USER MOD reduce.3.24.130724 H: found=0, std=0, add=847, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 846 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 76 SER OG : rot -128:sc= 0.194 USER MOD Set 1.2: A 86 HIS : no HD1:sc= -1.04 K(o=-0.85,f=-3.3!) USER MOD Set 2.1: A 67 TYR OH : rot -14:sc= 0.361 USER MOD Set 2.2: A 139 CYS SG : rot 98:sc= 0.154 USER MOD Set 3.1: A 54 SER OG : rot 180:sc= -0.049 USER MOD Set 3.2: A 64 SER OG : rot 36:sc= 1.02 USER MOD Set 4.1: A 45 THR OG1 : rot 136:sc= 0.493 USER MOD Set 4.2: A 47 TYR OH : rot 180:sc= 0.513 USER MOD Single : A 27 GLN : amide:sc= -1.33! C(o=-1.3!,f=-5.7!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.0086) USER MOD Single : A 29 GLN : amide:sc= -0.736 K(o=-0.74,f=-2.5) USER MOD Single : A 32 THR OG1 : rot -1:sc= -0.347 USER MOD Single : A 37 ASN :FLIP amide:sc= -5.88! C(o=-6.4!,f=-5.9!) USER MOD Single : A 39 LYS NZ :NH3+ 141:sc= -0.115 (180deg=-0.56) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.0532 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 130:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= -0.0966 USER MOD Single : A 73 HIS : no HD1:sc= -1.35 K(o=-1.3,f=-2!) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 150:sc= -1.43 USER MOD Single : A 90 MET CE :methyl -158:sc= -0.914 (180deg=-3.04!) USER MOD Single : A 92 ASN : amide:sc= -1.9 K(o=-1.9,f=-6.4!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 144:sc= 0 (180deg=-0.0252) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -0.473 USER MOD Single : A 124 SER OG : rot -57:sc= 0.915 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 132 MET CE :methyl 157:sc= -0.148 (180deg=-1.39) USER MOD Single : A 134 THR OG1 : rot 81:sc= 0.761 USER MOD Single : A 136 MET CE :methyl -159:sc= -0.706 (180deg=-1.43) USER MOD Single : A 137 CYS SG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.365 X(o=-0.37,f=-0.053) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 27 10.808 8.765 3.051 1.00 0.00 N ATOM 2 CA GLN A 27 10.607 8.264 4.448 1.00 0.00 C ATOM 3 C GLN A 27 10.878 6.758 4.524 1.00 0.00 C ATOM 4 O GLN A 27 10.546 6.015 3.618 1.00 0.00 O ATOM 5 CB GLN A 27 9.144 8.563 4.770 1.00 0.00 C ATOM 6 CG GLN A 27 8.867 8.236 6.238 1.00 0.00 C ATOM 7 CD GLN A 27 7.416 8.581 6.574 1.00 0.00 C ATOM 8 OE1 GLN A 27 6.500 7.920 6.126 1.00 0.00 O ATOM 9 NE2 GLN A 27 7.166 9.600 7.351 1.00 0.00 N ATOM 0 HA GLN A 27 11.287 8.740 5.155 1.00 0.00 H new ATOM 0 HB2 GLN A 27 8.924 9.612 4.573 1.00 0.00 H new ATOM 0 HB3 GLN A 27 8.491 7.974 4.126 1.00 0.00 H new ATOM 0 HG2 GLN A 27 9.053 7.179 6.427 1.00 0.00 H new ATOM 0 HG3 GLN A 27 9.544 8.799 6.881 1.00 0.00 H new ATOM 0 HE21 GLN A 27 7.935 10.155 7.727 1.00 0.00 H new ATOM 0 HE22 GLN A 27 6.202 9.841 7.582 1.00 0.00 H new ATOM 18 N GLN A 28 11.480 6.312 5.601 1.00 0.00 N ATOM 19 CA GLN A 28 11.783 4.857 5.759 1.00 0.00 C ATOM 20 C GLN A 28 11.325 4.365 7.135 1.00 0.00 C ATOM 21 O GLN A 28 11.273 5.124 8.088 1.00 0.00 O ATOM 22 CB GLN A 28 13.305 4.758 5.633 1.00 0.00 C ATOM 23 CG GLN A 28 13.733 3.291 5.712 1.00 0.00 C ATOM 24 CD GLN A 28 15.261 3.209 5.770 1.00 0.00 C ATOM 25 OE1 GLN A 28 15.869 3.684 6.710 1.00 0.00 O ATOM 26 NE2 GLN A 28 15.909 2.624 4.802 1.00 0.00 N ATOM 0 H GLN A 28 11.776 6.899 