18.375 -20.409 4.542 1.00 22.24 H new ATOM 0 HB1 ALA A 55 20.405 -19.014 4.455 1.00 70.20 H new ATOM 0 HB2 ALA A 55 20.624 -20.575 3.628 1.00 70.20 H new ATOM 0 HB3 ALA A 55 20.370 -19.092 2.677 1.00 70.20 H new ATOM 882 N PRO A 56 17.553 -18.045 4.925 1.00 10.21 N ATOM 883 CA PRO A 56 16.823 -16.793 5.117 1.00 35.32 C ATOM 884 C PRO A 56 17.618 -15.575 4.662 1.00 74.13 C ATOM 885 O PRO A 56 17.131 -14.769 3.879 1.00 74.44 O ATOM 886 CB PRO A 56 16.569 -16.741 6.628 1.00 32.43 C ATOM 887 CG PRO A 56 17.596 -17.641 7.229 1.00 61.21 C ATOM 888 CD PRO A 56 17.875 -18.705 6.205 1.00 32.35 C ATOM 0 HA PRO A 56 15.909 -16.768 4.523 1.00 35.32 H new ATOM 0 HB2 PRO A 56 16.665 -15.724 7.009 1.00 32.43 H new ATOM 0 HB3 PRO A 56 15.561 -17.078 6.870 1.00 32.43 H new ATOM 0 HG2 PRO A 56 18.503 -17.088 7.472 1.00 61.21 H new ATOM 0 HG3 PRO A 56 17.232 -18.081 8.158 1.00 61.21 H new ATOM 0 HD2 PRO A 56 18.915 -19.031 6.238 1.00 32.35 H new ATOM 0 HD3 PRO A 56 17.258 -19.589 6.367 1.00 32.35 H new ATOM 896 N LEU A 57 18.846 -15.455 5.147 1.00 1.43 N ATOM 897 CA LEU A 57 19.681 -14.300 4.830 1.00 10.12 C ATOM 898 C LEU A 57 21.059 -14.743 4.367 1.00 61.25 C ATOM 899 O LEU A 57 21.972 -13.934 4.195 1.00 75.11 O ATOM 900 CB LEU A 57 19.801 -13.370 6.044 1.00 64.32 C ATOM 901 CG LEU A 57 20.722 -13.823 7.191 1.00 73.23 C ATOM 902 CD1 LEU A 57 20.744 -12.774 8.289 1.00 35.34 C ATOM 903 CD2 LEU A 57 20.295 -15.167 7.770 1.00 32.41 C ATOM 0 H LEU A 57 19.287 -16.140 5.760 1.00 1.43 H new ATOM 0 HA LEU A 57 19.205 -13.751 4.018 1.00 10.12 H new ATOM 0 HB2 LEU A 57 20.152 -12.400 5.692 1.00 64.32 H new ATOM 0 HB3 LEU A 57 18.802 -13.218 6.453 1.00 64.32 H new ATOM 0 HG LEU A 57 21.723 -13.943 6.777 1.00 73.23 H new ATOM 0 HD11 LEU A 57 21.399 -13.105 9.095 1.00 35.34 H new ATOM 0 HD12 LEU A 57 21.114 -11.832 7.885 1.00 35.34 H new ATOM 0 HD13 LEU A 57 19.735 -12.631 8.676 1.00 35.34 H new ATOM 0 HD21 LEU A 57 20.973 -15.448 8.576 1.00 32.41 H new ATOM 0 HD22 LEU A 57 19.280 -15.089 8.160 1.00 32.41 H new ATOM 0 HD23 LEU A 57 20.327 -15.926 6.989 1.00 32.41 H new ATOM 915 N GLY A 58 21.191 -16.038 4.166 1.00 44.05 N ATOM 916 CA GLY A 58 22.451 -16.601 3.729 1.00 15.11 C ATOM 917 C GLY A 58 23.462 -16.702 4.853 1.00 64.31 C ATOM 918 O GLY A 58 23.702 -17.784 5.385 1.00 12.04 O ATOM 0 H GLY A 58 20.443 -16.719 4.298 1.00 44.05 H new ATOM 0 HA2 GLY A 58 22.277 -17.593 3.311 1.00 15.11 H new ATOM 0 HA3 GLY A 58 22.862 -15.986 2.929 1.00 15.11 H new ATOM 922 N ALA A 59 24.043 -15.571 5.221 1.00 14.11 N ATOM 923 CA ALA A 59 25.043 -15.537 6.275 1.00 13.45 C ATOM 924 C ALA A 59 24.551 -14.710 7.458 1.00 11.45 C ATOM 925 O ALA A 59 23.982 -15.246 8.409 1.00 4.51 O ATOM 926 CB ALA A 59 26.358 -14.986 5.737 1.00 4.02 C ATOM 0 H ALA A 59 23.838 -14.663 4.804 1.00 14.11 H new ATOM 0 HA ALA A 59 25.214 -16.555 6.625 1.00 13.45 H new ATOM 0 HB1 ALA A 59 27.098 -14.966 6.537 1.00 4.02 H new ATOM 0 HB2 ALA A 59 26.715 -15.623 4.928 1.00 4.02 H new ATOM 0 HB3 ALA A 59 26.202 -13.975 5.361 1.00 4.02 H new ATOM 932 N VAL A 60 24.755 -13.402 7.387 1.00 51.25 N ATOM 933 CA VAL A 60 24.298 -12.493 8.431 1.00 22.42 C ATOM 934 C VAL A 60 24.076 -11.102 7.836 1.00 10.42 C ATOM 935 O VAL A 60 23.952 -10.102 8.545 1.00 22.13 O ATOM 936 CB VAL A 60 25.309 -12.440 9.603 1.00 21.42 C ATOM 937 CG1 VAL A 60 26.568 -11.678 9.213 1.00 55.30 C ATOM 938 CG2 VAL A 60 24.668 -11.846 10.848 1.00 44.43 C ATOM 0 H VAL A 60 25.237 -12.944 6.613 1.00 51.25 H new ATOM 0 HA VAL A 60 23.354 -12.861 8.832 1.00 22.42 H new ATOM 0 HB VAL A 60 25.604 -13.463 9.835 1.00 21.42 H new ATOM 0 HG11 VAL A 60 27.258 -11.659 10.057 1.00 55.30 H new ATOM 0 HG12 VAL A 60 27.045 -12.172 8.366 1.00 55.30 H new ATOM 0 HG13 VAL A 60 26.304 -10.657 8.936 1.00 55.30 H new ATOM 0 HG21 VAL A 60 25.399 -11.820 11.656 1.00 44.43 H new ATOM 0 HG22 VAL A 60 24.327 -10.833 10.634 1.00 44.43 H new ATOM 0 HG23 VAL A 60 23.818 -12.459 11.147 1.00 44.43 H new ATOM 948 N SER A 61 24.012 -11.062 6.516 1.00 20.04 N ATOM 949 CA SER A 61 23.785 -9.826 5.794 1.00 74.51 C ATOM 950 C SER A 61 22.353 -9.354 6.017 1.00 11.02 C ATOM 951 O SER A 61 21.495 -10.145 6.419 1.00 74.04 O ATOM 952 CB SER A 61 24.053 -10.062 4.311 1.00 62.02 C ATOM 953 OG SER A 61 25.250 -10.809 4.142 1.00 24.30 O ATOM 0 H SER A 61 24.116 -11.882 5.919 1.00 20.04 H new ATOM 0 HA SER A 61 24.459 -9.051 6.158 1.00 74.51 H new ATOM 0 HB2 SER A 61 23.215 -10.597 3.863 1.00 62.02 H new ATOM 0 HB3 SER A 61 24.135 -9.107 3.792 1.00 62.02 H new ATOM 0 HG SER A 61 25.412 -10.956 3.187 1.00 24.30 H new ATOM 959 N TRP A 62 22.088 -8.076 5.782 1.00 62.31 N ATOM 960 CA TRP A 62 20.753 -7.554 6.010 1.00 10.25 C ATOM 961 C TRP A 62 19.826 -8.097 4.940 1.00 75.21 C ATOM 962 O TRP A 62 20.082 -7.928 3.746 1.00 33.41 O ATOM 963 CB TRP A 62 20.710 -6.027 5.979 1.00 13.40 C ATOM 964 CG TRP A 62 21.920 -5.328 6.546 1.00 15.34 C ATOM 965 CD1 TRP A 62 22.474 -4.174 6.071 1.00 64.23 C ATOM 966 CD2 TRP A 62 22.722 -5.716 7.677 1.00 52.54 C ATOM 967 NE1 TRP A 62 23.559 -3.818 6.832 1.00 2.21 N ATOM 968 CE2 TRP A 62 23.736 -4.747 7.818 1.00 32.05 C ATOM 969 CE3 TRP A 62 22.688 -6.784 8.580 1.00 41.12 C ATOM 970 CZ2 TRP A 62 24.697 -4.813 8.824 1.00 43.21 C ATOM 971 CZ3 TRP A 62 23.645 -6.847 9.576 1.00 71.05 C ATOM 972 CH2 TRP A 62 24.637 -5.868 9.690 1.00 43.14 C ATOM 0 H TRP A 62 22.767 -7.395 5.440 1.00 62.31 H new ATOM 0 HA TRP A 62 20.438 -7.871 7.004 1.00 10.25 H new ATOM 0 HB2 TRP A 62 20.579 -5.706 4.946 1.00 13.40 H new ATOM 0 HB3 TRP A 62 19.830 -5.695 6.530 1.00 13.40 H new ATOM 0 HD1 TRP A 62 22.110 -3.620 5.218 1.00 64.23 H new ATOM 0 HE1 TRP A 62 24.140 -2.993 6.685 1.00 2.21 H new ATOM 0 HE3 TRP A 62 21.927 -7.546 8.500 1.00 41.12 H new ATOM 0 HZ2 TRP A 62 25.463 -4.057 8.916 1.00 43.21 H new ATOM 0 HZ3 TRP A 62 23.626 -7.667 10.279 1.00 71.05 H new ATOM 0 HH2 TRP A 62 25.371 -5.947 10.479 1.00 43.14 H new ATOM 983 N GLU A 63 18.759 -8.739 5.368 1.00 53.52 N ATOM 984 CA GLU A 63 17.855 -9.401 4.448 1.00 65.41 C ATOM 985 C GLU A 63 16.407 -9.208 4.878 1.00 10.22 C ATOM 986 O GLU A 63 16.113 -9.016 6.066 1.00 41.41 O ATOM 987 CB GLU A 63 18.199 -10.890 4.373 1.00 52.54 C ATOM 988 CG GLU A 63 17.397 -11.656 3.337 1.00 11.10 C ATOM 989 CD GLU A 63 17.531 -11.070 1.949 1.00 34.54 C ATOM 990 OE1 GLU A 63 16.810 -10.095 1.641 1.00 51.31 O ATOM 991 OE2 GLU A 63 18.333 -11.592 1.154 1.00 34.22 O ATOM 0 H GLU A 63 18.495 -8.817 6.350 1.00 53.52 H new ATOM 0 HA GLU A 63 17.972 -8.957 3.459 1.00 65.41 H new ATOM 0 HB2 GLU A 63 19.260 -10.997 4.148 1.00 52.54 H new ATOM 0 HB3 GLU A 63 18.034 -11.341 5.352 1.00 52.54 H new ATOM 0 HG2 GLU A 63 17.727 -12.695 3.322 1.00 11.10 H new ATOM 0 HG3 GLU A 63 16.346 -11.660 3.626 1.00 11.10 H new ATOM 998 N ALA A 64 15.510 -9.259 3.905 1.00 35.13 N ATOM 999 CA ALA A 64 14.094 -9.071 4.147 1.00 54.15 C ATOM 1000 C ALA A 64 13.349 -10.395 4.091 1.00 14.23 C ATOM 1001 O ALA A 64 13.268 -11.033 3.044 1.00 44.43 O ATOM 1002 CB ALA A 64 13.523 -8.108 3.116 1.00 50.33 C ATOM 0 H ALA A 64 15.746 -9.432 2.928 1.00 35.13 H new ATOM 0 HA ALA A 64 13.967 -8.654 5.146 1.00 54.15 H new ATOM 0 HB1 ALA A 64 12.458 -7.968 3.300 1.00 50.33 H new ATOM 0 HB2 ALA A 64 14.034 -7.148 3.193 1.00 50.33 H new ATOM 0 HB3 ALA A 64 13.668 -8.517 2.116 1.00 50.33 H new ATOM 1008 N GLU A 65 12.803 -10.800 5.226 1.00 1.04 N ATOM 1009 CA GLU A 65 11.957 -11.978 5.288 1.00 0.42 C ATOM 1010 C GLU A 65 10.559 -11.584 5.732 1.00 30.43 C ATOM 1011 O GLU A 65 10.398 -10.791 6.654 1.00 34.52 O ATOM 1012 CB GLU A 65 12.529 -13.001 6.260 1.00 63.04 C ATOM 1013 CG GLU A 65 12.791 -14.361 5.629 1.00 72.34 C ATOM 1014 CD GLU A 65 11.541 -14.984 5.030 1.00 75.25 C ATOM 1015 OE1 GLU A 65 11.138 -14.574 3.918 1.00 61.05 O ATOM 1016 OE2 GLU A 65 10.960 -15.891 5.661 1.00 40.42 O ATOM 0 H GLU A 65 12.932 -10.327 6.120 1.00 1.04 H new ATOM 0 HA GLU A 65 11.914 -12.424 4.295 1.00 0.42 H new ATOM 0 HB2 GLU A 65 13.461 -12.616 6.673 1.00 63.04 H new ATOM 0 HB3 GLU A 65 11.838 -13.124 7.094 1.00 63.04 H new ATOM 0 HG2 GLU A 65 13.547 -14.256 4.851 1.00 72.34 H new ATOM 0 HG3 GLU A 65 13.201 -15.033 6.383 1.00 72.34 H new ATOM 1023 N LEU A 66 9.552 -12.137 5.084 1.00 24.21 N ATOM 1024 CA LEU A 66 8.175 -11.799 5.411 1.00 32.52 C ATOM 1025 C LEU A 66 7.626 -12.753 6.460 1.00 12.11 C ATOM 1026 O LEU A 66 7.699 -13.970 6.302 1.00 74.33 O ATOM 1027 CB LEU A 66 7.308 -11.808 4.149 1.00 33.33 C ATOM 1028 CG LEU A 66 7.253 -10.477 3.387 1.00 61.31 C ATOM 1029 CD1 LEU A 66 8.643 -9.893 3.193 1.00 52.21 C ATOM 1030 CD2 LEU A 66 6.581 -10.670 2.040 1.00 24.24 C ATOM 0 H LEU A 66 9.657 -12.818 4.332 1.00 24.21 H new ATOM 0 HA LEU A 66 8.153 -10.792 5.829 1.00 32.52 H new ATOM 0 HB2 LEU A 66 7.682 -12.579 3.476 1.00 33.33 H new ATOM 0 HB3 LEU A 66 6.293 -12.092 4.426 1.00 33.33 H new ATOM 0 HG LEU A 66 6.670 -9.775 3.983 1.00 61.31 H new ATOM 0 HD11 LEU A 66 8.569 -8.951 2.650 1.00 52.21 H new ATOM 0 HD12 LEU A 66 9.102 -9.716 4.166 1.00 52.21 H new ATOM 0 HD13 LEU A 66 9.255 -10.593 2.624 1.00 52.21 H new ATOM 0 HD21 LEU A 66 6.549 -9.718 1.510 1.00 24.24 H new ATOM 0 HD22 LEU A 66 7.146 -11.394 1.452 1.00 24.24 H new ATOM 0 HD23 LEU A 66 5.566 -11.037 2.189 1.00 24.24 H new ATOM 1042 N THR A 67 7.067 -12.193 7.527 1.00 74.52 N ATOM 1043 CA THR A 67 6.626 -12.995 8.667 1.00 63.43 C ATOM 1044 C THR A 67 5.395 -13.823 8.305 1.00 41.10 C ATOM 1045 O THR A 67 5.178 -14.909 8.846 1.00 54.21 O ATOM 1046 CB THR A 67 6.323 -12.112 9.907 1.00 12.52 C ATOM 1047 OG1 THR A 67 6.027 -12.925 11.050 1.00 34.43 O ATOM 1048 CG2 THR A 67 5.158 -11.171 9.648 1.00 32.21 C ATOM 0 H THR A 67 6.908 -11.191 7.628 1.00 74.52 H new ATOM 0 HA THR A 67 7.445 -13.668 8.922 1.00 63.43 H new ATOM 0 HB THR A 67 7.216 -11.519 10.104 1.00 12.52 H new ATOM 0 HG1 THR A 67 5.840 -12.350 11.821 1.00 34.43 H new ATOM 0 HG21 THR A 67 4.973 -10.568 10.537 1.00 32.21 H new ATOM 0 HG22 THR A 67 5.398 -10.517 8.809 1.00 32.21 H new ATOM 0 HG23 THR A 67 4.266 -11.752 9.412 1.00 32.21 H new ATOM 1056 N ALA A 68 4.609 -13.312 7.371 1.00 31.20 N ATOM 1057 CA ALA A 68 3.413 -13.996 6.918 1.00 50.21 C ATOM 1058 C ALA A 68 3.180 -13.704 5.450 1.00 23.24 C ATOM 1059 O ALA A 68 3.235 -12.550 5.025 1.00 42.51 O ATOM 1060 CB ALA A 68 2.207 -13.571 7.739 1.00 14.44 C ATOM 0 H ALA A 68 4.782 -12.419 6.910 1.00 31.20 H new ATOM 0 HA ALA A 68 3.553 -15.069 7.050 1.00 50.21 H new ATOM 0 HB1 ALA A 68 1.321 -14.096 7.382 1.00 14.44 H new ATOM 0 HB2 ALA A 68 2.376 -13.815 8.788 1.00 14.44 H new ATOM 0 HB3 ALA A 68 2.058 -12.496 7.637 1.00 14.44 H new ATOM 1066 N ASP A 69 2.935 -14.745 4.681 1.00 22.30 N ATOM 1067 CA ASP A 69 2.730 -14.599 3.249 1.00 60.43 C ATOM 1068 C ASP A 69 1.637 -15.547 2.785 1.00 14.33 C ATOM 1069 O ASP A 69 1.892 -16.718 2.495 1.00 15.45 O ATOM 1070 CB ASP A 69 4.031 -14.876 2.488 1.00 10.12 C ATOM 1071 CG ASP A 69 3.935 -14.543 1.009 1.00 72.44 C ATOM 1072 OD1 ASP A 69 3.499 -15.409 0.224 1.00 51.23 O ATOM 1073 OD2 ASP A 69 4.323 -13.421 0.624 1.00 32.52 O ATOM 0 H ASP A 69 2.872 -15.704 5.022 1.00 22.30 H new ATOM 0 HA ASP A 69 2.423 -13.574 3.042 1.00 60.43 H new ATOM 0 HB2 ASP A 69 4.838 -14.294 2.934 1.00 10.12 H new ATOM 0 HB3 ASP A 69 4.295 -15.927 2.602 1.00 10.12 H new ATOM 1078 N GLU A 70 0.412 -15.053 2.775 1.00 44.45 N ATOM 1079 CA GLU A 70 -0.719 -15.841 2.322 1.00 54.51 C ATOM 1080 C GLU A 70 -0.994 -15.526 0.856 1.00 64.34 C ATOM 1081 O GLU A 70 -0.895 -14.371 0.443 1.00 20.22 O ATOM 1082 CB GLU A 70 -1.953 -15.514 3.167 1.00 14.24 C ATOM 1083 CG GLU A 70 -1.743 -15.674 4.667 1.00 1.32 C ATOM 1084 CD GLU A 70 -1.581 -17.117 5.094 1.00 60.11 C ATOM 1085 OE1 GLU A 70 -2.605 -17.778 5.367 1.00 13.45 O ATOM 1086 OE2 GLU A 70 -0.435 -17.599 5.166 1.00 62.21 O ATOM 0 H GLU A 70 0.175 -14.108 3.076 1.00 44.45 H new ATOM 0 HA GLU A 70 -0.491 -16.902 2.429 1.00 54.51 H new ATOM 0 HB2 GLU A 70 -2.259 -14.488 2.962 1.00 14.24 H new ATOM 0 HB3 GLU A 70 -2.774 -16.160 2.856 1.00 14.24 H new ATOM 0 HG2 GLU A 70 -0.858 -15.112 4.966 1.00 1.32 H new ATOM 0 HG3 GLU A 70 -2.591 -15.238 5.195 1.00 1.32 H new ATOM 1093 N PRO A 71 -1.373 -16.536 0.061 1.00 41.44 N ATOM 1094 CA PRO A 71 -1.582 -16.366 -1.380 1.00 24.40 C ATOM 1095 C PRO A 71 -2.786 -15.484 -1.701 1.00 35.05 C ATOM 1096 O PRO A 71 -3.923 -15.957 -1.743 1.00 33.42 O ATOM 1097 CB PRO A 71 -1.809 -17.795 -1.885 1.00 23.23 C ATOM 1098 CG PRO A 71 -2.282 -18.553 -0.692 1.00 12.11 C ATOM 1099 CD PRO A 71 -1.612 -17.923 0.497 1.00 72.04 C ATOM 0 HA PRO A 71 -0.737 -15.865 -1.852 1.00 24.40 H new ATOM 0 HB2 PRO A 71 -2.548 -17.818 -2.686 1.00 23.23 H new ATOM 0 HB3 PRO A 71 -0.890 -18.223 -2.286 1.00 23.23 H new ATOM 0 HG2 PRO A 71 -3.367 -18.499 -0.601 1.00 12.11 H new ATOM 0 HG3 PRO A 71 -2.021 -19.608 -0.772 1.00 12.11 H new ATOM 0 HD2 PRO A 71 -2.246 -17.962 1.383 1.00 72.04 H new ATOM 0 HD3 PRO A 71 -0.681 -18.431 0.749 1.00 72.04 H new ATOM 1107 N GLY A 72 -2.533 -14.195 -1.904 1.00 13.30 N ATOM 1108 CA GLY A 72 -3.598 -13.268 -2.234 1.00 71.42 C ATOM 1109 C GLY A 72 -4.571 -13.082 -1.090 1.00 54.14 C ATOM 1110 O GLY A 72 -5.772 -12.927 -1.308 1.00 23.41 O ATOM 0 H GLY A 72 -1.605 -13.775 -1.845 1.00 13.30 H new ATOM 0 HA2 GLY A 72 -3.167 -12.303 -2.502 1.00 71.42 H new ATOM 0 HA3 GLY A 72 -4.135 -13.632 -3.110 1.00 71.42 H new ATOM 1114 N LYS A 73 -4.054 -13.116 0.131 1.00 43.20 N ATOM 1115 CA LYS A 73 -4.887 -12.951 1.317 1.00 23.44 C ATOM 1116 C LYS A 73 -4.327 -11.850 2.208 1.00 20.02 C ATOM 1117 O LYS A 73 -4.911 -10.775 2.318 1.00 52.40 O ATOM 1118 CB LYS A 73 -4.985 -14.266 2.097 1.00 33.44 C ATOM 1119 CG LYS A 73 -5.597 -15.410 1.300 1.00 70.11 C ATOM 1120 CD LYS A 73 -7.058 -15.145 0.967 1.00 23.41 C ATOM 1121 CE LYS A 73 -7.628 -16.228 0.066 1.00 25.34 C ATOM 1122 NZ LYS A 73 -9.081 -16.039 -0.188 1.00 30.52 N ATOM 0 H LYS A 73 -3.063 -13.256 0.327 1.00 43.20 H new ATOM 0 HA LYS A 73 -5.889 -12.666 0.995 1.00 23.44 H new ATOM 0 HB2 LYS A 73 -3.988 -14.558 2.426 1.00 33.44 H new ATOM 0 HB3 LYS A 73 -5.581 -14.101 2.995 1.00 33.44 H new ATOM 0 HG2 LYS A 73 -5.034 -15.553 0.378 1.00 70.11 H new ATOM 0 HG3 LYS A 73 -5.516 -16.335 1.870 1.00 70.11 H new ATOM 0 HD2 LYS A 73 -7.639 -15.093 1.888 1.00 23.41 H new ATOM 0 HD3 LYS A 73 -7.151 -14.176 0.477 1.00 23.41 H new ATOM 0 HE2 LYS A 73 -7.092 -16.228 -0.883 1.00 25.34 H new ATOM 0 HE3 LYS A 73 -7.465 -17.203 0.525 1.00 25.34 H new ATOM 0 HZ1 LYS A 73 -9.427 -16.800 -0.807 1.00 30.52 H new ATOM 0 HZ2 LYS A 73 -9.597 -16.065 0.714 1.00 30.52 H new ATOM 0 HZ3 LYS A 73 -9.236 -15.120 -0.650 1.00 30.52 H new ATOM 1136 N ARG A 74 -3.189 -12.122 2.837 1.00 75.24 N ATOM 1137 CA ARG A 74 -2.512 -11.126 3.654 1.00 11.52 C ATOM 1138 C ARG A 74 -1.010 -11.385 3.642 1.00 25.21 C ATOM 1139 O ARG A 74 -0.559 -12.524 3.794 1.00 0.33 O ATOM 1140 CB ARG A 74 -3.045 -11.133 5.095 1.00 73.15 C ATOM 1141 CG ARG A 74 -2.565 -12.306 5.930 1.00 61.44 C ATOM 1142 CD ARG A 74 -3.190 -12.322 7.314 1.00 41.24 C ATOM 1143 NE ARG A 74 -2.657 -13.418 8.120 1.00 13.11 N ATOM 1144 CZ ARG A 74 -3.248 -14.600 8.260 1.00 60.02 C ATOM 1145 NH1 ARG A 74 -4.445 -14.817 7.727 1.00 10.12 N ATOM 1146 NH2 ARG A 74 -2.649 -15.560 8.949 1.00 21.43 N ATOM 0 H ARG A 74 -2.717 -13.025 2.796 1.00 75.24 H new ATOM 0 HA ARG A 74 -2.711 -10.141 3.231 1.00 11.52 H new ATOM 0 HB2 ARG A 74 -2.747 -10.206 5.585 1.00 73.15 H new ATOM 0 HB3 ARG A 74 -4.135 -11.143 5.067 1.00 73.15 H new ATOM 0 HG2 ARG A 74 -2.803 -13.237 5.415 1.00 61.44 H new ATOM 0 HG3 ARG A 74 -1.480 -12.262 6.024 1.00 61.44 H new ATOM 0 HD2 ARG A 74 -2.998 -11.372 7.814 1.00 41.24 H new ATOM 0 HD3 ARG A 74 -4.272 -12.424 7.227 1.00 41.24 H new ATOM 0 HE ARG A 74 -1.774 -13.266 8.607 1.00 13.11 H new ATOM 0 HH11 ARG A 74 -4.914 -14.075 7.208 1.00 10.12 H new ATOM 0 HH12 ARG A 74 -4.895 -15.726 7.837 1.00 10.12 H new ATOM 0 HH21 ARG A 74 -1.736 -15.391 9.371 1.00 21.43 H new ATOM 0 HH22 ARG A 74 -3.101 -16.468 9.058 1.00 21.43 H new ATOM 1160 N ILE A 75 -0.243 -10.337 3.415 1.00 14.05 N ATOM 1161 CA ILE A 75 1.204 -10.441 3.373 1.00 62.32 C ATOM 1162 C ILE A 75 1.822 -9.425 4.325 1.00 33.21 C ATOM 1163 O ILE A 75 1.663 -8.216 4.149 1.00 44.24 O ATOM 1164 CB ILE A 75 1.764 -10.214 1.943 1.00 54.14 C ATOM 1165 CG1 ILE A 75 1.284 -11.301 0.970 1.00 2.41 C ATOM 1166 CG2 ILE A 75 3.282 -10.173 1.967 1.00 22.31 C ATOM 1167 CD1 ILE A 75 -0.135 -11.104 0.476 1.00 71.44 C ATOM 0 H ILE A 75 -0.601 -9.395 3.255 1.00 14.05 H new ATOM 0 HA ILE A 75 1.468 -11.453 3.679 1.00 62.32 H new ATOM 0 HB ILE A 75 1.385 -9.254 1.591 1.00 54.14 H new ATOM 0 HG12 ILE A 75 1.956 -11.328 0.112 1.00 2.41 H new ATOM 0 HG13 ILE A 75 1.355 -12.271 1.462 1.00 2.41 H new ATOM 0 HG21 ILE A 75 3.658 -10.013 0.956 1.00 22.31 H new ATOM 0 HG22 ILE A 75 3.614 -9.358 2.611 1.00 22.31 H new ATOM 0 HG23 ILE A 75 3.665 -11.118 2.351 1.00 22.31 H new ATOM 0 HD11 ILE A 75 -0.398 -11.912 -0.206 1.00 71.44 H new ATOM 0 HD12 ILE A 75 -0.819 -11.107 1.324 1.00 71.44 H new ATOM 0 HD13 ILE A 75 -0.209 -10.150 -0.046 1.00 71.44 H new ATOM 1179 N ALA A 76 2.508 -9.922 5.339 1.00 41.44 N ATOM 1180 CA ALA A 76 3.116 -9.066 6.343 1.00 62.14 C ATOM 1181 C ALA A 76 4.626 -9.027 6.167 1.00 71.21 C ATOM 1182 O ALA A 76 5.305 -10.053 6.277 1.00 13.03 O ATOM 1183 CB ALA A 76 2.749 -9.548 7.734 1.00 73.01 C ATOM 0 H ALA A 76 2.659 -10.920 5.489 1.00 41.44 H new ATOM 0 HA ALA A 76 2.734 -8.053 6.217 1.00 62.14 H new ATOM 0 HB1 ALA A 76 3.211 -8.898 8.478 1.00 73.01 H new ATOM 0 HB2 ALA A 76 1.666 -9.524 7.853 1.00 73.01 H new ATOM 0 HB3 ALA A 76 3.107 -10.568 7.872 1.00 73.01 H new ATOM 1189 N TRP A 77 5.145 -7.840 5.905 1.00 22.11 N ATOM 1190 CA TRP A 77 6.558 -7.661 5.605 1.00 44.32 C ATOM 1191 C TRP A 77 7.372 -7.478 6.876 1.00 23.14 C ATOM 1192 O TRP A 77 6.900 -6.882 7.847 1.00 12.50 O ATOM 1193 CB TRP A 77 6.756 -6.447 4.701 1.00 22.15 C ATOM 1194 CG TRP A 77 6.166 -6.600 3.330 1.00 42.12 C ATOM 1195 CD1 TRP A 77 4.842 -6.714 3.009 1.00 62.20 C ATOM 1196 CD2 TRP A 77 6.883 -6.644 2.091 1.00 33.31 C ATOM 1197 NE1 TRP A 77 4.695 -6.836 1.649 1.00 2.14 N ATOM 1198 CE2 TRP A 77 5.933 -6.793 1.063 1.00 32.15 C ATOM 1199 CE3 TRP A 77 8.236 -6.571 1.750 1.00 62.30 C ATOM 1200 CZ2 TRP A 77 6.294 -6.873 -0.280 1.00 54.33 C ATOM 1201 CZ3 TRP A 77 8.593 -6.650 0.416 1.00 34.23 C ATOM 1202 CH2 TRP A 77 7.626 -6.799 -0.584 1.00 52.42 C ATOM 0 H TRP A 77 4.603 -6.976 5.894 1.00 22.11 H new ATOM 0 HA TRP A 77 6.905 -8.560 5.095 1.00 44.32 H new ATOM 0 HB2 TRP A 77 6.312 -5.575 5.180 1.00 22.15 H new ATOM 0 HB3 TRP A 77 7.824 -6.249 4.605 1.00 22.15 H new ATOM 0 HD1 TRP A 77 4.030 -6.709 3.721 1.00 62.20 H new ATOM 0 HE1 TRP A 77 3.809 -6.941 1.155 1.00 2.14 H new ATOM 0 HE3 TRP A 77 8.990 -6.455 2.515 1.00 62.30 H new ATOM 0 HZ2 TRP A 77 5.549 -6.989 -1.053 1.00 54.33 H new ATOM 0 HZ3 TRP A 77 9.636 -6.596 0.142 1.00 34.23 H new ATOM 0 HH2 TRP A 77 7.937 -6.857 -1.617 1.00 52.42 H new ATOM 1213 N ARG A 78 8.594 -7.992 6.858 1.00 51.35 N ATOM 1214 CA ARG A 78 9.508 -7.893 7.989 1.00 14.51 C ATOM 1215 C ARG A 78 10.943 -7.842 7.488 1.00 71.41 C ATOM 1216 O ARG A 78 11.200 -7.964 6.289 1.00 54.43 O ATOM 1217 CB ARG A 78 9.352 -9.090 8.935 1.00 21.31 C ATOM 1218 CG ARG A 78 8.007 -9.170 9.635 1.00 40.10 C ATOM 1219 CD ARG A 78 7.818 -8.048 10.645 1.00 24.41 C ATOM 1220 NE ARG A 78 8.861 -8.044 11.669 1.00 3.12 N ATOM 1221 CZ ARG A 78 8.641 -8.270 12.963 1.00 71.23 C ATOM 1222 NH1 ARG A 78 7.411 -8.521 13.401 1.00 53.35 N ATOM 1223 NH2 ARG A 78 9.651 -8.244 13.822 1.00 55.10 N ATOM 0 H ARG A 78 8.981 -8.491 6.057 1.00 51.35 H new ATOM 0 HA ARG A 78 9.268 -6.981 8.536 1.00 14.51 H new ATOM 0 HB2 ARG A 78 9.507 -10.008 8.368 1.00 21.31 H new ATOM 0 HB3 ARG A 78 10.138 -9.045 9.689 1.00 21.31 H new ATOM 0 HG2 ARG A 78 7.210 -9.127 8.893 1.00 40.10 H new ATOM 0 HG3 ARG A 78 7.919 -10.131 10.141 1.00 40.10 H new ATOM 0 HD2 ARG A 78 7.818 -7.090 10.125 1.00 24.41 H new ATOM 0 HD3 ARG A 78 6.843 -8.152 11.122 1.00 24.41 H new ATOM 0 HE ARG A 78 9.819 -7.856 11.374 1.00 3.12 H new ATOM 0 HH11 ARG A 78 6.630 -8.541 12.745 1.00 53.35 H new ATOM 0 HH12 ARG A 78 7.248 -8.693 14.393 1.00 53.35 H new ATOM 0 HH21 ARG A 78 10.597 -8.051 13.492 1.00 55.10 H new ATOM 0 HH22 ARG A 78 9.482 -8.417 14.813 1.00 55.10 H new ATOM 1237 N SER A 79 11.865 -7.651 8.411 1.00 21.53 N ATOM 1238 CA SER A 79 13.282 -7.681 8.116 1.00 53.30 C ATOM 1239 C SER A 79 13.980 -8.507 9.188 1.00 32.04 C ATOM 1240 O SER A 79 13.598 -8.464 10.359 1.00 70.24 O ATOM 1241 CB SER A 79 13.861 -6.261 8.066 1.00 14.42 C ATOM 1242 OG SER A 79 13.244 -5.489 7.046 1.00 60.30 O ATOM 0 H SER A 79 11.650 -7.470 9.391 1.00 21.53 H new ATOM 0 HA SER A 79 13.442 -8.133 7.137 1.00 53.30 H new ATOM 0 HB2 SER A 79 13.719 -5.774 9.031 1.00 14.42 H new ATOM 0 HB3 SER A 79 14.935 -6.310 7.889 1.00 14.42 H new ATOM 0 HG SER A 79 13.734 -4.648 6.930 1.00 60.30 H new ATOM 1248 N LEU A 80 14.979 -9.273 8.787 1.00 33.12 N ATOM 1249 CA LEU A 80 15.666 -10.160 9.711 1.00 22.41 C ATOM 1250 C LEU A 80 16.441 -9.363 10.758 1.00 41.02 C ATOM 1251 O LEU A 80 16.845 -8.229 10.500 1.00 55.53 O ATOM 1252 CB LEU A 80 16.578 -11.112 8.937 1.00 3.34 C ATOM 1253 CG LEU A 80 15.824 -12.095 8.036 1.00 34.22 C ATOM 1254 CD1 LEU A 80 16.787 -12.945 7.236 1.00 41.44 C ATOM 1255 CD2 LEU A 80 14.912 -12.980 8.867 1.00 50.44 C ATOM 0 H LEU A 80 15.332 -9.299 7.831 1.00 33.12 H new ATOM 0 HA LEU A 80 14.927 -10.757 10.245 1.00 22.41 H new ATOM 0 HB2 LEU A 80 17.264 -10.526 8.325 1.00 3.34 H new ATOM 0 HB3 LEU A 80 17.185 -11.675 9.646 1.00 3.34 H new ATOM 0 HG LEU A 80 15.217 -11.517 7.339 1.00 34.22 H new ATOM 0 HD11 LEU A 80 16.226 -13.634 6.605 1.00 41.44 H new ATOM 0 HD12 LEU A 80 17.406 -12.302 6.610 1.00 41.44 H new ATOM 0 HD13 LEU A 80 17.423 -13.512 7.916 1.00 41.44 H new ATOM 0 HD21 LEU A 80 14.383 -13.673 8.213 1.00 50.44 H new ATOM 0 HD22 LEU A 80 15.507 -13.542 9.586 1.00 50.44 H new ATOM 0 HD23 LEU A 80 14.190 -12.361 9.399 1.00 50.44 H new ATOM 1267 N PRO A 81 16.650 -9.959 11.951 1.00 61.10 N ATOM 1268 CA PRO A 81 17.257 -9.283 13.116 1.00 44.23 C ATOM 1269 C PRO A 81 18.590 -8.598 12.821 1.00 72.04 C ATOM 1270 O PRO A 81 19.059 -7.778 13.612 1.00 73.03 O ATOM 1271 CB PRO A 81 17.469 -10.422 14.113 1.00 33.20 C ATOM 1272 CG PRO A 81 16.431 -11.424 13.760 