6.381 1.00 0.00 H new ATOM 0 HA GLN A 28 11.269 4.244 5.018 1.00 0.00 H new ATOM 0 HB2 GLN A 28 13.631 5.192 4.687 1.00 0.00 H new ATOM 0 HB3 GLN A 28 13.784 5.330 6.428 1.00 0.00 H new ATOM 0 HG2 GLN A 28 13.299 2.821 6.595 1.00 0.00 H new ATOM 0 HG3 GLN A 28 13.361 2.745 4.845 1.00 0.00 H new ATOM 0 HE21 GLN A 28 15.398 2.226 4.014 1.00 0.00 H new ATOM 0 HE22 GLN A 28 16.927 2.564 4.833 1.00 0.00 H new ATOM 35 N GLN A 29 10.995 3.100 7.241 1.00 0.00 N ATOM 36 CA GLN A 29 10.539 2.534 8.549 1.00 0.00 C ATOM 37 C GLN A 29 11.516 1.432 9.013 1.00 0.00 C ATOM 38 O GLN A 29 11.996 0.672 8.196 1.00 0.00 O ATOM 39 CB GLN A 29 9.151 1.947 8.269 1.00 0.00 C ATOM 40 CG GLN A 29 8.191 2.318 9.402 1.00 0.00 C ATOM 41 CD GLN A 29 7.542 3.669 9.095 1.00 0.00 C ATOM 42 OE1 GLN A 29 7.568 4.570 9.909 1.00 0.00 O ATOM 43 NE2 GLN A 29 6.953 3.847 7.942 1.00 0.00 N ATOM 0 H GLN A 29 11.022 2.431 6.471 1.00 0.00 H new ATOM 0 HA GLN A 29 10.506 3.284 9.339 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.771 2.325 7.320 1.00 0.00 H new ATOM 0 HB3 GLN A 29 9.217 0.863 8.177 1.00 0.00 H new ATOM 0 HG2 GLN A 29 7.425 1.550 9.511 1.00 0.00 H new ATOM 0 HG3 GLN A 29 8.729 2.367 10.348 1.00 0.00 H new ATOM 0 HE21 GLN A 29 6.931 3.090 7.258 1.00 0.00 H new ATOM 0 HE22 GLN A 29 6.515 4.743 7.726 1.00 0.00 H new ATOM 52 N PRO A 30 11.794 1.371 10.309 1.00 0.00 N ATOM 53 CA PRO A 30 12.729 0.341 10.818 1.00 0.00 C ATOM 54 C PRO A 30 12.026 -1.014 10.990 1.00 0.00 C ATOM 55 O PRO A 30 12.191 -1.904 10.178 1.00 0.00 O ATOM 56 CB PRO A 30 13.196 0.908 12.157 1.00 0.00 C ATOM 57 CG PRO A 30 12.120 1.854 12.606 1.00 0.00 C ATOM 58 CD PRO A 30 11.287 2.226 11.402 1.00 0.00 C ATOM 0 HA PRO A 30 13.557 0.146 10.136 1.00 0.00 H new ATOM 0 HB2 PRO A 30 13.345 0.112 12.887 1.00 0.00 H new ATOM 0 HB3 PRO A 30 14.150 1.425 12.050 1.00 0.00 H new ATOM 0 HG2 PRO A 30 11.498 1.387 13.369 1.00 0.00 H new ATOM 0 HG3 PRO A 30 12.560 2.745 13.054 1.00 0.00 H new ATOM 0 HD2 PRO A 30 10.227 2.047 11.584 1.00 0.00 H new ATOM 0 HD3 PRO A 30 11.394 3.283 11.159 1.00 0.00 H new ATOM 66 N GLU A 31 11.246 -1.172 12.035 1.00 0.00 N ATOM 67 CA GLU A 31 10.527 -2.463 12.267 1.00 0.00 C ATOM 68 C GLU A 31 9.021 -2.243 12.146 1.00 0.00 C ATOM 69 O GLU A 31 8.476 -1.341 12.760 1.00 0.00 O ATOM 70 CB GLU A 31 10.896 -2.877 13.693 1.00 0.00 C ATOM 71 CG GLU A 31 12.408 -3.089 13.793 1.00 0.00 C ATOM 72 CD GLU A 31 12.770 -3.531 15.212 1.00 0.00 C ATOM 73 OE1 GLU A 31 12.778 -2.684 16.090 1.00 0.00 O ATOM 74 OE2 GLU A 31 13.035 -4.707 15.396 1.00 0.00 O ATOM 0 H GLU A 31 11.077 -0.455 12.741 1.00 0.00 H new ATOM 0 HA GLU A 31 10.802 -3.229 11.542 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.579 -2.109 14.399 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.372 -3.794 13.963 1.00 0.00 H new ATOM 0 HG2 GLU A 31 12.728 -3.842 13.073 1.00 0.00 H new ATOM 0 HG3 GLU A 31 12.932 -2.167 13.543 1.00 0.00 H new ATOM 81 N THR A 32 8.347 -3.048 11.355 1.00 0.00 N ATOM 82 CA THR A 32 6.873 -2.878 11.185 1.00 0.00 C ATOM 83 C THR A 32 6.243 -4.198 10.699 1.00 0.00 C ATOM 84 O THR A 32 6.858 -4.936 9.945 1.00 0.00 O ATOM 85 CB THR A 32 6.765 -1.734 10.146 1.00 0.00 C ATOM 86 OG1 THR A 32 7.092 -0.507 10.784 1.00 0.00 O ATOM 87 CG2 THR A 32 5.351 -1.619 9.544 