1.00 43.24 C ATOM 1273 CD PRO A 81 16.290 -11.355 12.267 1.00 51.14 C ATOM 0 HA PRO A 81 16.615 -8.476 13.468 1.00 44.23 H new ATOM 0 HB2 PRO A 81 18.471 -10.842 14.028 1.00 33.20 H new ATOM 0 HB3 PRO A 81 17.354 -10.077 15.140 1.00 33.20 H new ATOM 0 HG2 PRO A 81 16.727 -12.423 14.079 1.00 43.24 H new ATOM 0 HG3 PRO A 81 15.486 -11.199 14.253 1.00 43.24 H new ATOM 0 HD2 PRO A 81 16.952 -12.063 11.768 1.00 51.14 H new ATOM 0 HD3 PRO A 81 15.274 -11.590 11.948 1.00 51.14 H new ATOM 1281 N GLY A 82 19.214 -8.957 11.706 1.00 3.35 N ATOM 1282 CA GLY A 82 20.438 -8.297 11.299 1.00 64.42 C ATOM 1283 C GLY A 82 20.201 -6.846 10.922 1.00 13.11 C ATOM 1284 O GLY A 82 21.034 -5.979 11.193 1.00 61.11 O ATOM 0 H GLY A 82 18.894 -9.693 11.077 1.00 3.35 H new ATOM 0 HA2 GLY A 82 21.164 -8.347 12.110 1.00 64.42 H new ATOM 0 HA3 GLY A 82 20.871 -8.826 10.450 1.00 64.42 H new ATOM 1288 N ALA A 83 19.050 -6.578 10.321 1.00 72.14 N ATOM 1289 CA ALA A 83 18.730 -5.243 9.841 1.00 60.12 C ATOM 1290 C ALA A 83 18.123 -4.394 10.948 1.00 55.31 C ATOM 1291 O ALA A 83 17.427 -4.901 11.825 1.00 62.50 O ATOM 1292 CB ALA A 83 17.782 -5.312 8.653 1.00 51.35 C ATOM 0 H ALA A 83 18.320 -7.271 10.154 1.00 72.14 H new ATOM 0 HA ALA A 83 19.660 -4.773 9.520 1.00 60.12 H new ATOM 0 HB1 ALA A 83 17.555 -4.303 8.309 1.00 51.35 H new ATOM 0 HB2 ALA A 83 18.251 -5.874 7.845 1.00 51.35 H new ATOM 0 HB3 ALA A 83 16.859 -5.809 8.952 1.00 51.35 H new ATOM 1298 N ARG A 84 18.386 -3.098 10.898 1.00 15.02 N ATOM 1299 CA ARG A 84 17.874 -2.178 11.904 1.00 74.52 C ATOM 1300 C ARG A 84 16.900 -1.182 11.280 1.00 13.32 C ATOM 1301 O ARG A 84 16.335 -0.330 11.966 1.00 54.51 O ATOM 1302 CB ARG A 84 19.034 -1.453 12.608 1.00 14.22 C ATOM 1303 CG ARG A 84 20.068 -0.842 11.665 1.00 43.22 C ATOM 1304 CD ARG A 84 19.533 0.385 10.942 1.00 42.12 C ATOM 1305 NE ARG A 84 20.470 0.897 9.946 1.00 61.11 N ATOM 1306 CZ ARG A 84 20.153 1.813 9.029 1.00 13.45 C ATOM 1307 NH1 ARG A 84 18.965 2.412 9.062 1.00 54.10 N ATOM 1308 NH2 ARG A 84 21.038 2.163 8.105 1.00 24.43 N ATOM 0 H ARG A 84 18.951 -2.658 10.172 1.00 15.02 H new ATOM 0 HA ARG A 84 17.329 -2.752 12.653 1.00 74.52 H new ATOM 0 HB2 ARG A 84 18.623 -0.663 13.236 1.00 14.22 H new ATOM 0 HB3 ARG A 84 19.537 -2.158 13.270 1.00 14.22 H new ATOM 0 HG2 ARG A 84 20.957 -0.568 12.232 1.00 43.22 H new ATOM 0 HG3 ARG A 84 20.375 -1.588 10.932 1.00 43.22 H new ATOM 0 HD2 ARG A 84 18.591 0.134 10.455 1.00 42.12 H new ATOM 0 HD3 ARG A 84 19.318 1.167 11.670 1.00 42.12 H new ATOM 0 HE ARG A 84 21.423 0.533 9.952 1.00 61.11 H new ATOM 0 HH11 ARG A 84 18.293 2.171 9.790 1.00 54.10 H new ATOM 0 HH12 ARG A 84 18.727 3.112 8.359 1.00 54.10 H new ATOM 0 HH21 ARG A 84 21.962 1.732 8.095 1.00 24.43 H new ATOM 0 HH22 ARG A 84 20.794 2.863 7.405 1.00 24.43 H new ATOM 1322 N ILE A 85 16.712 -1.290 9.971 1.00 25.22 N ATOM 1323 CA ILE A 85 15.840 -0.376 9.246 1.00 60.33 C ATOM 1324 C ILE A 85 14.550 -1.093 8.827 1.00 11.43 C ATOM 1325 O ILE A 85 13.957 -0.813 7.785 1.00 24.22 O ATOM 1326 CB ILE A 85 16.580 0.227 8.017 1.00 4.23 C ATOM 1327 CG1 ILE A 85 15.769 1.360 7.373 1.00 22.54 C ATOM 1328 CG2 ILE A 85 16.897 -0.847 6.987 1.00 1.55 C ATOM 1329 CD1 ILE A 85 15.494 2.524 8.300 1.00 21.34 C ATOM 0 H ILE A 85 17.153 -2.003 9.389 1.00 25.22 H new ATOM 0 HA ILE A 85 15.568 0.449 9.905 1.00 60.33 H new ATOM 0 HB ILE A 85 17.519 0.646 8.379 1.00 4.23 H new ATOM 0 HG12 ILE A 85 16.306 1.725 6.498 1.00 22.54 H new ATOM 0 HG13 ILE A 85 14.819 0.958 7.020 1.00 22.54 H new ATOM 0 HG21 ILE A 85 17.414 -0.397 6.139 1.00 1.55 H new ATOM 0 HG22 ILE A 85 17.534 -1.607 7.439 1.00 1.55 H new ATOM 0 HG23 ILE A 85 15.970 -1.307 6.644 1.00 1.55 H new ATOM 0 HD11 ILE A 85 14.917 3.282 7.771 1.00 21.34 H new ATOM 0 HD12 ILE A 85 14.929 2.175 9.164 1.00 21.34 H new ATOM 0 HD13 ILE A 85 16.438 2.954 8.634 1.00 21.34 H new ATOM 1341 N GLU A 86 14.109 -2.019 9.667 1.00 33.34 N ATOM 1342 CA GLU A 86 12.866 -2.735 9.418 1.00 73.50 C ATOM 1343 C GLU A 86 11.680 -1.777 9.453 1.00 62.13 C ATOM 1344 O GLU A 86 11.455 -1.086 10.452 1.00 33.51 O ATOM 1345 CB GLU A 86 12.663 -3.851 10.451 1.00 40.35 C ATOM 1346 CG GLU A 86 11.327 -4.568 10.310 1.00 12.42 C ATOM 1347 CD GLU A 86 11.149 -5.683 11.316 1.00 23.23 C ATOM 1348 OE1 GLU A 86 11.023 -5.388 12.525 1.00 62.34 O ATOM 1349 OE2 GLU A 86 11.132 -6.861 10.905 1.00 5.42 O ATOM 0 H GLU A 86 14.591 -2.291 10.524 1.00 33.34 H new ATOM 0 HA GLU A 86 12.930 -3.184 8.427 1.00 73.50 H new ATOM 0 HB2 GLU A 86 13.469 -4.578 10.353 1.00 40.35 H new ATOM 0 HB3 GLU A 86 12.736 -3.427 11.452 1.00 40.35 H new ATOM 0 HG2 GLU A 86 10.519 -3.846 10.428 1.00 12.42 H new ATOM 0 HG3 GLU A 86 11.244 -4.977 9.303 1.00 12.42 H new ATOM 1356 N ASN A 87 10.939 -1.725 8.358 1.00 14.32 N ATOM 1357 CA ASN A 87 9.720 -0.936 8.298 1.00 64.52 C ATOM 1358 C ASN A 87 8.533 -1.880 8.404 1.00 35.10 C ATOM 1359 O ASN A 87 8.551 -2.969 7.826 1.00 13.24 O ATOM 1360 CB ASN A 87 9.644 -0.138 6.987 1.00 71.43 C ATOM 1361 CG ASN A 87 8.614 0.984 7.030 1.00 5.44 C ATOM 1362 OD1 ASN A 87 7.653 0.942 7.797 1.00 55.22 O ATOM 1363 ND2 ASN A 87 8.798 1.990 6.189 1.00 60.11 N ATOM 0 H ASN A 87 11.162 -2.222 7.496 1.00 14.32 H new ATOM 0 HA ASN A 87 9.711 -0.221 9.121 1.00 64.52 H new ATOM 0 HB2 ASN A 87 10.625 0.285 6.769 1.00 71.43 H new ATOM 0 HB3 ASN A 87 9.400 -0.816 6.169 1.00 71.43 H new ATOM 0 HD21 ASN A 87 8.132 2.762 6.164 1.00 60.11 H new ATOM 0 HD22 ASN A 87 9.606 1.993 5.567 1.00 60.11 H new ATOM 1370 N SER A 88 7.507 -1.476 9.128 1.00 21.13 N ATOM 1371 CA SER A 88 6.367 -2.339 9.341 1.00 1.02 C ATOM 1372 C SER A 88 5.284 -2.040 8.314 1.00 11.51 C ATOM 1373 O SER A 88 4.850 -0.894 8.157 1.00 64.22 O ATOM 1374 CB SER A 88 5.829 -2.149 10.758 1.00 63.42 C ATOM 1375 OG SER A 88 6.855 -2.355 11.718 1.00 12.45 O ATOM 0 H SER A 88 7.441 -0.561 9.575 1.00 21.13 H new ATOM 0 HA SER A 88 6.678 -3.377 9.222 1.00 1.02 H new ATOM 0 HB2 SER A 88 5.421 -1.144 10.865 1.00 63.42 H new ATOM 0 HB3 SER A 88 5.011 -2.846 10.938 1.00 63.42 H new ATOM 0 HG SER A 88 6.491 -2.227 12.619 1.00 12.45 H new ATOM 1381 N GLY A 89 4.857 -3.084 7.622 1.00 52.52 N ATOM 1382 CA GLY A 89 3.855 -2.944 6.591 1.00 11.12 C ATOM 1383 C GLY A 89 3.170 -4.257 6.306 1.00 62.34 C ATOM 1384 O GLY A 89 3.790 -5.320 6.396 1.00 52.15 O ATOM 0 H GLY A 89 5.193 -4.037 7.760 1.00 52.52 H new ATOM 0 HA2 GLY A 89 3.115 -2.205 6.899 1.00 11.12 H new ATOM 0 HA3 GLY A 89 4.319 -2.569 5.679 1.00 11.12 H new ATOM 1388 N GLU A 90 1.896 -4.192 5.969 1.00 53.33 N ATOM 1389 CA GLU A 90 1.111 -5.393 5.748 1.00 60.05 C ATOM 1390 C GLU A 90 0.062 -5.150 4.667 1.00 2.40 C ATOM 1391 O GLU A 90 -0.712 -4.192 4.749 1.00 41.20 O ATOM 1392 CB GLU A 90 0.450 -5.816 7.064 1.00 32.31 C ATOM 1393 CG GLU A 90 -0.160 -7.205 7.043 1.00 32.22 C ATOM 1394 CD GLU A 90 -0.671 -7.620 8.409 1.00 40.22 C ATOM 1395 OE1 GLU A 90 0.125 -8.143 9.214 1.00 42.01 O ATOM 1396 OE2 GLU A 90 -1.867 -7.409 8.692 1.00 41.03 O ATOM 0 H GLU A 90 1.382 -3.320 5.842 1.00 53.33 H new ATOM 0 HA GLU A 90 1.764 -6.196 5.406 1.00 60.05 H new ATOM 0 HB2 GLU A 90 1.193 -5.771 7.860 1.00 32.31 H new ATOM 0 HB3 GLU A 90 -0.328 -5.095 7.313 1.00 32.31 H new ATOM 0 HG2 GLU A 90 -0.980 -7.230 6.326 1.00 32.22 H new ATOM 0 HG3 GLU A 90 0.585 -7.923 6.701 1.00 32.22 H new ATOM 1403 N VAL A 91 0.049 -6.002 3.650 1.00 64.13 N ATOM 1404 CA VAL A 91 -0.907 -5.879 2.556 1.00 64.24 C ATOM 1405 C VAL A 91 -1.953 -6.987 2.619 1.00 14.35 C ATOM 1406 O VAL A 91 -1.623 -8.172 2.618 1.00 11.13 O ATOM 1407 CB VAL A 91 -0.217 -5.907 1.167 1.00 75.32 C ATOM 1408 CG1 VAL A 91 0.759 -7.063 1.056 1.00 64.11 C ATOM 1409 CG2 VAL A 91 -1.253 -5.997 0.063 1.00 15.43 C ATOM 0 H VAL A 91 0.692 -6.789 3.560 1.00 64.13 H new ATOM 0 HA VAL A 91 -1.392 -4.910 2.677 1.00 64.24 H new ATOM 0 HB VAL A 91 0.343 -4.978 1.058 1.00 75.32 H new ATOM 0 HG11 VAL A 91 1.225 -7.053 0.070 1.00 64.11 H new ATOM 0 HG12 VAL A 91 1.528 -6.964 1.822 1.00 64.11 H new ATOM 0 HG13 VAL A 91 0.226 -8.004 1.196 1.00 64.11 H new ATOM 0 HG21 VAL A 91 -0.752 -6.016 -0.905 1.00 15.43 H new ATOM 0 HG22 VAL A 91 -1.838 -6.908 0.187 1.00 15.43 H new ATOM 0 HG23 VAL A 91 -1.914 -5.132 0.113 1.00 15.43 H new ATOM 1419 N LEU A 92 -3.211 -6.598 2.710 1.00 44.01 N ATOM 1420 CA LEU A 92 -4.304 -7.551 2.655 1.00 43.25 C ATOM 1421 C LEU A 92 -5.051 -7.401 1.337 1.00 73.24 C ATOM 1422 O LEU A 92 -5.257 -6.286 0.856 1.00 71.43 O ATOM 1423 CB LEU A 92 -5.267 -7.339 3.826 1.00 35.32 C ATOM 1424 CG LEU A 92 -4.862 -7.964 5.166 1.00 63.33 C ATOM 1425 CD1 LEU A 92 -3.462 -7.541 5.590 1.00 45.53 C ATOM 1426 CD2 LEU A 92 -5.867 -7.571 6.230 1.00 15.21 C ATOM 0 H LEU A 92 -3.502 -5.627 2.823 1.00 44.01 H new ATOM 0 HA LEU A 92 -3.891 -8.557 2.726 1.00 43.25 H new ATOM 0 HB2 LEU A 92 -5.393 -6.267 3.974 1.00 35.32 H new ATOM 0 HB3 LEU A 92 -6.241 -7.739 3.544 1.00 35.32 H new ATOM 0 HG LEU A 92 -4.853 -9.047 5.044 1.00 63.33 H new ATOM 0 HD11 LEU A 92 -3.215 -8.006 6.544 1.00 45.53 H new ATOM 0 HD12 LEU A 92 -2.742 -7.857 4.835 1.00 45.53 H new ATOM 0 HD13 LEU A 92 -3.426 -6.457 5.695 1.00 45.53 H new ATOM 0 HD21 LEU A 92 -5.580 -8.015 7.183 1.00 15.21 H new ATOM 0 HD22 LEU A 92 -5.888 -6.486 6.327 1.00 15.21 H new ATOM 0 HD23 LEU A 92 -6.856 -7.930 5.946 1.00 15.21 H new ATOM 1438 N PHE A 93 -5.441 -8.517 0.748 1.00 72.54 N ATOM 1439 CA PHE A 93 -6.189 -8.492 -0.496 1.00 45.21 C ATOM 1440 C PHE A 93 -7.651 -8.801 -0.231 1.00 20.42 C ATOM 1441 O PHE A 93 -8.014 -9.926 0.109 1.00 54.41 O ATOM 1442 CB PHE A 93 -5.600 -9.475 -1.510 1.00 12.42 C ATOM 1443 CG PHE A 93 -4.243 -9.068 -2.003 1.00 52.35 C ATOM 1444 CD1 PHE A 93 -4.116 -8.152 -3.034 1.00 40.23 C ATOM 1445 CD2 PHE A 93 -3.097 -9.591 -1.429 1.00 24.44 C ATOM 1446 CE1 PHE A 93 -2.869 -7.768 -3.486 1.00 0.52 C ATOM 1447 CE2 PHE A 93 -1.848 -9.209 -1.877 1.00 3.33 C ATOM 1448 CZ PHE A 93 -1.734 -8.297 -2.907 1.00 52.43 C ATOM 0 H PHE A 93 -5.252 -9.451 1.111 1.00 72.54 H new ATOM 0 HA PHE A 93 -6.116 -7.492 -0.923 1.00 45.21 H new ATOM 0 HB2 PHE A 93 -5.533 -10.462 -1.053 1.00 12.42 H new ATOM 0 HB3 PHE A 93 -6.278 -9.562 -2.359 1.00 12.42 H new ATOM 0 HD1 PHE A 93 -5.002 -7.734 -3.489 1.00 40.23 H new ATOM 0 HD2 PHE A 93 -3.181 -10.305 -0.623 1.00 24.44 H new ATOM 0 HE1 PHE A 93 -2.782 -7.054 -4.292 1.00 0.52 H new ATOM 0 HE2 PHE A 93 -0.961 -9.624 -1.422 1.00 3.33 H new ATOM 0 HZ PHE A 93 -0.758 -7.998 -3.259 1.00 52.43 H new ATOM 1458 N ARG A 94 -8.478 -7.784 -0.364 1.00 30.00 N ATOM 1459 CA ARG A 94 -9.897 -7.904 -0.096 1.00 41.24 C ATOM 1460 C ARG A 94 -10.696 -7.415 -1.292 1.00 24.42 C ATOM 1461 O ARG A 94 -10.280 -6.485 -1.977 1.00 34.33 O ATOM 1462 CB ARG A 94 -10.260 -7.088 1.145 1.00 62.32 C ATOM 1463 CG ARG A 94 -9.835 -7.732 2.455 1.00 32.13 C ATOM 1464 CD ARG A 94 -10.045 -6.784 3.624 1.00 52.04 C ATOM 1465 NE ARG A 94 -11.332 -6.093 3.542 1.00 72.54 N ATOM 1466 CZ ARG A 94 -11.593 -4.930 4.135 1.00 61.10 C ATOM 1467 NH1 ARG A 94 -10.718 -4.401 4.984 1.00 23.13 N ATOM 1468 NH2 ARG A 94 -12.746 -4.314 3.908 1.00 54.41 N ATOM 0 H ARG A 94 -8.186 -6.853 -0.660 1.00 30.00 H new ATOM 0 HA ARG A 94 -10.138 -8.952 0.083 1.00 41.24 H new