1.00 0.00 C ATOM 0 H THR A 32 8.758 -3.814 10.821 1.00 0.00 H new ATOM 0 HA THR A 32 6.338 -2.634 12.103 1.00 0.00 H new ATOM 0 HB THR A 32 7.455 -1.957 9.332 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.298 -0.674 11.728 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.328 -0.803 8.822 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.091 -2.552 9.045 1.00 0.00 H new ATOM 0 HG23 THR A 32 4.632 -1.420 10.339 1.00 0.00 H new ATOM 95 N GLU A 33 5.020 -4.493 11.121 1.00 0.00 N ATOM 96 CA GLU A 33 4.370 -5.759 10.668 1.00 0.00 C ATOM 97 C GLU A 33 3.205 -5.442 9.701 1.00 0.00 C ATOM 98 O GLU A 33 2.494 -4.458 9.834 1.00 0.00 O ATOM 99 CB GLU A 33 3.893 -6.384 12.006 1.00 0.00 C ATOM 100 CG GLU A 33 2.847 -7.497 11.797 1.00 0.00 C ATOM 101 CD GLU A 33 3.131 -8.675 12.735 1.00 0.00 C ATOM 102 OE1 GLU A 33 3.654 -8.436 13.811 1.00 0.00 O ATOM 103 OE2 GLU A 33 2.822 -9.794 12.361 1.00 0.00 O ATOM 0 H GLU A 33 4.462 -3.915 11.749 1.00 0.00 H new ATOM 0 HA GLU A 33 5.018 -6.433 10.108 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.752 -6.792 12.539 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.467 -5.604 12.637 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.847 -7.106 11.985 1.00 0.00 H new ATOM 0 HG3 GLU A 33 2.867 -7.835 10.761 1.00 0.00 H new ATOM 110 N ALA A 34 3.020 -6.308 8.743 1.00 0.00 N ATOM 111 CA ALA A 34 1.930 -6.149 7.740 1.00 0.00 C ATOM 112 C ALA A 34 0.834 -7.232 7.836 1.00 0.00 C ATOM 113 O ALA A 34 1.119 -8.441 7.739 1.00 0.00 O ATOM 114 CB ALA A 34 2.632 -6.224 6.388 1.00 0.00 C ATOM 0 H ALA A 34 3.594 -7.141 8.611 1.00 0.00 H new ATOM 0 HA ALA A 34 1.402 -5.210 7.905 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.897 -6.115 5.590 1.00 0.00 H new ATOM 0 HB2 ALA A 34 3.368 -5.423 6.315 1.00 0.00 H new ATOM 0 HB3 ALA A 34 3.133 -7.187 6.291 1.00 0.00 H new ATOM 120 N VAL A 35 -0.409 -6.798 7.927 1.00 0.00 N ATOM 121 CA VAL A 35 -1.571 -7.755 7.915 1.00 0.00 C ATOM 122 C VAL A 35 -2.390 -7.467 6.622 1.00 0.00 C ATOM 123 O VAL A 35 -2.665 -6.328 6.305 1.00 0.00 O ATOM 124 CB VAL A 35 -2.372 -7.477 9.210 1.00 0.00 C ATOM 125 CG1 VAL A 35 -3.698 -8.258 9.219 1.00 0.00 C ATOM 126 CG2 VAL A 35 -1.528 -7.894 10.420 1.00 0.00 C ATOM 0 H VAL A 35 -0.668 -5.815 8.010 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.286 -8.807 7.900 1.00 0.00 H new ATOM 0 HB VAL A 35 -2.601 -6.412 9.256 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.240 -8.044 10.140 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.303 -7.957 8.364 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.491 -9.327 9.160 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.086 -7.701 11.336 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.296 -8.957 10.353 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.601 -7.321 10.432 1.00 0.00 H new ATOM 136 N LEU A 36 -2.712 -8.482 5.835 1.00 0.00 N ATOM 137 CA LEU A 36 -3.428 -8.245 4.528 1.00 0.00 C ATOM 138 C LEU A 36 -4.723 -9.072 4.338 1.00 0.00 C ATOM 139 O LEU A 36 -4.731 -10.285 4.415 1.00 0.00 O ATOM 140 CB LEU A 36 -2.399 -8.619 3.444 1.00 0.00 C ATOM 141 CG LEU A 36 -2.339 -7.521 2.372 1.00 0.00 C ATOM 142 CD1 LEU A 36 -0.918 -7.430 1.814 1.00 0.00 C ATOM 143 CD2 LEU A 36 -3.311 -7.855 1.237 1.00 0.00 C ATOM 