ATOM 0 HB2 ARG A 94 -9.797 -6.104 1.069 1.00 62.32 H new ATOM 0 HB3 ARG A 94 -11.339 -6.932 1.162 1.00 62.32 H new ATOM 0 HG2 ARG A 94 -10.407 -8.646 2.617 1.00 32.13 H new ATOM 0 HG3 ARG A 94 -8.785 -8.018 2.399 1.00 32.13 H new ATOM 0 HD2 ARG A 94 -9.992 -7.343 4.558 1.00 52.04 H new ATOM 0 HD3 ARG A 94 -9.240 -6.050 3.645 1.00 52.04 H new ATOM 0 HE ARG A 94 -12.075 -6.529 2.997 1.00 72.54 H new ATOM 0 HH11 ARG A 94 -9.843 -4.886 5.183 1.00 23.13 H new ATOM 0 HH12 ARG A 94 -10.921 -3.510 5.437 1.00 23.13 H new ATOM 0 HH21 ARG A 94 -13.432 -4.732 3.279 1.00 54.41 H new ATOM 0 HH22 ARG A 94 -12.946 -3.423 4.362 1.00 54.41 H new ATOM 1482 N PRO A 95 -11.842 -8.039 -1.577 1.00 4.12 N ATOM 1483 CA PRO A 95 -12.715 -7.604 -2.663 1.00 42.21 C ATOM 1484 C PRO A 95 -13.307 -6.226 -2.388 1.00 21.04 C ATOM 1485 O PRO A 95 -13.719 -5.926 -1.264 1.00 11.22 O ATOM 1486 CB PRO A 95 -13.816 -8.668 -2.697 1.00 34.51 C ATOM 1487 CG PRO A 95 -13.804 -9.273 -1.336 1.00 11.01 C ATOM 1488 CD PRO A 95 -12.376 -9.218 -0.874 1.00 22.51 C ATOM 0 HA PRO A 95 -12.181 -7.511 -3.609 1.00 42.21 H new ATOM 0 HB2 PRO A 95 -14.786 -8.226 -2.925 1.00 34.51 H new ATOM 0 HB3 PRO A 95 -13.619 -9.417 -3.464 1.00 34.51 H new ATOM 0 HG2 PRO A 95 -14.455 -8.722 -0.658 1.00 11.01 H new ATOM 0 HG3 PRO A 95 -14.167 -10.300 -1.362 1.00 11.01 H new ATOM 0 HD2 PRO A 95 -12.307 -9.108 0.208 1.00 22.51 H new ATOM 0 HD3 PRO A 95 -11.832 -10.125 -1.138 1.00 22.51 H new ATOM 1496 N ALA A 96 -13.324 -5.383 -3.409 1.00 20.14 N ATOM 1497 CA ALA A 96 -13.889 -4.053 -3.286 1.00 75.12 C ATOM 1498 C ALA A 96 -15.410 -4.126 -3.336 1.00 13.43 C ATOM 1499 O ALA A 96 -15.961 -4.981 -4.032 1.00 72.21 O ATOM 1500 CB ALA A 96 -13.350 -3.154 -4.381 1.00 61.52 C ATOM 0 H ALA A 96 -12.951 -5.599 -4.333 1.00 20.14 H new ATOM 0 HA ALA A 96 -13.599 -3.628 -2.325 1.00 75.12 H new ATOM 0 HB1 ALA A 96 -13.781 -2.158 -4.279 1.00 61.52 H new ATOM 0 HB2 ALA A 96 -12.265 -3.090 -4.298 1.00 61.52 H new ATOM 0 HB3 ALA A 96 -13.616 -3.566 -5.354 1.00 61.52 H new ATOM 1506 N PRO A 97 -16.092 -3.223 -2.603 1.00 62.11 N ATOM 1507 CA PRO A 97 -17.548 -3.250 -2.409 1.00 45.22 C ATOM 1508 C PRO A 97 -18.343 -3.679 -3.642 1.00 13.24 C ATOM 1509 O PRO A 97 -18.419 -2.964 -4.647 1.00 52.42 O ATOM 1510 CB PRO A 97 -17.868 -1.811 -2.050 1.00 35.03 C ATOM 1511 CG PRO A 97 -16.658 -1.325 -1.329 1.00 10.43 C ATOM 1512 CD PRO A 97 -15.481 -2.080 -1.895 1.00 62.42 C ATOM 0 HA PRO A 97 -17.827 -3.986 -1.655 1.00 45.22 H new ATOM 0 HB2 PRO A 97 -18.065 -1.215 -2.941 1.00 35.03 H new ATOM 0 HB3 PRO A 97 -18.756 -1.747 -1.421 1.00 35.03 H new ATOM 0 HG2 PRO A 97 -16.531 -0.251 -1.467 1.00 10.43 H new ATOM 0 HG3 PRO A 97 -16.750 -1.500 -0.257 1.00 10.43 H new ATOM 0 HD2 PRO A 97 -14.897 -1.458 -2.573 1.00 62.42 H new ATOM 0 HD3 PRO A 97 -14.806 -2.414 -1.107 1.00 62.42 H new ATOM 1520 N GLY A 98 -18.895 -4.874 -3.553 1.00 24.32 N ATOM 1521 CA GLY A 98 -19.771 -5.394 -4.576 1.00 62.51 C ATOM 1522 C GLY A 98 -19.017 -6.154 -5.633 1.00 4.34 C ATOM 1523 O GLY A 98 -19.123 -7.378 -5.733 1.00 31.02 O ATOM 0 H GLY A 98 -18.747 -5.509 -2.768 1.00 24.32 H new ATOM 0 HA2 GLY A 98 -20.513 -6.049 -4.119 1.00 62.51 H new ATOM 0 HA3 GLY A 98 -20.315 -4.571 -5.040 1.00 62.51 H new ATOM 1527 N ALA A 99 -18.227 -5.423 -6.394 1.00 74.34 N ATOM 1528 CA ALA A 99 -17.523 -5.975 -7.542 1.00 35.53 C ATOM 1529 C ALA A 99 -16.656 -4.918 -8.205 1.00 61.33 C ATOM 1530 O ALA A 99 -16.435 -4.954 -9.412 1.00 32.05 O ATOM 1531 CB ALA A 99 -18.515 -6.536 -8.550 1.00 32.25 C ATOM 0 H ALA A 99 -18.053 -4.430 -6.237 1.00 74.34 H new ATOM 0 HA ALA A 99 -16.879 -6.780 -7.188 1.00 35.53 H new ATOM 0 HB1 ALA A 99 -17.974 -6.945 -9.403 1.00 32.25 H new ATOM 0 HB2 ALA A 99 -19.104 -7.324 -8.081 1.00 32.25 H new ATOM 0 HB3 ALA A 99 -19.179 -5.740 -8.889 1.00 32.25 H new ATOM 1537 N ARG A 100 -16.139 -3.993 -7.408 1.00 70.03 N ATOM 1538 CA ARG A 100 -15.335 -2.895 -7.935 1.00 72.13 C ATOM 1539 C ARG A 100 -13.943 -3.388 -8.346 1.00 5.13 C ATOM 1540 O ARG A 100 -13.206 -2.693 -9.044 1.00 43.40 O ATOM 1541 CB ARG A 100 -15.223 -1.780 -6.888 1.00 74.22 C ATOM 1542 CG ARG A 100 -14.502 -0.533 -7.381 1.00 64.33 C ATOM 1543 CD ARG A 100 -15.337 0.239 -8.388 1.00 45.31 C ATOM 1544 NE ARG A 100 -16.460 0.927 -7.749 1.00 70.22 N ATOM 1545 CZ ARG A 100 -17.560 1.322 -8.390 1.00 33.23 C ATOM 1546 NH1 ARG A 100 -17.699 1.087 -9.687 1.00 14.45 N ATOM 1547 NH2 ARG A 100 -18.517 1.962 -7.733 1.00 4.44 N ATOM 0 H ARG A 100 -16.261 -3.979 -6.395 1.00 70.03 H new ATOM 0 HA ARG A 100 -15.827 -2.498 -8.823 1.00 72.13 H new ATOM 0 HB2 ARG A 100 -16.225 -1.502 -6.561 1.00 74.22 H new ATOM 0 HB3 ARG A 100 -14.699 -2.168 -6.015 1.00 74.22 H new ATOM 0 HG2 ARG A 100 -14.268 0.111 -6.533 1.00 64.33 H new ATOM 0 HG3 ARG A 100 -13.554 -0.817 -7.837 1.00 64.33 H new ATOM 0 HD2 ARG A 100 -14.708 0.967 -8.899 1.00 45.31 H new ATOM 0 HD3 ARG A 100 -15.715 -0.445 -9.148 1.00 45.31 H new ATOM 0 HE ARG A 100 -16.397 1.116 -6.749 1.00 70.22 H new ATOM 0 HH11 ARG A 100 -16.962 0.602 -10.199 1.00 14.45 H new ATOM 0 HH12 ARG A 100 -18.543 1.391 -10.173 1.00 14.45 H new ATOM 0 HH21 ARG A 100 -18.412 2.152 -6.736 1.00 4.44 H new ATOM 0 HH22 ARG A 100 -19.358 2.264 -8.224 1.00 4.44 H new ATOM 1561 N GLY A 101 -13.600 -4.594 -7.916 1.00 10.13 N ATOM 1562 CA GLY A 101 -12.293 -5.151 -8.201 1.00 1.25 C ATOM 1563 C GLY A 101 -11.638 -5.664 -6.941 1.00 14.13 C ATOM 1564 O GLY A 101 -12.326 -5.953 -5.959 1.00 32.32 O ATOM 0 H GLY A 101 -14.210 -5.202 -7.370 1.00 10.13 H new ATOM 0 HA2 GLY A 101 -12.389 -5.963 -8.922 1.00 1.25 H new ATOM 0 HA3 GLY A 101 -11.661 -4.390 -8.660 1.00 1.25 H new ATOM 1568 N THR A 102 -10.323 -5.770 -6.950 1.00 11.22 N ATOM 1569 CA THR A 102 -9.597 -6.190 -5.772 1.00 0.31 C ATOM 1570 C THR A 102 -8.974 -4.982 -5.093 1.00 35.22 C ATOM 1571 O THR A 102 -8.292 -4.175 -5.730 1.00 70.15 O ATOM 1572 CB THR A 102 -8.507 -7.217 -6.111 1.00 73.01 C ATOM 1573 OG1 THR A 102 -9.085 -8.304 -6.844 1.00 21.44 O ATOM 1574 CG2 THR A 102 -7.848 -7.744 -4.843 1.00 51.00 C ATOM 0 H THR A 102 -9.738 -5.571 -7.761 1.00 11.22 H new ATOM 0 HA THR A 102 -10.306 -6.668 -5.096 1.00 0.31 H new ATOM 0 HB THR A 102 -7.745 -6.729 -6.718 1.00 73.01 H new ATOM 0 HG1 THR A 102 -8.564 -8.463 -7.659 1.00 21.44 H new ATOM 0 HG21 THR A 102 -7.079 -8.470 -5.107 1.00 51.00 H new ATOM 0 HG22 THR A 102 -7.394 -6.916 -4.298 1.00 51.00 H new ATOM 0 HG23 THR A 102 -8.599 -8.223 -4.215 1.00 51.00 H new ATOM 1582 N GLU A 103 -9.236 -4.852 -3.810 1.00 13.00 N ATOM 1583 CA GLU A 103 -8.731 -3.743 -3.036 1.00 70.21 C ATOM 1584 C GLU A 103 -7.513 -4.177 -2.233 1.00 4.05 C ATOM 1585 O GLU A 103 -7.616 -4.978 -1.298 1.00 51.52 O ATOM 1586 CB GLU A 103 -9.828 -3.209 -2.114 1.00 44.22 C ATOM 1587 CG GLU A 103 -9.410 -2.003 -1.298 1.00 13.15 C ATOM 1588 CD GLU A 103 -10.549 -1.431 -0.478 1.00 33.20 C ATOM 1589 OE1 GLU A 103 -10.917 -2.042 0.547 1.00 55.51 O ATOM 1590 OE2 GLU A 103 -11.077 -0.364 -0.850 1.00 2.31 O ATOM 0 H GLU A 103 -9.804 -5.511 -3.277 1.00 13.00 H new ATOM 0 HA GLU A 103 -8.428 -2.943 -3.711 1.00 70.21 H new ATOM 0 HB2 GLU A 103 -10.698 -2.945 -2.715 1.00 44.22 H new ATOM 0 HB3 GLU A 103 -10.139 -4.004 -1.436 1.00 44.22 H new ATOM 0 HG2 GLU A 103 -8.594 -2.284 -0.633 1.00 13.15 H new ATOM 0 HG3 GLU A 103 -9.025 -1.232 -1.966 1.00 13.15 H new ATOM 1597 N VAL A 104 -6.357 -3.668 -2.622 1.00 23.03 N ATOM 1598 CA VAL A 104 -5.126 -3.921 -1.898 1.00 25.50 C ATOM 1599 C VAL A 104 -4.962 -2.876 -0.798 1.00 12.53 C ATOM 1600 O VAL A 104 -4.557 -1.735 -1.042 1.00 41.51 O ATOM 1601 CB VAL A 104 -3.894 -3.953 -2.849 1.00 64.25 C ATOM 1602 CG1 VAL A 104 -3.928 -2.818 -3.852 1.00 33.32 C ATOM 1603 CG2 VAL A 104 -2.594 -3.918 -2.067 1.00 71.14 C ATOM 0 H VAL A 104 -6.246 -3.072 -3.442 1.00 23.03 H new ATOM 0 HA VAL A 104 -5.185 -4.908 -1.440 1.00 25.50 H new ATOM 0 HB VAL A 104 -3.945 -4.893 -3.399 1.00 64.25 H new ATOM 0 HG11 VAL A 104 -3.051 -2.876 -4.497 1.00 33.32 H new ATOM 0 HG12 VAL A 104 -4.830 -2.895 -4.459 1.00 33.32 H new ATOM 0 HG13 VAL A 104 -3.927 -1.865 -3.323 1.00 33.32 H new ATOM 0 HG21 VAL A 104 -1.752 -3.942 -2.759 1.00 71.14 H new ATOM 0 HG22 VAL A 104 -2.551 -3.005 -1.474 1.00 71.14 H new ATOM 0 HG23 VAL A 104 -2.544 -4.783 -1.405 1.00 71.14 H new ATOM 1613 N VAL A 105 -5.349 -3.266 0.410 1.00 12.14 N ATOM 1614 CA VAL A 105 -5.242 -2.403 1.565 1.00 4.03 C ATOM 1615 C VAL A 105 -3.842 -2.500 2.153 1.00 63.11 C ATOM 1616 O VAL A 105 -3.439 -3.534 2.694 1.00 34.30 O ATOM 1617 CB VAL A 105 -6.310 -2.734 2.643 1.00 23.30 C ATOM 1618 CG1 VAL A 105 -7.702 -2.410 2.138 1.00 32.13 C ATOM 1619 CG2 VAL A 105 -6.252 -4.190 3.069 1.00 71.11 C ATOM 0 H VAL A 105 -5.743 -4.185 0.610 1.00 12.14 H new ATOM 0 HA VAL A 105 -5.427 -1.381 1.235 1.00 4.03 H new ATOM 0 HB VAL A 105 -6.086 -2.115 3.512 1.00 23.30 H new ATOM 0 HG11 VAL A 105 -8.434 -2.650 2.909 1.00 32.13 H new ATOM 0 HG12 VAL A 105 -7.764 -1.349 1.897 1.00 32.13 H new ATOM 0 HG13 VAL A 105 -7.911 -2.998 1.244 1.00 32.13 H new ATOM 0 HG21 VAL A 105 -7.015 -4.379 3.824 1.00 71.11 H new ATOM 0 HG22 VAL A 105 -6.430 -4.829 2.204 1.00 71.11 H new ATOM 0 HG23 VAL A 105 -5.268 -4.408 3.485 1.00 71.11 H new ATOM 1629 N VAL A 106 -3.091 -1.430 2.021 1.00 64.14 N ATOM 1630 CA VAL A 106 -1.715 -1.421 2.465 1.00 35.31 C ATOM 1631 C VAL A 106 -1.533 -0.481 3.650 1.00 60.15 C ATOM 1632 O VAL A 106 -1.896 0.695 3.596 1.00 42.43 O ATOM 1633 CB VAL A 106 -0.747 -1.041 1.315 1.00 43.01 C ATOM 1634 CG1 VAL A 106 -1.109 0.309 0.710 1.00 44.44 C ATOM 1635 CG2 VAL A 106 0.698 -1.049 1.796 1.00 4.21 C ATOM 0 H VAL A 106 -3.410 -0.553 1.609 1.00 64.14 H new ATOM 0 HA VAL A 106 -1.469 -2.433 2.786 1.00 35.31 H new ATOM 0 HB VAL A 106 -0.850 -1.794 0.533 1.00 43.01 H new ATOM 0 HG11 VAL A 106 -0.412 0.546 -0.093 1.00 44.44 H new ATOM 0 HG12 VAL A 106 -2.122 0.269 0.311 1.00 44.44 H new ATOM 0 HG13 VAL A 106 -1.052 1.079 1.479 1.00 44.44 H new ATOM 0 HG21 VAL A 106 1.358 -0.779 0.971 1.00 4.21 H new ATOM 0 HG22 VAL A 106 0.816 -0.329 2.605 1.00 4.21 H new ATOM 0 HG23 VAL A 106 0.956 -2.045 2.156 1.00 4.21 H new ATOM 1645 N ARG A 107 -1.015 -1.022 4.735 1.00 2.44 N ATOM 1646 CA ARG A 107 -0.670 -0.218 5.887 1.00 64.42 C ATOM 1647 C ARG A 107 0.833 -0.257 6.106 1.00 22.41 C ATOM 1648 O ARG A 107 1.374 -1.222 6.647 1.00 11.21 O ATOM 1649 CB ARG A 107 -1.440 -0.674 7.135 1.00 65.12 C ATOM 1650 CG ARG A 107 -1.325 -2.156 7.463 1.00 33.31 C ATOM 1651 CD ARG A 107 -2.177 -2.498 8.674 1.00 72.14 C ATOM 1652 NE ARG A 107 -2.092 -3.907 9.054 1.00 33.41 N ATOM 1653 CZ ARG A 107 -2.245 -4.341 10.308 1.00 20.42 C ATOM 1654 NH1 ARG A 107 -2.452 -3.472 11.293 1.00 12.43 N ATOM 1655 NH2 ARG A 107 -2.197 -5.636 10.580 1.00 71.02 N ATOM 0 H ARG A 107 -0.824 -2.018 4.841 1.00 2.44 H new ATOM 0 HA ARG A 107 -0.963 0.815 5.698 1.00 64.42 H new ATOM 0 HB2 ARG A 107 -1.085 -0.100 7.991 1.00 65.12 H new ATOM 0 HB3 ARG A 107 -2.494 -0.429 7.002 1.00 65.12 H new ATOM 0 HG2 ARG A 107 -1.644 -2.750 6.607 1.00 33.31 H new ATOM 0 HG3 ARG A 107 -0.284 -2.412 7.659 1.00 33.31 H new ATOM 0 HD2 ARG A 107 -1.865 -1.881 9.517 1.00 72.14 H new ATOM 0 HD3 ARG A 107 -3.216 -2.247 8.463 1.00 72.14 H new ATOM 0 HE ARG A 107 -1.906 -4.594 8.324 1.00 33.41 H new ATOM 0 HH11 ARG A 107 -2.494 -2.473 11.091 1.00 12.43 H new ATOM 0 HH12 ARG A 107 -2.569 -3.804 12.250 1.00 12.43 H new ATOM 0 HH21 ARG A 107 -2.042 -6.309 9.830 1.00 71.02 H new ATOM 0 HH22 ARG A 107 -2.315 -5.960 11.540 1.00 71.02 H new ATOM 1669 N LEU A 108 1.506 0.782 5.643 1.00 71.33 N ATOM 1670 CA LEU A 108 2.953 0.867 5.739 1.00 3.33 C ATOM 1671 C LEU A 108 3.324 2.102 6.540 1.00 42.31 C ATOM 1672 O LEU A 108 2.683 3.145 6.411 1.00 11.52 O ATOM 1673 CB LEU A 108 3.580 0.921 4.340 1.00 42.13 C ATOM 1674 CG LEU A 108 5.111 0.933 4.302 1.00 4.30 C ATOM 1675 CD1 LEU A 108 5.678 -0.325 4.942 1.00 23.13 C ATOM 1676 CD2 LEU A 108 5.603 1.075 2.870 1.00 11.13 C ATOM 0 H LEU A 108 1.068 1.586 5.193 1.00 71.33 H new ATOM 0 HA LEU A 108 3.338 -0.019 6.244 1.00 3.33 H new ATOM 0 HB2 LEU A 108 3.227 0.062 3.770 1.00 42.13 H new ATOM 0 HB3 LEU A 108 3.215 1.813 3.832 1.00 42.13 H new ATOM 0 HG LEU A 108 5.462 1.791 4.876 1.00 4.30 H new ATOM 0 HD11 LEU A 108 6.767 -0.294 4.903 1.00 23.13 H new ATOM 0 HD12 LEU A 108 5.353 -0.383 5.981 1.00 23.13 H new ATOM 0 HD13 LEU A 108 5.321 -1.201 4.401 1.00 23.13 H new ATOM 0 HD21 LEU A 108 6.693 1.082 2.859 1.00 11.13 H new ATOM 0 HD22 LEU A 108 5.239 0.237 2.276 1.00 11.13 H new ATOM 0 HD23 LEU A 108 5.230 2.008 2.448 1.00 11.13 H new ATOM 1688 N THR A 109 4.351 1.991 7.360 1.00 12.11 N ATOM 1689 CA THR A 109 4.690 3.058 8.278 1.00 23.23 C ATOM 1690 C THR A 109 5.531 4.140 7.608 1.00 11.54 C ATOM 1691 O THR A 109 6.622 3.887 7.094 1.00 32.14 O ATOM 1692 CB THR A 109 5.416 2.495 9.513 1.00 2.21 C ATOM 1693 OG1 THR A 109 4.527 1.639 10.244 1.00 53.25 O ATOM 1694 CG2 THR A 109 5.938 3.603 10.420 1.00 5.11 C ATOM 0 H THR A 109 4.962 1.176 7.409 1.00 12.11 H new ATOM 0 HA THR A 109 3.758 3.523 8.598 1.00 23.23 H new ATOM 0 HB THR A 109 6.277 1.925 9.165 1.00 2.21 H new ATOM 0 HG1 THR A 109 4.469 0.769 9.797 1.00 53.25 H new ATOM 0 HG21 THR A 109 6.443 3.162 11.279 1.00 5.11 H new ATOM 0 HG22 THR A 109 6.640 4.226 9.866 1.00 5.11 H new ATOM 0 HG23 THR A 109 5.104 4.215 10.764 1.00 5.11 H new ATOM 1702 N TYR A 110 4.982 5.344 7.605 1.00 71.03 N ATOM 1703 CA TYR A 110 5.672 6.519 7.112 1.00 21.40 C ATOM 1704 C TYR A 110 5.697 7.573 8.202 1.00 3.14 C ATOM 1705 O TYR A 110 4.648 7.994 8.686 1.00 74.32 O ATOM 1706 CB TYR A 110 4.978 7.086 5.870 1.00 34.02 C ATOM 1707 CG TYR A 110 5.131 6.245 4.622 1.00 44.25 C ATOM 1708 CD1 TYR A 110 6.296 6.298 3.864 1.00 24.40 C ATOM 1709 CD2 TYR A 110 4.109 5.407 4.193 1.00 14.03 C ATOM 1710 CE1 TYR A 110 6.435 5.542 2.716 1.00 31.34 C ATOM 1711 CE2 TYR A 110 4.239 4.652 3.045 1.00 53.55 C ATOM 1712 CZ TYR A 110 5.404 4.721 2.313 1.00 42.32 C ATOM 1713 OH TYR A 110 5.534 3.973 1.166 1.00 51.10 O ATOM 0 H TYR A 110 4.040 5.532 7.947 1.00 71.03 H new ATOM 0 HA TYR A 110 6.688 6.236 6.836 1.00 21.40 H new ATOM 0 HB2 TYR A 110 3.916 7.203 6.085 1.00 34.02 H new ATOM 0 HB3 TYR A 110 5.374 8.082 5.672 1.00 34.02 H new ATOM 0 HD1 TYR A 110 7.105 6.941 4.178 1.00 24.40 H new ATOM 0 HD2 TYR A 110 3.197 5.345 4.768 1.00 14.03 H new ATOM 0 HE1 TYR A 110 7.346 5.594 2.138 1.00 31.34 H new ATOM 0 HE2 TYR A 110 3.432 4.011 2.722 1.00 53.55 H new ATOM 0 HH TYR A 110 4.719 3.448 1.024 1.00 51.10 H new ATOM 1723 N ARG A 111 6.882 7.976 8.610 1.00 63.13 N ATOM 1724 CA ARG A 111 7.015 9.005 9.625 1.00 75.12 C ATOM 1725 C ARG A 111 7.783 10.186 9.054 1.00 21.12 C ATOM 1726 O ARG A 111 8.660 10.005 8.208 1.00 12.32 O ATOM 1727 CB ARG A 111 7.732 8.458 10.862 1.00 14.30 C ATOM 1728 CG ARG A 111 7.081 7.217 11.449 1.00 42.45 C ATOM 1729 CD ARG A 111 7.810 6.744 12.694 1.00 41.03 C ATOM 1730 NE ARG A 111 9.233 6.523 12.444 1.00 55.33 N ATOM 1731 CZ ARG A 111 10.110 6.167 13.379 1.00 32.22 C ATOM 1732 NH1 ARG A 111 9.711 5.966 14.631 1.00 55.42 N ATOM 1733 NH2 ARG A 111 11.387 6.007 13.056 1.00 60.11 N ATOM 0 H ARG A 111 7.766 7.609 8.257 1.00 63.13 H new ATOM 0 HA ARG A 111 6.020 9.332 9.926 1.00 75.12 H new ATOM 0 HB2 ARG A 111 8.764 8.226 10.599 1.00 14.30 H new ATOM 0 HB3 ARG A 111 7.764 9.236 11.625 1.00 14.30 H new ATOM 0 HG2 ARG A 111 6.041 7.432 11.694 1.00 42.45 H new ATOM 0 HG3 ARG A 111 7.075 6.421 10.705 1.00 42.45 H new ATOM 0 HD2 ARG A 111 7.692 7.483 13.486 1.00 41.03 H new ATOM 0 HD3 ARG A 111 7.357 5.819 13.050 1.00 41.03 H new ATOM 0 HE ARG A 111 9.576 6.650 11.492 1.00 55.33 H new ATOM 0 HH11 ARG A 111 8.729 6.085 14.878 1.00 55.42 H new ATOM 0 HH12 ARG A 111 10.387 5.693 15.344 1.00 55.42 H new ATOM 0 HH21 ARG A 111 11.692 6.157 12.094 1.00 60.11 H new ATOM 0 HH22 ARG A 111 12.063 5.734 13.769 1.00 60.11 H new ATOM 1747 N PRO A 112 7.445 11.411 9.474 1.00 32.32 N ATOM 1748 CA PRO A 112 8.150 12.610 9.027 1.00 52.42 C ATOM 1749 C PRO A 112 9.581 12.642 9.555 1.00 73.03 C ATOM 1750 O PRO A 112 9.873 12.067 10.605 1.00 31.54 O ATOM 1751 CB PRO A 112 7.331 13.767 9.625 1.00 33.42 C ATOM 1752 CG PRO A 112 6.040 13.158 10.061 1.00 1.01 C ATOM 1753 CD PRO A 112 6.350 11.730 10.398 1.00 42.22 C ATOM 0 HA PRO A 112 8.230 12.660 7.941 1.00 52.42 H new ATOM 0 HB2 PRO A 112 7.853 14.224 10.466 1.00 33.42 H new ATOM 0 HB3 PRO A 112 7.165 14.553 8.888 1.00 33.42 H new ATOM 0 HG2 PRO A 112 5.633 13.683 10.925 1.00 1.01 H new ATOM 0 HG3 PRO A 112 5.293 13.219 9.270 1.00 1.01 H new ATOM 0 HD2 PRO A 112 6.652 11.616 11.439 1.00 42.22 H new ATOM 0 HD3 PRO A 112 5.488 11.081 10.244 1.00 42.22 H new ATOM 1761 N PRO A 113 10.489 13.326 8.846 1.00 1.31 N ATOM 1762 CA PRO A 113 11.886 13.446 9.263 1.00 52.13 C ATOM 1763 C PRO A 113 12.068 14.514 10.334 1.00 24.10 C ATOM 1764 O PRO A 113 13.188 14.818 10.746 1.00 20.23 O ATOM 1765 CB PRO A 113 12.596 13.847 7.973 1.00 3.42 C ATOM 1766 CG PRO A 113 11.574 14.610 7.199 1.00 34.00 C ATOM 1767 CD PRO A 113 10.232 14.028 7.572 1.00 53.33 C ATOM 0 HA PRO A 113 12.271 12.528 9.708 1.00 52.13 H new ATOM 0 HB2 PRO A 113 13.475 14.458 8.178 1.00 3.42 H new ATOM 0 HB3 PRO A 113 12.938 12.972 7.421 1.00 3.42 H new ATOM 0 HG2 PRO A 113 11.617 15.672 7.441 1.00 34.00 H new ATOM 0 HG3 PRO A 113 11.752 14.520 6.127 1.00 34.00 H new ATOM 0 HD2 PRO A 113 9.478 14.806 7.690 1.00 53.33 H new ATOM 0 HD3 PRO A 113 9.867 13.344 6.806 1.00 53.33 H new ATOM 1775 N GLY A 114 10.955 15.073 10.784 1.00 50.05 N ATOM 1776 CA GLY A 114 10.988 16.139 11.758 1.00 30.15 C ATOM 1777 C GLY A 114 10.447 17.425 11.173 1.00 20.23 C ATOM 1778 O GLY A 114 9.559 17.388 10.320 1.00 14.52 O ATOM 0 H GLY A 114 10.018 14.801 10.486 1.00 50.05 H new ATOM 0 HA2 GLY A 114 10.400 15.857 12.631 1.00 30.15 H new ATOM 0 HA3 GLY A 114 12.012 16.293 12.099 1.00 30.15 H new ATOM 1782 N GLY A 115 10.976 18.555 11.625 1.00 64.41 N ATOM 1783 CA GLY A 115 10.573 19.838 11.079 1.00 12.31 C ATOM 1784 C GLY A 115 9.099 20.127 11.283 1.00 62.21 C ATOM 1785 O GLY A 115 8.415 20.578 10.364 1.00 65.22 O ATOM 0 H GLY A 115 11.679 18.606 12.362 1.00 64.41 H new ATOM 0 HA2 GLY A 115 11.161 20.628 11.547 1.00 12.31 H new ATOM 0 HA3 GLY A 115 10.799 19.861 10.013 1.00 12.31 H new ATOM 1789 N SER A 116 8.613 19.877 12.491 1.00 1.24 N ATOM 1790 CA SER A 116 7.213 20.105 12.821 1.00 3.31 C ATOM 1791 C SER A 116 6.854 21.585 12.684 1.00 75.34 C ATOM 1792 O SER A 116 5.714 21.933 12.375 1.00 71.34 O ATOM 1793 CB SER A 116 6.933 19.624 14.245 1.00 73.23 C ATOM 1794 OG SER A 116 7.325 18.270 14.409 1.00 41.31 O ATOM 0 H SER A 116 9.172 19.514 13.263 1.00 1.24 H new ATOM 0 HA SER A 116 6.596 19.541 12.122 1.00 3.31 H new ATOM 0 HB2 SER A 116 7.470 20.251 14.957 1.00 73.23 H new ATOM 0 HB3 SER A 116 5.871 19.728 14.466 1.00 73.23 H new ATOM 0 HG SER A 116 7.138 17.984 15.328 1.00 41.31 H new ATOM 1800 N ALA A 117 7.842 22.448 12.898 1.00 43.12 N ATOM 1801 CA ALA A 117 7.641 23.885 12.781 1.00 5.12 C ATOM 1802 C ALA A 117 7.476 24.293 11.322 1.00 21.12 C ATOM 1803 O ALA A 117 6.760 25.246 11.007 1.00 11.35 O ATOM 1804 CB ALA A 117 8.804 24.635 13.412 1.00 45.21 C ATOM 0 H ALA A 117 8.791 22.175 13.154 1.00 43.12 H new ATOM 0 HA ALA A 117 6.726 24.146 13.313 1.00 5.12 H new ATOM 0 HB1 ALA A 117 8.639 25.708 13.317 1.00 45.21 H new ATOM 0 HB2 ALA A 117 8.877 24.371 14.467 1.00 45.21 H new ATOM 0 HB3 ALA A 117 9.730 24.364 12.905 1.00 45.21 H new ATOM 1810 N GLY A 118 8.124 23.546 10.436 1.00 51.41 N ATOM 1811 CA GLY A 118 8.105 23.862 9.019 1.00 30.43 C ATOM 1812 C GLY A 118 6.780 23.535 8.359 1.00 44.02 C ATOM 1813 O GLY A 118 6.461 24.075 7.302 1.00 2.22 O ATOM 0 H GLY A 118 8.668 22.718 10.677 1.00 51.41 H new ATOM 0 HA2 GLY A 118 8.320 24.922 8.886 1.00 30.43 H new ATOM 0 HA3 GLY A 118 8.901 23.310 8.518 1.00 30.43 H new ATOM 1817 N ALA A 119 6.003 22.662 8.995 1.00 32.34 N ATOM 1818 CA ALA A 119 4.716 22.216 8.458 1.00 3.25 C ATOM 1819 C ALA A 119 3.759 23.383 8.201 1.00 1.22 C ATOM 1820 O ALA A 119 2.805 23.259 7.428 1.00 13.32 O ATOM 1821 CB ALA A 119 4.078 21.209 9.405 1.00 32.51 C ATOM 0 H ALA A 119 6.244 22.244 9.894 1.00 32.34 H new ATOM 0 HA ALA A 119 4.909 21.741 7.496 1.00 3.25 H new ATOM 0 HB1 ALA A 119 3.121 20.882 8.998 1.00 32.51 H new ATOM 0 HB2 ALA A 119 4.737 20.348 9.518 1.00 32.51 H new ATOM 0 HB3 ALA A 119 3.919 21.675 10.378 1.00 32.51 H new ATOM 1827 N VAL A 120 4.025 24.514 8.845 1.00 62.20 N ATOM 1828 CA VAL A 120 3.170 25.689 8.741 1.00 44.14 C ATOM 1829 C VAL A 120 3.064 26.191 7.296 1.00 41.50 C ATOM 1830 O VAL A 120 2.034 26.735 6.902 1.00 20.54 O ATOM 1831 CB VAL A 120 3.677 26.826 9.660 1.00 53.13 C ATOM 1832 CG1 VAL A 120 5.043 27.329 9.217 1.00 12.04 C ATOM 1833 CG2 VAL A 120 2.675 27.967 9.715 1.00 43.51 C ATOM 0 H VAL A 120 4.836 24.641 9.451 1.00 62.20 H new ATOM 0 HA VAL A 120 2.174 25.388 9.067 1.00 44.14 H new ATOM 0 HB VAL A 120 3.783 26.416 10.664 1.00 53.13 H new ATOM 0 HG11 VAL A 120 5.370 28.127 9.883 1.00 12.04 H new ATOM 0 HG12 VAL A 120 5.761 26.510 9.252 1.00 12.04 H new ATOM 0 HG13 VAL A 120 4.977 27.711 8.198 1.00 12.04 H new ATOM 0 HG21 VAL A 120 3.055 28.753 10.367 1.00 43.51 H new ATOM 0 HG22 VAL A 120 2.525 28.368 8.713 1.00 43.51 H new ATOM 0 HG23 VAL A 120 1.726 27.599 10.105 1.00 43.51 H new ATOM 1843 N ILE A 121 4.112 25.980 6.496 1.00 14.14 N ATOM 1844 CA ILE A 121 4.113 26.467 5.118 1.00 75.31 C ATOM 1845 C ILE A 121 3.047 25.760 4.287 1.00 33.51 C ATOM 1846 O ILE A 121 2.450 26.357 3.393 1.00 33.20 O ATOM 1847 CB ILE A 121 5.502 26.340 4.441 1.00 42.43 C ATOM 1848 CG1 ILE A 121 6.016 24.893 4.434 1.00 54.12 C ATOM 1849 CG2 ILE A 121 6.504 27.248 5.134 1.00 61.02 C ATOM 1850 CD1 ILE A 121 5.653 24.110 3.189 1.00 64.32 C ATOM 0 H ILE A 121 4.958 25.483 6.774 1.00 14.14 H new ATOM 0 HA ILE A 121 3.875 27.530 5.165 1.00 75.31 H new ATOM 0 HB ILE A 121 5.387 26.648 3.402 1.00 42.43 H new ATOM 0 HG12 ILE A 121 7.101 24.904 4.539 1.00 54.12 H new ATOM 0 HG13 ILE A 121 5.617 24.374 5.305 1.00 54.12 H new ATOM 0 HG21 ILE A 121 7.477 27.152 4.651 1.00 61.02 H new ATOM 0 HG22 ILE A 121 6.166 28.282 5.066 1.00 61.02 H new ATOM 0 HG23 ILE A 121 6.589 26.962 6.182 1.00 61.02 H new ATOM 0 HD11 ILE A 121 6.054 23.099 3.265 1.00 64.32 H new ATOM 0 HD12 ILE A 121 4.568 24.064 3.092 1.00 64.32 H new ATOM 0 HD13 ILE