0 H LEU A 36 -2.510 -9.460 6.042 1.00 0.00 H new ATOM 0 HA LEU A 36 -3.767 -7.210 4.484 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.416 -8.752 3.895 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.671 -9.570 2.986 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.618 -6.566 2.818 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.875 -6.651 1.053 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.225 -7.188 2.620 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.639 -8.386 1.370 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.266 -7.074 0.478 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.035 -8.811 0.791 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.325 -7.918 1.633 1.00 0.00 H new ATOM 155 N ASN A 37 -5.813 -8.379 4.034 1.00 0.00 N ATOM 156 CA ASN A 37 -7.190 -8.975 3.743 1.00 0.00 C ATOM 157 C ASN A 37 -7.917 -9.518 4.984 1.00 0.00 C ATOM 158 O ASN A 37 -8.921 -10.183 4.838 1.00 0.00 O ATOM 159 CB ASN A 37 -6.956 -10.134 2.737 1.00 0.00 C ATOM 160 CG ASN A 37 -8.209 -10.393 1.897 1.00 0.00 C ATOM 161 OD1 ASN A 37 -8.080 -10.625 0.619 1.00 0.00 O flip ATOM 162 ND2 ASN A 37 -9.313 -10.384 2.399 1.00 0.00 N flip ATOM 0 H ASN A 37 -5.806 -7.361 3.971 1.00 0.00 H new ATOM 0 HA ASN A 37 -7.834 -8.186 3.354 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -6.119 -9.889 2.083 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -6.683 -11.040 3.278 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.418 -10.203 3.397 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -10.137 -10.557 1.823 1.00 0.00 H new ATOM 169 N GLY A 38 -7.492 -9.180 6.179 1.00 0.00 N ATOM 170 CA GLY A 38 -8.214 -9.658 7.408 1.00 0.00 C ATOM 171 C GLY A 38 -7.311 -10.620 8.184 1.00 0.00 C ATOM 172 O GLY A 38 -7.310 -10.637 9.402 1.00 0.00 O ATOM 0 H GLY A 38 -6.677 -8.594 6.359 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.486 -8.810 8.036 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.141 -10.158 7.128 1.00 0.00 H new ATOM 176 N LYS A 39 -6.522 -11.394 7.479 1.00 0.00 N ATOM 177 CA LYS A 39 -5.578 -12.338 8.151 1.00 0.00 C ATOM 178 C LYS A 39 -4.220 -11.656 8.169 1.00 0.00 C ATOM 179 O LYS A 39 -3.948 -10.847 7.290 1.00 0.00 O ATOM 180 CB LYS A 39 -5.550 -13.589 7.270 1.00 0.00 C ATOM 181 CG LYS A 39 -6.530 -14.626 7.826 1.00 0.00 C ATOM 182 CD LYS A 39 -6.583 -15.833 6.884 1.00 0.00 C ATOM 183 CE LYS A 39 -5.240 -16.574 6.911 1.00 0.00 C ATOM 184 NZ LYS A 39 -4.548 -16.169 5.656 1.00 0.00 N ATOM 0 H LYS A 39 -6.492 -11.411 6.460 1.00 0.00 H new ATOM 0 HA LYS A 39 -5.860 -12.602 9.170 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.819 -13.332 6.245 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -4.542 -14.004 7.241 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.217 -14.941 8.821 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.522 -14.187 7.928 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -7.386 -16.506 7.185 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.807 -15.504 5.869 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -4.656 -16.299 7.789 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -5.386 -17.653 6.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.534 -16.035 5.