A 121 6.075 24.603 2.313 1.00 64.32 H new ATOM 1862 N ALA A 122 2.790 24.500 4.605 1.00 15.14 N ATOM 1863 CA ALA A 122 1.749 23.747 3.927 1.00 13.13 C ATOM 1864 C ALA A 122 0.385 24.186 4.436 1.00 25.20 C ATOM 1865 O ALA A 122 -0.555 24.345 3.666 1.00 40.03 O ATOM 1866 CB ALA A 122 1.946 22.251 4.136 1.00 63.21 C ATOM 0 H ALA A 122 3.288 23.979 5.327 1.00 15.14 H new ATOM 0 HA ALA A 122 1.807 23.947 2.857 1.00 13.13 H new ATOM 0 HB1 ALA A 122 1.156 21.704 3.620 1.00 63.21 H new ATOM 0 HB2 ALA A 122 2.915 21.952 3.736 1.00 63.21 H new ATOM 0 HB3 ALA A 122 1.908 22.024 5.202 1.00 63.21 H new ATOM 1872 N ARG A 123 0.314 24.425 5.742 1.00 42.40 N ATOM 1873 CA ARG A 123 -0.925 24.824 6.412 1.00 4.43 C ATOM 1874 C ARG A 123 -1.487 26.122 5.830 1.00 20.52 C ATOM 1875 O ARG A 123 -2.697 26.352 5.850 1.00 55.11 O ATOM 1876 CB ARG A 123 -0.654 24.998 7.909 1.00 11.30 C ATOM 1877 CG ARG A 123 -1.874 25.389 8.726 1.00 31.23 C ATOM 1878 CD ARG A 123 -1.493 25.652 10.173 1.00 45.23 C ATOM 1879 NE ARG A 123 -2.643 26.019 10.994 1.00 74.35 N ATOM 1880 CZ ARG A 123 -2.604 26.113 12.323 1.00 51.11 C ATOM 1881 NH1 ARG A 123 -1.460 25.917 12.970 1.00 41.32 N ATOM 1882 NH2 ARG A 123 -3.704 26.419 13.000 1.00 34.52 N ATOM 0 H ARG A 123 1.115 24.348 6.369 1.00 42.40 H new ATOM 0 HA ARG A 123 -1.668 24.042 6.254 1.00 4.43 H new ATOM 0 HB2 ARG A 123 -0.251 24.065 8.304 1.00 11.30 H new ATOM 0 HB3 ARG A 123 0.115 25.759 8.041 1.00 11.30 H new ATOM 0 HG2 ARG A 123 -2.333 26.280 8.298 1.00 31.23 H new ATOM 0 HG3 ARG A 123 -2.618 24.594 8.680 1.00 31.23 H new ATOM 0 HD2 ARG A 123 -1.022 24.761 10.589 1.00 45.23 H new ATOM 0 HD3 ARG A 123 -0.753 26.451 10.211 1.00 45.23 H new ATOM 0 HE ARG A 123 -3.527 26.215 10.524 1.00 74.35 H new ATOM 0 HH11 ARG A 123 -0.611 25.695 12.450 1.00 41.32 H new ATOM 0 HH12 ARG A 123 -1.430 25.989 13.987 1.00 41.32 H new ATOM 0 HH21 ARG A 123 -4.580 26.582 12.503 1.00 34.52 H new ATOM 0 HH22 ARG A 123 -3.674 26.491 14.017 1.00 34.52 H new ATOM 1896 N MET A 124 -0.602 26.962 5.309 1.00 3.43 N ATOM 1897 CA MET A 124 -0.999 28.247 4.743 1.00 63.20 C ATOM 1898 C MET A 124 -1.973 28.066 3.582 1.00 1.23 C ATOM 1899 O MET A 124 -2.998 28.745 3.511 1.00 34.42 O ATOM 1900 CB MET A 124 0.231 29.021 4.273 1.00 75.31 C ATOM 1901 CG MET A 124 1.154 29.446 5.403 1.00 44.34 C ATOM 1902 SD MET A 124 2.687 30.185 4.809 1.00 64.10 S ATOM 1903 CE MET A 124 3.510 30.524 6.362 1.00 0.22 C ATOM 0 H MET A 124 0.400 26.776 5.266 1.00 3.43 H new ATOM 0 HA MET A 124 -1.504 28.813 5.526 1.00 63.20 H new ATOM 0 HB2 MET A 124 0.791 28.404 3.571 1.00 75.31 H new ATOM 0 HB3 MET A 124 -0.095 29.908 3.729 1.00 75.31 H new ATOM 0 HG2 MET A 124 0.635 30.161 6.041 1.00 44.34 H new ATOM 0 HG3 MET A 124 1.389 28.579 6.020 1.00 44.34 H new ATOM 0 HE1 MET A 124 4.478 30.985 6.168 1.00 0.22 H new ATOM 0 HE2 MET A 124 2.898 31.202 6.958 1.00 0.22 H new ATOM 0 HE3 MET A 124 3.655 29.592 6.908 1.00 0.22 H new ATOM 1913 N PHE A 125 -1.666 27.139 2.684 1.00 20.53 N ATOM 1914 CA PHE A 125 -2.490 26.936 1.498 1.00 50.41 C ATOM 1915 C PHE A 125 -3.309 25.654 1.590 1.00 51.50 C ATOM 1916 O PHE A 125 -4.367 25.543 0.973 1.00 64.10 O ATOM 1917 CB PHE A 125 -1.624 26.917 0.239 1.00 2.02 C ATOM 1918 CG PHE A 125 -1.012 28.253 -0.083 1.00 23.51 C ATOM 1919 CD1 PHE A 125 -1.753 29.226 -0.737 1.00 65.31 C ATOM 1920 CD2 PHE A 125 0.299 28.536 0.268 1.00 2.34 C ATOM 1921 CE1 PHE A 125 -1.196 30.455 -1.038 1.00 54.02 C ATOM 1922 CE2 PHE A 125 0.859 29.763 -0.032 1.00 45.43 C ATOM 1923 CZ PHE A 125 0.112 30.724 -0.684 1.00 72.14 C ATOM 0 H PHE A 125 -0.859 26.519 2.752 1.00 20.53 H new ATOM 0 HA PHE A 125 -3.186 27.773 1.440 1.00 50.41 H new ATOM 0 HB2 PHE A 125 -0.829 26.182 0.364 1.00 2.02 H new ATOM 0 HB3 PHE A 125 -2.230 26.590 -0.606 1.00 2.02 H new ATOM 0 HD1 PHE A 125 -2.777 29.021 -1.014 1.00 65.31 H new ATOM 0 HD2 PHE A 125 0.888 27.790 0.781 1.00 2.34 H new ATOM 0 HE1 PHE A 125 -1.783 31.204 -1.549 1.00 54.02 H new ATOM 0 HE2 PHE A 125 1.882 29.971 0.244 1.00 45.43 H new ATOM 0 HZ PHE A 125 0.549 31.684 -0.917 1.00 72.14 H new ATOM 1933 N ASN A 126 -2.822 24.692 2.359 1.00 53.04 N ATOM 1934 CA ASN A 126 -3.531 23.437 2.552 1.00 5.51 C ATOM 1935 C ASN A 126 -4.202 23.440 3.918 1.00 44.41 C ATOM 1936 O ASN A 126 -3.550 23.654 4.938 1.00 12.11 O ATOM 1937 CB ASN A 126 -2.571 22.246 2.454 1.00 52.25 C ATOM 1938 CG ASN A 126 -3.295 20.934 2.201 1.00 11.23 C ATOM 1939 OD1 ASN A 126 -4.238 20.874 1.413 1.00 44.03 O ATOM 1940 ND2 ASN A 126 -2.888 19.884 2.893 1.00 74.22 N ATOM 0 H ASN A 126 -1.936 24.757 2.861 1.00 53.04 H new ATOM 0 HA ASN A 126 -4.283 23.339 1.769 1.00 5.51 H new ATOM 0 HB2 ASN A 126 -1.857 22.424 1.650 1.00 52.25 H new ATOM 0 HB3 ASN A 126 -1.998 22.169 3.378 1.00 52.25 H new ATOM 0 HD21 ASN A 126 -3.360 18.986 2.783 1.00 74.22 H new ATOM 0 HD22 ASN A 126 -2.102 19.971 3.537 1.00 74.22 H new ATOM 1947 N GLN A 127 -5.501 23.199 3.932 1.00 20.25 N ATOM 1948 CA GLN A 127 -6.275 23.216 5.172 1.00 43.21 C ATOM 1949 C GLN A 127 -6.082 21.933 5.968 1.00 22.13 C ATOM 1950 O GLN A 127 -6.642 21.788 7.056 1.00 25.12 O ATOM 1951 CB GLN A 127 -7.763 23.378 4.864 1.00 45.31 C ATOM 1952 CG GLN A 127 -8.133 24.709 4.242 1.00 72.10 C ATOM 1953 CD GLN A 127 -9.593 24.758 3.849 1.00 42.22 C ATOM 1954 OE1 GLN A 127 -9.957 24.432 2.716 1.00 63.10 O ATOM 1955 NE2 GLN A 127 -10.442 25.137 4.789 1.00 14.34 N ATOM 0 H GLN A 127 -6.049 22.988 3.098 1.00 20.25 H new ATOM 0 HA GLN A 127 -5.918 24.058 5.765 1.00 43.21 H new ATOM 0 HB2 GLN A 127 -8.071 22.578 4.191 1.00 45.31 H new ATOM 0 HB3 GLN A 127 -8.328 23.253 5.788 1.00 45.31 H new ATOM 0 HG2 GLN A 127 -7.919 25.512 4.947 1.00 72.10 H new ATOM 0 HG3 GLN A 127 -7.514 24.884 3.362 1.00 72.10 H new ATOM 0 HE21 GLN A 127 -10.097 25.398 5.713 1.00 14.34 H new ATOM 0 HE22 GLN A 127 -11.442 25.168 4.591 1.00 14.34 H new ATOM 1964 N GLU A 128 -5.282 21.017 5.425 1.00 22.53 N ATOM 1965 CA GLU A 128 -5.160 19.671 5.977 1.00 64.03 C ATOM 1966 C GLU A 128 -6.550 19.038 6.078 1.00 12.12 C ATOM 1967 O GLU A 128 -7.071 18.831 7.177 1.00 31.50 O ATOM 1968 CB GLU A 128 -4.476 19.701 7.352 1.00 3.11 C ATOM 1969 CG GLU A 128 -3.057 20.254 7.326 1.00 32.21 C ATOM 1970 CD GLU A 128 -2.092 19.352 6.583 1.00 3.31 C ATOM 1971 OE1 GLU A 128 -1.548 18.415 7.211 1.00 74.33 O ATOM 1972 OE2 GLU A 128 -1.867 19.573 5.376 1.00 21.41 O ATOM 0 H GLU A 128 -4.707 21.185 4.600 1.00 22.53 H new ATOM 0 HA GLU A 128 -4.538 19.070 5.313 1.00 64.03 H new ATOM 0 HB2 GLU A 128 -5.077 20.304 8.033 1.00 3.11 H new ATOM 0 HB3 GLU A 128 -4.453 18.689 7.757 1.00 3.11 H new ATOM 0 HG2 GLU A 128 -3.063 21.238 6.857 1.00 32.21 H new ATOM 0 HG3 GLU A 128 -2.706 20.391 8.349 1.00 32.21 H new ATOM 1979 N PRO A 129 -7.178 18.748 4.918 1.00 70.24 N ATOM 1980 CA PRO A 129 -8.572 18.287 4.854 1.00 52.10 C ATOM 1981 C PRO A 129 -8.816 17.033 5.684 1.00 24.02 C ATOM 1982 O PRO A 129 -9.827 16.923 6.378 1.00 3.33 O ATOM 1983 CB PRO A 129 -8.791 17.994 3.367 1.00 54.45 C ATOM 1984 CG PRO A 129 -7.763 18.808 2.661 1.00 3.25 C ATOM 1985 CD PRO A 129 -6.574 18.844 3.576 1.00 35.23 C ATOM 0 HA PRO A 129 -9.257 19.031 5.260 1.00 52.10 H new ATOM 0 HB2 PRO A 129 -8.671 16.932 3.152 1.00 54.45 H new ATOM 0 HB3 PRO A 129 -9.798 18.271 3.054 1.00 54.45 H new ATOM 0 HG2 PRO A 129 -7.504 18.364 1.700 1.00 3.25 H new ATOM 0 HG3 PRO A 129 -8.131 19.814 2.458 1.00 3.25 H new ATOM 0 HD2 PRO A 129 -5.891 18.017 3.382 1.00 35.23 H new ATOM 0 HD3 PRO A 129 -6.002 19.764 3.457 1.00 35.23 H new ATOM 1993 N SER A 130 -7.881 16.103 5.627 1.00 2.20 N ATOM 1994 CA SER A 130 -7.999 14.870 6.377 1.00 34.42 C ATOM 1995 C SER A 130 -6.615 14.394 6.801 1.00 41.01 C ATOM 1996 O SER A 130 -5.604 14.910 6.321 1.00 1.44 O ATOM 1997 CB SER A 130 -8.713 13.803 5.539 1.00 4.11 C ATOM 1998 OG SER A 130 -9.030 12.672 6.326 1.00 74.25 O ATOM 0 H SER A 130 -7.031 16.180 5.068 1.00 2.20 H new ATOM 0 HA SER A 130 -8.595 15.048 7.272 1.00 34.42 H new ATOM 0 HB2 SER A 130 -9.625 14.221 5.111 1.00 4.11 H new ATOM 0 HB3 SER A 130 -8.078 13.504 4.705 1.00 4.11 H new ATOM 0 HG SER A 130 -8.691 11.863 5.888 1.00 74.25 H new ATOM 2004 N GLN A 131 -6.575 13.416 7.694 1.00 12.41 N ATOM 2005 CA GLN A 131 -5.316 12.940 8.250 1.00 14.41 C ATOM 2006 C GLN A 131 -4.775 11.758 7.448 1.00 23.42 C ATOM 2007 O GLN A 131 -3.635 11.340 7.637 1.00 74.23 O ATOM 2008 CB GLN A 131 -5.502 12.565 9.723 1.00 21.00 C ATOM 2009 CG GLN A 131 -6.450 11.399 9.952 1.00 62.15 C ATOM 2010 CD GLN A 131 -7.012 11.382 11.359 1.00 51.21 C ATOM 2011 OE1 GLN A 131 -8.078 11.938 11.619 1.00 41.23 O ATOM 2012 NE2 GLN A 131 -6.285 10.774 12.287 1.00 14.41 N ATOM 0 H GLN A 131 -7.401 12.936 8.050 1.00 12.41 H new ATOM 0 HA GLN A 131 -4.582 13.744 8.186 1.00 14.41 H new ATOM 0 HB2 GLN A 131 -4.530 12.318 10.149 1.00 21.00 H new ATOM 0 HB3 GLN A 131 -5.876 13.435 10.264 1.00 21.00 H new ATOM 0 HG2 GLN A 131 -7.270 11.455 9.236 1.00 62.15 H new ATOM 0 HG3 GLN A 131 -5.924 10.463 9.762 1.00 62.15 H new ATOM 0 HE21 GLN A 131 -5.406 10.324 12.032 1.00 14.41 H new ATOM 0 HE22 GLN A 131 -6.605 10.757 13.255 1.00 14.41 H new ATOM 2021 N GLN A 132 -5.602 11.221 6.560 1.00 54.33 N ATOM 2022 CA GLN A 132 -5.163 10.174 5.651 1.00 31.14 C ATOM 2023 C GLN A 132 -5.714 10.410 4.249 1.00 14.31 C ATOM 2024 O GLN A 132 -6.922 10.426 4.027 1.00 54.15 O ATOM 2025 CB GLN A 132 -5.526 8.771 6.175 1.00 34.14 C ATOM 2026 CG GLN A 132 -6.780 8.694 7.044 1.00 31.21 C ATOM 2027 CD GLN A 132 -8.076 8.842 6.271 1.00 44.53 C ATOM 2028 OE1 GLN A 132 -8.605 9.941 6.125 1.00 32.02 O ATOM 2029 NE2 GLN A 132 -8.597 7.733 5.770 1.00 14.35 N ATOM 0 H GLN A 132 -6.579 11.494 6.451 1.00 54.33 H new ATOM 0 HA GLN A 132 -4.075 10.217 5.596 1.00 31.14 H new ATOM 0 HB2 GLN A 132 -5.656 8.107 5.321 1.00 34.14 H new ATOM 0 HB3 GLN A 132 -4.683 8.389 6.751 1.00 34.14 H new ATOM 0 HG2 GLN A 132 -6.788 7.738 7.568 1.00 31.21 H new ATOM 0 HG3 GLN A 132 -6.731 9.474 7.804 1.00 31.21 H new ATOM 0 HE21 GLN A 132 -8.127 6.839 5.913 1.00 14.35 H new ATOM 0 HE22 GLN A 132 -9.468 7.773 5.241 1.00 14.35 H new ATOM 2038 N LEU A 133 -4.812 10.628 3.308 1.00 43.54 N ATOM 2039 CA LEU A 133 -5.189 10.890 1.929 1.00 4.52 C ATOM 2040 C LEU A 133 -4.440 9.953 0.995 1.00 61.13 C ATOM 2041 O LEU A 133 -3.235 9.752 1.141 1.00 51.12 O ATOM 2042 CB LEU A 133 -4.884 12.346 1.557 1.00 31.43 C ATOM 2043 CG LEU A 133 -5.680 13.403 2.327 1.00 63.34 C ATOM 2044 CD1 LEU A 133 -5.175 14.799 1.991 1.00 0.42 C ATOM 2045 CD2 LEU A 133 -7.162 13.287 2.007 1.00 15.33 C ATOM 0 H LEU A 133 -3.806 10.629 3.475 1.00 43.54 H new ATOM 0 HA LEU A 133 -6.260 10.718 1.826 1.00 4.52 H new ATOM 0 HB2 LEU A 133 -3.821 12.529 1.717 1.00 31.43 H new ATOM 0 HB3 LEU A 133 -5.074 12.478 0.492 1.00 31.43 H new ATOM 0 HG LEU A 133 -5.540 13.231 3.394 1.00 63.34 H new ATOM 0 HD11 LEU A 133 -5.752 15.538 2.547 1.00 0.42 H new ATOM 0 HD12 LEU A 133 -4.123 14.880 2.263 1.00 0.42 H new ATOM 0 HD13 LEU A 133 -5.288 14.979 0.922 1.00 0.42 H new ATOM 0 HD21 LEU A 133 -7.715 14.045 2.562 1.00 15.33 H new ATOM 0 HD22 LEU A 133 -7.316 13.435 0.938 1.00 15.33 H new ATOM 0 HD23 LEU A 133 -7.519 12.297 2.291 1.00 15.33 H new ATOM 2057 N ARG A 134 -5.154 9.381 0.038 1.00 13.12 N ATOM 2058 CA ARG A 134 -4.546 8.476 -0.935 1.00 52.33 C ATOM 2059 C ARG A 134 -4.025 9.245 -2.153 1.00 15.11 C ATOM 2060 O ARG A 134 -4.137 8.782 -3.287 1.00 52.44 O ATOM 2061 CB ARG A 134 -5.553 7.406 -1.376 1.00 64.14 C ATOM 2062 CG ARG A 134 -6.839 7.964 -1.963 1.00 40.01 C ATOM 2063 CD ARG A 134 -7.715 6.861 -2.539 1.00 61.11 C ATOM 2064 NE ARG A 134 -8.101 5.869 -1.538 1.00 73.12 N ATOM 2065 CZ ARG A 134 -9.162 5.073 -1.648 1.00 12.01 C ATOM 2066 NH1 ARG A 134 -9.975 5.179 -2.693 1.00 30.14 N ATOM 2067 NH2 ARG A 134 -9.420 4.182 -0.704 1.00 42.13 N ATOM 0 H ARG A 134 -6.156 9.525 -0.089 1.00 13.12 H new ATOM 0 HA ARG A 134 -3.700 7.986 -0.453 1.00 52.33 H new ATOM 0 HB2 ARG A 134 -5.079 6.761 -2.116 1.00 64.14 H new ATOM 0 HB3 ARG A 134 -5.800 6.780 -0.518 1.00 64.14 H new ATOM 0 HG2 ARG A 134 -7.390 8.501 -1.191 1.00 40.01 H new ATOM 0 HG3 ARG A 134 -6.600 8.686 -2.744 1.00 40.01 H new ATOM 0 HD2 ARG A 134 -8.612 7.303 -2.971 1.00 61.11 H new ATOM 0 HD3 ARG A 134 -7.182 6.365 -3.350 1.00 61.11 H new ATOM 0 HE ARG A 134 -7.521 5.781 -0.703 1.00 73.12 H new ATOM 0 HH11 ARG A 134 -9.788 5.873 -3.417 1.00 30.14 H new ATOM 0 HH12 ARG A 134 -10.787 4.566 -2.772 1.00 30.14 H new ATOM 0 HH21 ARG A 134 -8.806 4.106 0.107 1.00 42.13 H new ATOM 0 HH22 ARG A 134 -10.233 3.572 -0.787 1.00 42.13 H new ATOM 2081 N ASP A 135 -3.424 10.407 -1.905 1.00 42.13 N ATOM 2082 CA ASP A 135 -2.899 11.250 -2.981 1.00 12.24 C ATOM 2083 C ASP A 135 -1.743 10.553 -3.694 1.00 54.23 C ATOM 2084 O ASP A 135 -1.659 10.560 -4.921 1.00 71.22 O ATOM 2085 CB ASP A 135 -2.433 12.600 -2.430 1.00 11.35 C ATOM 2086 CG ASP A 135 -1.974 13.552 -3.521 1.00 0.21 C ATOM 2087 OD1 ASP A 135 -2.813 14.324 -4.038 1.00 74.40 O ATOM 2088 OD2 ASP A 135 -0.769 13.554 -3.853 1.00 65.32 O ATOM 0 H ASP A 135 -3.288 10.788 -0.969 1.00 42.13 H new ATOM 0 HA ASP A 135 -3.702 11.422 -3.698 1.00 12.24 H new ATOM 0 HB2 ASP A 135 -3.248 13.060 -1.871 1.00 11.35 H new ATOM 0 HB3 ASP A 135 -1.616 12.438 -1.727 1.00 11.35 H new ATOM 2093 N ASP A 136 -0.850 9.954 -2.921 1.00 54.42 N ATOM 2094 CA ASP A 136 0.235 9.164 -3.487 1.00 75.01 C ATOM 2095 C ASP A 136 -0.292 7.831 -3.996 1.00 73.14 C ATOM 2096 O ASP A 136 0.146 7.324 -5.026 1.00 14.14 O ATOM 2097 CB ASP A 136 1.339 8.921 -2.452 1.00 15.03 C ATOM 2098 CG ASP A 136 2.151 10.166 -2.154 1.00 43.13 C ATOM 2099 OD1 ASP A 136 1.669 11.030 -1.394 1.00 1.41 O ATOM 2100 OD2 ASP A 136 3.283 10.283 -2.674 1.00 33.30 O ATOM 0 H ASP A 136 -0.854 9.999 -1.902 1.00 54.42 H new ATOM 0 HA ASP A 136 0.658 9.726 -4.319 1.00 75.01 H new ATOM 0 HB2 ASP A 136 0.890 8.556 -1.528 1.00 15.03 H new ATOM 0 HB3 ASP A 136 2.004 8.137 -2.815 1.00 15.03 H new ATOM 2105 N LEU A 137 -1.258 7.276 -3.276 1.00 74.00 N ATOM 2106 CA LEU A 137 -1.775 5.947 -3.584 1.00 43.20 C ATOM 2107 C LEU A 137 -2.594 5.920 -4.869 1.00 71.10 C ATOM 2108 O LEU A 137 -2.627 4.901 -5.557 1.00 5.30 O ATOM 2109 CB LEU A 137 -2.598 5.403 -2.411 1.00 60.22 C ATOM 2110 CG LEU A 137 -1.983 4.202 -1.684 1.00 73.15 C ATOM 2111 CD1 LEU A 137 -0.571 4.519 -1.212 1.00 25.04 C ATOM 2112 CD2 LEU A 137 -2.851 3.784 -0.504 1.00 75.12 C ATOM 0 H LEU A 137 -1.700 7.725 -2.474 1.00 74.00 H new ATOM 0 HA LEU A 137 -0.911 5.301 -3.744 1.00 43.20 H new ATOM 0 HB2 LEU A 137 -2.748 6.206 -1.690 1.00 60.22 H new ATOM 0 HB3 LEU A 137 -3.583 5.118 -2.780 1.00 60.22 H new ATOM 0 HG LEU A 137 -1.933 3.373 -2.390 1.00 73.15 H new ATOM 0 HD11 LEU A 137 -0.156 3.652 -0.699 1.00 25.04 H new ATOM 0 HD12 LEU A 137 0.053 4.766 -2.071 1.00 25.04 H new ATOM 0 HD13 LEU A 137 -0.598 5.367 -0.528 1.00 25.04 H new ATOM 0 HD21 LEU A 137 -2.396 2.930 -0.002 1.00 75.12 H new ATOM 0 HD22 LEU A 137 -2.936 4.614 0.197 1.00 75.12 H new ATOM 0 HD23 LEU A 137 -3.843 3.508 -0.862 1.00 75.12 H new ATOM 2124 N MET A 138 -3.246 7.024 -5.211 1.00 42.34 N ATOM 2125 CA MET A 138 -3.966 7.094 -6.478 1.00 33.15 C ATOM 2126 C MET A 138 -2.986 6.983 -7.645 1.00 33.44 C ATOM 2127 O MET A 138 -3.355 6.538 -8.732 1.00 5.00 O ATOM 2128 CB MET A 138 -4.828 8.366 -6.595 1.00 54.03 C ATOM 2129 CG MET A 138 -4.101 9.661 -6.280 1.00 63.41 C ATOM 2130 SD MET A 138 -4.134 10.845 -7.641 1.00 4.11 S ATOM 2131 CE MET A 138 -3.013 10.051 -8.787 1.00 60.54 C ATOM 0 H MET A 138 -3.292 7.869 -4.642 1.00 42.34 H new ATOM 0 HA MET A 138 -4.655 6.250 -6.512 1.00 33.15 H new ATOM 0 HB2 MET A 138 -5.225 8.426 -7.608 1.00 54.03 H new ATOM 0 HB3 MET A 138 -5.681 8.272 -5.923 1.00 54.03 H new ATOM 0 HG2 MET A 138 -4.552 10.118 -5.399 1.00 63.41 H new ATOM 0 HG3 MET A 138 -3.065 9.436 -6.028 1.00 63.41 H new ATOM 0 HE1 MET A 138 -2.699 10.768 -9.545 1.00 60.54 H new ATOM 0 HE2 MET A 138 -2.138 9.688 -8.248 1.00 60.54 H new ATOM 0 HE3 MET A 138 -3.517 9.213 -9.267 1.00 60.54 H new ATOM 2141 N ARG A 139 -1.732 7.381 -7.412 1.00 32.25 N ATOM 2142 CA ARG A 139 -0.676 7.209 -8.406 1.00 40.23 C ATOM 2143 C ARG A 139 -0.349 5.729 -8.549 1.00 21.22 C ATOM 2144 O ARG A 139 -0.304 5.190 -9.655 1.00 11.55 O ATOM 2145 CB ARG A 139 0.594 7.957 -7.993 1.00 75.55 C ATOM 2146 CG ARG A 139 0.432 9.461 -7.865 1.00 43.33 C ATOM 2147 CD ARG A 139 1.733 10.099 -7.407 1.00 63.11 C ATOM 2148 NE ARG A 139 1.683 11.560 -7.425 1.00 45.11 N ATOM 2149 CZ ARG A 139 2.693 12.326 -7.833 1.00 55.03 C ATOM 2150 NH1 ARG A 139 3.820 11.769 -8.256 1.00 22.41 N ATOM 2151 NH2 ARG A 139 2.581 13.647 -7.811 1.00 53.54 N ATOM 0 H ARG A 139 -1.427 7.823 -6.545 1.00 32.25 H new ATOM 0 HA ARG A 139 -1.032 7.614 -9.354 1.00 40.23 H new ATOM 0 HB2 ARG A 139 0.939 7.560 -7.038 1.00 75.55 H new ATOM 0 HB3 ARG A 139 1.375 7.750 -8.725 1.00 75.55 H new ATOM 0 HG2 ARG A 139 0.131 9.883 -8.824 1.00 43.33 H new ATOM 0 HG3 ARG A 139 -0.362 9.688 -7.153 1.00 43.33 H new ATOM 0 HD2 ARG A 139 1.963 9.760 -6.397 1.00 63.11 H new ATOM 0 HD3 ARG A 139 2.545 9.760 -8.050 1.00 63.11 H new ATOM 0 HE ARG A 139 0.828 12.017 -7.108 1.00 45.11 H new ATOM 0 HH11 ARG A 139 3.913 10.753 -8.269 1.00 22.41 H new ATOM 0 HH12 ARG A 139 4.593 12.356 -8.568 1.00 22.41 H new ATOM 0 HH21 ARG A 139 1.719 14.080 -7.481 1.00 53.54 H new ATOM 0 HH22 ARG A 139 3.357 14.230 -8.124 1.00 53.54 H new ATOM 2165 N PHE A 140 -0.149 5.088 -7.402 1.00 43.22 N ATOM 2166 CA PHE A 140 0.193 3.673 -7.331 1.00 14.53 C ATOM 2167 C PHE A 140 -0.850 2.823 -8.046 1.00 14.43 C ATOM 2168 O PHE A 140 -0.514 1.974 -8.873 1.00 62.31 O ATOM 2169 CB PHE A 140 0.306 3.257 -5.856 1.00 12.53 C ATOM 2170 CG PHE A 140 0.585 1.799 -5.633 1.00 52.35 C ATOM 2171 CD1 PHE A 140 1.876 1.306 -5.719 1.00 40.24 C ATOM 2172 CD2 PHE A 140 -0.443 0.928 -5.312 1.00 51.23 C ATOM 2173 CE1 PHE A 140 2.135 -0.031 -5.492 1.00 41.11 C ATOM 2174 CE2 PHE A 140 -0.190 -0.410 -5.089 1.00 21.51 C ATOM 2175 CZ PHE A 140 1.102 -0.890 -5.175 1.00 23.31 C ATOM 0 H PHE A 140 -0.220 5.539 -6.490 1.00 43.22 H new ATOM 0 HA PHE A 140 1.149 3.512 -7.830 1.00 14.53 H new ATOM 0 HB2 PHE A 140 1.099 3.840 -5.388 1.00 12.53 H new ATOM 0 HB3 PHE A 140 -0.623 3.517 -5.348 1.00 12.53 H new ATOM 0 HD1 PHE A 140 2.688 1.974 -5.966 1.00 40.24 H new ATOM 0 HD2 PHE A 140 -1.454 1.300 -5.235 1.00 51.23 H new ATOM 0 HE1 PHE A 140 3.146 -0.405 -5.562 1.00 41.11 H new ATOM 0 HE2 PHE A 140 -1.001 -1.081 -4.848 1.00 21.51 H new ATOM 0 HZ PHE A 140 1.304 -1.936 -4.995 1.00 23.31 H new ATOM 2185 N LYS A 141 -2.115 3.071 -7.735 1.00 21.23 N ATOM 2186 CA LYS A 141 -3.210 2.335 -8.349 1.00 71.23 C ATOM 2187 C LYS A 141 -3.245 2.601 -9.849 1.00 21.22 C ATOM 2188 O LYS A 141 -3.398 1.677 -10.645 1.00 73.21 O ATOM 2189 CB LYS A 141 -4.545 2.737 -7.708 1.00 13.13 C ATOM 2190 CG LYS A 141 -5.700 1.782 -8.002 1.00 31.14 C ATOM 2191 CD LYS A 141 -6.286 1.973 -9.392 1.00 34.23 C ATOM 2192 CE LYS A 141 -6.865 3.365 -9.580 1.00 53.20 C ATOM 2193 NZ LYS A 141 -7.455 3.538 -10.933 1.00 14.30 N ATOM 0 H LYS A 141 -2.408 3.777 -7.060 1.00 21.23 H new ATOM 0 HA LYS A 141 -3.051 1.269 -8.185 1.00 71.23 H new ATOM 0 HB2 LYS A 141 -4.410 2.803 -6.628 1.00 13.13 H new ATOM 0 HB3 LYS A 141 -4.816 3.733 -8.057 1.00 13.13 H new ATOM 0 HG2 LYS A 141 -5.351 0.755 -7.898 1.00 31.14 H new ATOM 0 HG3 LYS A 141 -6.484 1.929 -7.259 1.00 31.14 H new ATOM 0 HD2 LYS A 141 -5.511 1.799 -10.139 1.00 34.23 H new ATOM 0 HD3 LYS A 141 -7.065 1.230 -9.562 1.00 34.23 H new ATOM 0 HE2 LYS A 141 -7.629 3.546 -8.824 1.00 53.20 H new ATOM 0 HE3 LYS A 141 -6.082 4.108 -9.427 1.00 53.20 H new ATOM 0 HZ1 LYS A 141 -8.014 4.414 -10.958 1.00 14.30 H new ATOM 0 HZ2 LYS A 141 -6.694 3.593 -11.639 1.00 14.30 H new ATOM 0 HZ3 LYS A 141 -8.071 2.728 -11.149 1.00 14.30 H new ATOM 2207 N ARG A 142 -3.085 3.865 -10.221 1.00 63.12 N ATOM 2208 CA ARG A 142 -3.189 4.278 -11.615 1.00 44.24 C ATOM 2209 C ARG A 142 -2.195 3.518 -12.488 1.00 63.51 C ATOM 2210 O ARG A 142 -2.570 2.935 -13.503 1.00 2.14 O ATOM 2211 CB ARG A 142 -2.946 5.781 -11.733 1.00 25.13 C ATOM 2212 CG ARG A 142 -3.272 6.352 -13.098 1.00 45.10 C ATOM 2213 CD ARG A 142 -2.994 7.841 -13.143 1.00 15.21 C ATOM 2214 NE ARG A 142 -3.503 8.460 -14.362 1.00 53.11 N ATOM 2215 CZ ARG A 142 -2.920 9.493 -14.966 1.00 54.30 C ATOM 2216 NH1 ARG A 142 -1.750 9.945 -14.536 1.00 74.22 N ATOM 2217 NH2 ARG A 142 -3.496 10.062 -16.017 1.00 72.13 N ATOM 0 H ARG A 142 -2.882 4.626 -9.573 1.00 63.12 H new ATOM 0 HA ARG A 142 -4.195 4.047 -11.965 1.00 44.24 H new ATOM 0 HB2 ARG A 142 -3.546 6.296 -10.982 1.00 25.13 H new ATOM 0 HB3 ARG A 142 -1.901 5.989 -11.504 1.00 25.13 H new ATOM 0 HG2 ARG A 142 -2.680 5.844 -13.860 1.00 45.10 H new ATOM 0 HG3 ARG A 142 -4.320 6.167 -13.333 1.00 45.10 H new ATOM 0 HD2 ARG A 142 -3.450 8.320 -12.277 1.00 15.21 H new ATOM 0 HD3 ARG A 142 -1.920 8.011 -13.073 1.00 15.21 H new ATOM 0 HE ARG A 142 -4.354 8.079 -14.775 1.00 53.11 H new ATOM 0 HH11 ARG A 142 -1.293 9.501 -13.739 1.00 74.22 H new ATOM 0 HH12 ARG A 142 -1.307 10.737 -15.002 1.00 74.22 H new ATOM 0 HH21 ARG A 142 -4.388 9.708 -16.364 1.00 72.13 H new ATOM 0 HH22 ARG A 142 -3.047 10.853 -16.478 1.00 72.13 H new ATOM 2231 N GLU A 143 -0.937 3.505 -12.071 1.00 60.44 N ATOM 2232 CA GLU A 143 0.110 2.825 -12.825 1.00 20.23 C ATOM 2233 C GLU A 143 -0.126 1.316 -12.831 1.00 34.23 C ATOM 2234 O GLU A 143 0.262 0.615 -13.768 1.00 64.33 O ATOM 2235 CB GLU A 143 1.484 3.132 -12.220 1.00 13.01 C ATOM 2236 CG GLU A 143 1.801 4.615 -12.128 1.00 24.33 C ATOM 2237 CD GLU A 143 3.200 4.880 -11.604 1.00 65.34 C ATOM 2238 OE1 GLU A 143 3.420 4.751 -10.381 1.00 13.02 O ATOM 2239 OE2 GLU A 143 4.089 5.221 -12.416 1.00 12.13 O ATOM 0 H GLU A 143 -0.615 3.957 -11.215 1.00 60.44 H new ATOM 0 HA GLU A 143 0.083 3.189 -13.852 1.00 20.23 H new ATOM 0 HB2 GLU A 143 1.535 2.697 -11.222 1.00 13.01 H new ATOM 0 HB3 GLU A 143 2.251 2.643 -12.820 1.00 13.01 H new ATOM 0 HG2 GLU A 143 1.694 5.068 -13.114 1.00 24.33 H new ATOM 0 HG3 GLU A 143 1.075 5.098 -11.475 1.00 24.33 H new ATOM 2246 N GLN A 144 -0.789 0.832 -11.791 1.00 72.44 N ATOM 2247 CA GLN A 144 -0.985 -0.595 -11.589 1.00 63.10 C ATOM 2248 C GLN A 144 -2.086 -1.157 -12.492 1.00 22.52 C ATOM 2249 O GLN A 144 -2.048 -2.334 -12.861 1.00 43.54 O ATOM 2250 CB GLN A 144 -1.310 -0.862 -10.120 1.00 71.41 C ATOM 2251 CG GLN A 144 -1.264 -2.326 -9.721 1.00 21.54 C ATOM 2252 CD GLN A 144 -1.373 -2.509 -8.219 1.00 4.32 C ATOM 2253 OE1 GLN A 144 -1.997 -1.709 -7.532 1.00 51.04 O ATOM 2254 NE2 GLN A 144 -0.752 -3.553 -7.698 1.00 64.51 N ATOM 0 H GLN A 144 -1.205 1.416 -11.066 1.00 72.44 H new ATOM 0 HA GLN A 144 -0.060 -1.105 -11.859 1.00 63.10 H new ATOM 0 HB2 GLN A 144 -0.607 -0.307 -9.499 1.00 71.41 H new ATOM 0 HB3 GLN A 144 -2.304 -0.471 -9.904 1.00 71.41 H new ATOM 0 HG2 GLN A 144 -2.077 -2.861 -10.211 1.00 21.54 H new ATOM 0 HG3 GLN A 144 -0.333 -2.769 -10.074 1.00 21.54 H new ATOM 0 HE21 GLN A 144 -0.242 -4.197 -8.303 1.00 64.51 H new ATOM 0 HE22 GLN A 144 -0.782 -3.714 -6.691 1.00 64.51 H new ATOM 2263 N GLU A 145 -3.065 -0.333 -12.844 1.00 64.32 N ATOM 2264 CA GLU A 145 -4.148 -0.786 -13.713 1.00 60.42 C ATOM 2265 C GLU A 145 -4.059 -0.181 -15.111 1.00 42.51 C ATOM 2266 O GLU A 145 -4.730 -0.646 -16.034 1.00 1.04 O ATOM 2267 CB GLU A 145 -5.521 -0.525 -13.076 1.00 73.21 C ATOM 2268 CG GLU A 145 -5.694 0.848 -12.443 1.00 5.42 C ATOM 2269 CD GLU A 145 -6.067 1.939 -13.427 1.00 3.33 C ATOM 2270 OE1 GLU A 145 -6.603 1.620 -14.506 1.00 3.45 O ATOM 2271 OE2 GLU A 145 -5.857 3.127 -13.104 1.00 5.14 O ATOM 0 H GLU A 145 -3.133 0.640 -12.547 1.00 64.32 H new ATOM 0 HA GLU A 145 -4.032 -1.864 -13.828 1.00 60.42 H new ATOM 0 HB2 GLU A 145 -6.288 -0.654 -13.840 1.00 73.21 H new ATOM 0 HB3 GLU A 145 -5.700 -1.283 -12.314 1.00 73.21 H new ATOM 0 HG2 GLU A 145 -6.464 0.788 -11.674 1.00 5.42 H new ATOM 0 HG3 GLU A 145 -4.766 1.126 -11.943 1.00 5.42 H new ATOM 2278 N LEU A 146 -3.227 0.843 -15.272 1.00 3.24 N ATOM 2279 CA LEU A 146 -2.989 1.427 -16.587 1.00 12.12 C ATOM 2280 C LEU A 146 -2.372 0.381 -17.507 1.00 41.34 C ATOM 2281 O LEU A 146 -2.725 0.275 -18.680 1.00 23.34 O ATOM 2282 CB LEU A 146 -2.064 2.644 -16.477 1.00 74.31 C ATOM 2283 CG LEU A 146 -1.789 3.380 -17.791 1.00 71.22 C ATOM 2284 CD1 LEU A 146 -3.072 3.971 -18.356 1.00 63.22 C ATOM 2285 CD2 LEU A 146 -0.746 4.465 -17.585 1.00 13.32 C ATOM 0 H LEU A 146 -2.709 1.284 -14.512 1.00 3.24 H new ATOM 0 HA LEU A 146 -3.941 1.757 -17.003 1.00 12.12 H new ATOM 0 HB2 LEU A 146 -2.501 3.349 -15.770 1.00 74.31 H new ATOM 0 HB3 LEU A 146 -1.112 2.319 -16.056 1.00 74.31 H new ATOM 0 HG LEU A 146 -1.400 2.660 -18.511 1.00 71.22 H new ATOM 0 HD11 LEU A 146 -2.854 4.489 -19.290 1.00 63.22 H new ATOM 0 HD12 LEU A 146 -3.789 3.172 -18.544 1.00 63.22 H new ATOM 0 HD13 LEU A 146 -3.494 4.676 -17.640 1.00 63.22 H new ATOM 0 HD21 LEU A 146 -0.563 4.978 -18.529 1.00 13.32 H new ATOM 0 HD22 LEU A 146 -1.107 5.181 -16.847 1.00 13.32 H new ATOM 0 HD23 LEU A 146 0.182 4.015 -17.231 1.00 13.32 H new ATOM 2297 N GLY A 147 -1.460 -0.404 -16.954 1.00 71.02 N ATOM 2298 CA GLY A 147 -0.870 -1.493 -17.699 1.00 31.42 C ATOM 2299 C GLY A 147 -1.421 -2.831 -17.252 1.00 74.41 C ATOM 2300 O GLY A 147 -1.202 -3.247 -16.114 1.00 33.41 O ATOM 0 H GLY A 147 -1.118 -0.304 -15.998 1.00 71.02 H new ATOM 0 HA2 GLY A 147 -1.064 -1.355 -18.763 1.00 31.42 H new ATOM 0 HA3 GLY A 147 0.212 -1.481 -17.568 1.00 31.42 H new ATOM 2304 N LEU A 148 -2.153 -3.495 -18.132 1.00 64.41 N ATOM 2305 CA LEU A 148 -2.727 -4.795 -17.815 1.00 41.40 C ATOM 2306 C LEU A 148 -1.675 -5.881 -17.983 1.00 22.04 C ATOM 2307 O LEU A 148 -1.318 -6.569 -17.025 1.00 32.04 O ATOM 2308 CB LEU A 148 -3.936 -5.080 -18.711 1.00 30.04 C ATOM 2309 CG LEU A 148 -5.078 -4.067 -18.602 1.00 43.14 C ATOM 2310 CD1 LEU A 148 -6.201 -4.425 -19.560 1.00 61.04 C ATOM 2311 CD2 LEU A 148 -5.599 -3.996 -17.173 1.00 31.13 C ATOM 0 H LEU A 148 -2.364 -3.157 -19.071 1.00 64.41 H new ATOM 0 HA LEU A 148 -3.063 -4.787 -16.778 1.00 41.40 H new ATOM 0 HB2 LEU A 148 -3.600 -5.115 -19.747 1.00 30.04 H new ATOM 0 HB3 LEU A 148 -4.324 -6.069 -18.468 1.00 30.04 H new ATOM 0 HG LEU A 148 -4.691 -3.085 -18.875 1.00 43.14 H new ATOM 0 HD11 LEU A 148 -7.004 -3.694 -19.469 1.00 61.04 H new ATOM 0 HD12 LEU A 148 -5.822 -4.422 -20.582 1.00 61.04 H new ATOM 0 HD13 LEU A 148 -6.584 -5.416 -19.318 1.00 61.04 H new ATOM 0 HD21 LEU A 148 -6.410 -3.270 -17.117 1.00 31.13 H new ATOM 0 HD22 LEU A 148 -5.968 -4.976 -16.871 1.00 31.13 H new ATOM 0 HD23 LEU A 148 -4.792 -3.691 -16.506 1.00 31.13 H new ATOM 2323 N GLU A 149 -1.179 -6.006 -19.204 1.00 24.41 N ATOM 2324 CA GLU A 149 -0.108 -6.935 -19.526 1.00 1.24 C ATOM 2325 C GLU A 149 1.031 -6.153 -20.163 1.00 55.41 C ATOM 2326 O GLU A 149 0.877 -5.609 -21.260 1.00 32.14 O ATOM 2327 CB GLU A 149 -0.603 -8.017 -20.488 1.00 75.12 C ATOM 2328 CG GLU A 149 -1.763 -8.833 -19.945 1.00 12.11 C ATOM 2329 CD GLU A 149 -2.337 -9.782 -20.975 1.00 10.04 C ATOM 2330 OE1 GLU A 149 -3.219 -9.360 -21.754 1.00 54.25 O ATOM 2331 OE2 GLU A 149 -1.921 -10.959 -21.008 1.00 43.50 O ATOM 0 H GLU A 149 -1.509 -5.464 -20.002 1.00 24.41 H new ATOM 0 HA GLU A 149 0.235 -7.426 -18.616 1.00 1.24 H new ATOM 0 HB2 GLU A 149 -0.907 -7.547 -21.423 1.00 75.12 H new ATOM 0 HB3 GLU A 149 0.223 -8.688 -20.722 1.00 75.12 H new ATOM 0 HG2 GLU A 149 -1.428 -9.402 -19.078 1.00 12.11 H new ATOM 0 HG3 GLU A 149 -2.547 -8.159 -19.600 1.00 12.11 H new ATOM 2338 N HIS A 150 2.156 -6.069 -19.476 1.00 4.34 N ATOM 2339 CA HIS A 150 3.245 -5.225 -19.934 1.00 15.31 C ATOM 2340 C HIS A 150 4.585 -5.939 -19.786 1.00 73.42 C ATOM 2341 O HIS A 150 4.812 -6.658 -18.818 1.00 35.42 O ATOM 2342 CB HIS A 150 3.238 -3.917 -19.135 1.00 60.52 C ATOM 2343 CG HIS A 150 3.982 -2.788 -19.779 1.00 62.02 C ATOM 2344 ND1 HIS A 150 5.139 -2.263 -19.261 1.00 41.34 N ATOM 2345 CD2 HIS A 150 3.700 -2.055 -20.882 1.00 54.14 C ATOM 2346 CE1 HIS A 150 5.537 -1.253 -20.007 1.00 2.40 C ATOM 2347 NE2 HIS A 150 4.685 -1.106 -21.000 1.00 4.12 N ATOM 0 H HIS A 150 2.339 -6.570 -18.607 1.00 4.34 H new ATOM 0 HA HIS A 150 3.105 -5.003 -20.992 1.00 15.31 H new ATOM 0 HB2 HIS A 150 2.204 -3.610 -18.976 1.00 60.52 H new ATOM 0 HB3 HIS A 150 3.670 -4.105 -18.152 1.00 60.52 H new ATOM 0 HD1 HIS A 150 5.617 -2.603 -18.427 1.00 41.34 H new ATOM 0 HD2 HIS A 150 2.858 -2.191 -21.545 1.00 54.14 H new ATOM 0 HE1 HIS A 150 6.414 -0.648 -19.833 1.00 2.40 H new ATOM 2356 N HIS A 151 5.455 -5.762 -20.773 1.00 25.12 N ATOM 2357 CA HIS A 151 6.806 -6.313 -20.721 1.00 31.24 C ATOM 2358 C HIS A 151 7.826 -5.221 -21.022 1.00 32.51 C ATOM 2359 O HIS A 151 8.657 -5.350 -21.921 1.00 31.31 O ATOM 2360 CB HIS A 151 6.974 -7.513 -21.675 1.00 0.32 C ATOM 2361 CG HIS A 151 6.436 -7.312 -23.065 1.00 23.53 C ATOM 2362 ND1 HIS A 151 7.206 -6.891 -24.130 1.00 42.33 N ATOM 2363 CD2 HIS A 151 5.194 -7.516 -23.564 1.00 62.43 C ATOM 2364 CE1 HIS A 151 6.460 -6.845 -25.219 1.00 35.21 C ATOM 2365 NE2 HIS A 151 5.234 -7.221 -24.905 1.00 11.22 N ATOM 0 H HIS A 151 5.249 -5.239 -21.624 1.00 25.12 H new ATOM 0 HA HIS A 151 6.980 -6.687 -19.712 1.00 31.24 H new ATOM 0 HB2 HIS A 151 8.035 -7.754 -21.745 1.00 0.32 H new ATOM 0 HB3 HIS A 151 6.479 -8.378 -21.234 1.00 0.32 H new ATOM 0 HD2 HIS A 151 4.330 -7.850 -23.009 1.00 62.43 H new ATOM 0 HE1 HIS A 151 6.797 -6.549 -26.202 1.00 35.21 H new ATOM 0 HE2 HIS A 151 4.447 -7.282 -25.551 1.00 11.22 H new ATOM 2374 N HIS A 152 7.746 -4.155 -20.235 1.00 73.15 N ATOM 2375 CA HIS A 152 8.576 -2.963 -20.389 1.00 70.01 C ATOM 2376 C HIS A 152 8.530 -2.444 -21.824 1.00 64.22 C ATOM 2377 O HIS A 152 7.471 -2.028 -22.290 1.00 34.21 O ATOM 2378 CB HIS A 152 10.013 -3.223 -19.925 1.00 74.44 C ATOM 2379 CG HIS A 152 10.658 -2.012 -19.318 1.00 55.40 C ATOM 2380 ND1 HIS A 152 10.110 -1.321 -18.256 1.00 33.32 N ATOM 2381 CD2 HIS A 152 11.803 -1.365 -19.630 1.00 34.11 C ATOM 2382 CE1 HIS A 152 10.891 -0.305 -17.942 1.00 15.10 C ATOM 2383 NE2 HIS A 152 11.925 -0.310 -18.760 1.00 34.55 N ATOM 0 H HIS A 152 7.090 -4.092 -19.456 1.00 73.15 H new ATOM 0 HA HIS A 152 8.166 -2.183 -19.747 1.00 70.01 H new ATOM 0 HB2 HIS A 152 10.013 -4.033 -19.195 1.00 74.44 H new ATOM 0 HB3 HIS A 152 10.609 -3.559 -20.774 1.00 74.44 H new ATOM 0 HD1 HIS A 152 9.236 -1.559 -17.787 1.00 33.32 H new ATOM 0 HD2 HIS A 152 12.494 -1.629 -20.417 1.00 34.11 H new ATOM 0 HE1 HIS A 152 10.714 0.408 -17.151 1.00 15.10 H new ATOM 2392 N HIS A 153 9.654 -2.479 -22.530 1.00 33.25 N ATOM 2393 CA HIS A 153 9.700 -1.992 -23.906 1.00 65.23 C ATOM 2394 C HIS A 153 11.045 -2.296 -24.547 1.00 12.41 C ATOM 2395 O HIS A 153 12.044 -2.491 -23.852 1.00 62.10 O ATOM 2396 CB HIS A 153 9.435 -0.473 -23.966 1.00 25.42 C ATOM 2397 CG HIS A 153 10.477 0.373 -23.287 1.00 34.34 C ATOM 2398 ND1 HIS A 153 10.250 1.064 -22.116 1.00 34.55 N ATOM 2399 CD2 HIS A 153 11.761 0.641 -23.628 1.00 14.30 C ATOM 2400 CE1 HIS A 153 11.346 1.712 -21.769 1.00 15.30 C ATOM 2401 NE2 HIS A 153 12.277 1.471 -22.668 1.00 35.34 N ATOM 0 H HIS A 153 10.541 -2.837 -22.176 1.00 33.25 H new ATOM 0 HA HIS A 153 8.917 -2.510 -24.460 1.00 65.23 H new ATOM 0 HB2 HIS A 153 9.365 -0.171 -25.011 1.00 25.42 H new ATOM 0 HB3 HIS A 153 8.466 -0.268 -23.510 1.00 25.42 H new ATOM 0 HD2 HIS A 153 12.282 0.268 -24.497 1.00 14.30 H new ATOM 0 HE1 HIS A 153 11.460 2.335 -20.894 1.00 15.30 H new ATOM 0 HE2 HIS A 153 13.227 1.842 -22.652 1.00 35.34 H new ATOM 2410 N HIS A 154 11.053 -2.329 -25.868 1.00 64.03 N ATOM 2411 CA HIS A 154 12.281 -2.416 -26.639 1.00 13.43 C ATOM 2412 C HIS A 154 11.969 -2.026 -28.083 1.00 5.41 C ATOM 2413 O HIS A 154 11.696 -0.861 -28.365 1.00 40.44 O ATOM 2414 CB HIS A 154 12.895 -3.827 -26.556 1.00 30.05 C ATOM 2415 CG HIS A 154 14.317 -3.916 -27.045 1.00 53.14 C ATOM 2416 ND1 HIS A 154 15.090 -5.050 -26.908 1.00 73.43 N ATOM 2417 CD2 HIS A 154 15.099 -3.009 -27.683 1.00 34.13 C ATOM 2418 CE1 HIS A 154 16.279 -4.837 -27.441 1.00 1.14 C ATOM 2419 NE2 HIS A 154 16.310 -3.609 -27.918 1.00 12.43 N ATOM 0 H HIS A 154 10.207 -2.296 -26.437 1.00 64.03 H new ATOM 0 HA HIS A 154 13.023 -1.732 -26.228 1.00 13.43 H new ATOM 0 HB2 HIS A 154 12.858 -4.166 -25.521 1.00 30.05 H new ATOM 0 HB3 HIS A 154 12.280 -4.513 -27.138 1.00 30.05 H new ATOM 0 HD2 HIS A 154 14.820 -2.002 -27.955 1.00 34.13 H new ATOM 0 HE1 HIS A 154 17.090 -5.549 -27.480 1.00 1.14 H new ATOM 0 HE2 HIS A 154 17.106 -3.175 -28.386 1.00 12.43 H new ATOM 2428 N HIS A 155 11.968 -3.007 -28.976 1.00 30.44 N ATOM 2429 CA HIS A 155 11.630 -2.808 -30.382 1.00 51.05 C ATOM 2430 C HIS A 155 11.375 -4.161 -31.021 1.00 34.32 C ATOM 2431 O HIS A 155 12.358 -4.861 -31.331 1.00 37.02 O ATOM 2432 CB HIS A 155 12.740 -2.076 -31.152 1.00 23.22 C ATOM 2433 CG HIS A 155 12.665 -0.579 -31.074 1.00 64.40 C ATOM 2434 ND1 HIS A 155 11.545 0.139 -31.438 1.00 53.32 N ATOM 2435 CD2 HIS A 155 13.577 0.337 -30.670 1.00 42.31 C ATOM 2436 CE1 HIS A 155 11.772 1.426 -31.265 1.00 22.42 C ATOM 2437 NE2 HIS A 155 12.995 1.573 -30.798 1.00 74.45 N ATOM 2438 OXT HIS A 155 10.195 -4.531 -31.177 1.00 37.02 O ATOM 0 H HIS A 155 12.204 -3.972 -28.744 1.00 30.44 H new ATOM 0 HA HIS A 155 10.738 -2.183 -30.429 1.00 51.05 H new ATOM 0 HB2 HIS A 155 13.707 -2.400 -30.767 1.00 23.22 H new ATOM 0 HB3 HIS A 155 12.697 -2.376 -32.199 1.00 23.22 H new ATOM 0 HD2 HIS A 155 14.576 0.133 -30.314 1.00 42.31 H new ATOM 0 HE1 HIS A 155 11.074 2.224 -31.471 1.00 22.42 H new ATOM 0 HE2 HIS A 155 13.438 2.463 -30.568 1.00 74.45 H new TER 2447 HIS A 155