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.670 -16.911 4.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -4.955 -15.278 5.307 1.00 0.00 H new ATOM 198 N GLY A 40 -3.388 -11.917 9.163 1.00 0.00 N ATOM 199 CA GLY A 40 -2.084 -11.195 9.210 1.00 0.00 C ATOM 200 C GLY A 40 -1.007 -11.899 8.396 1.00 0.00 C ATOM 201 O GLY A 40 -0.407 -12.868 8.821 1.00 0.00 O ATOM 0 H GLY A 40 -3.557 -12.581 9.919 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.218 -10.181 8.832 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -1.756 -11.108 10.246 1.00 0.00 H new ATOM 205 N LEU A 41 -0.696 -11.325 7.261 1.00 0.00 N ATOM 206 CA LEU A 41 0.409 -11.826 6.423 1.00 0.00 C ATOM 207 C LEU A 41 1.332 -10.630 6.125 1.00 0.00 C ATOM 208 O LEU A 41 0.950 -9.721 5.405 1.00 0.00 O ATOM 209 CB LEU A 41 -0.285 -12.377 5.149 1.00 0.00 C ATOM 210 CG LEU A 41 0.706 -12.566 3.978 1.00 0.00 C ATOM 211 CD1 LEU A 41 1.842 -13.513 4.383 1.00 0.00 C ATOM 212 CD2 LEU A 41 -0.038 -13.140 2.768 1.00 0.00 C ATOM 0 H LEU A 41 -1.180 -10.512 6.881 1.00 0.00 H new ATOM 0 HA LEU A 41 1.020 -12.605 6.879 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.758 -13.331 5.379 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.078 -11.693 4.845 1.00 0.00 H new ATOM 0 HG LEU A 41 1.135 -11.598 3.720 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.530 -13.634 3.546 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.377 -13.095 5.236 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.427 -14.483 4.655 1.00 0.00 H new ATOM 0 HD21 LEU A 41 0.660 -13.274 1.942 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -0.475 -14.103 3.033 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -0.829 -12.453 2.467 1.00 0.00 H new ATOM 224 N GLY A 42 2.525 -10.647 6.634 1.00 0.00 N ATOM 225 CA GLY A 42 3.490 -9.553 6.365 1.00 0.00 C ATOM 226 C GLY A 42 4.287 -9.225 7.623 1.00 0.00 C ATOM 227 O GLY A 42 3.740 -8.778 8.610 1.00 0.00 O ATOM 0 H GLY A 42 2.880 -11.388 7.238 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.168 -9.847 5.564 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.957 -8.666 6.023 1.00 0.00 H new ATOM 231 N THR A 43 5.579 -9.416 7.578 1.00 0.00 N ATOM 232 CA THR A 43 6.449 -9.069 8.735 1.00 0.00 C ATOM 233 C THR A 43 7.755 -8.554 8.154 1.00 0.00 C ATOM 234 O THR A 43 8.480 -9.316 7.548 1.00 0.00 O ATOM 235 CB THR A 43 6.663 -10.379 9.497 1.00 0.00 C ATOM 236 OG1 THR A 43 5.400 -10.929 9.848 1.00 0.00 O ATOM 237 CG2 THR A 43 7.474 -10.108 10.765 1.00 0.00 C ATOM 0 H THR A 43 6.074 -9.804 6.775 1.00 0.00 H new ATOM 0 HA THR A 43 6.031 -8.314 9.401 1.00 0.00 H new ATOM 0 HB THR A 43 7.206 -11.083 8.867 1.00 0.00 H new ATOM 0 HG1 THR A 43 5.533 -11.769 10.335 1.00 0.00 H new ATOM 0 HG21 THR A 43 7.626 -11.042 11.307 1.00 0.00 H new ATOM 0 HG22 THR A 43 8.441 -9.684 10.495 1.00 0.00 H new ATOM 0 HG23 THR A 43 6.934 -9.405 11.399 1.00 0.00 H new ATOM 245 N GLY A 44 8.056 -7.278 8.302 1.00 0.00 N ATOM 246 CA GLY A 44 9.316 -6.747 7.699 1.00 0.00 C ATOM 247 C GLY A 44 9.414 -5.243 7.843 1.00 0.00 C ATOM 248 O GLY A 44 9.086 -4.669 8.870 1.00 0.00 O ATOM 0 H GLY A 44 7.490 -6.596 8.807 1.00 0.00 H new ATOM 0 HA2 GLY A 44 10.175 -7.215 8.179 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.356 -7.015 6.643 1.00 0.00 H new ATOM 252 N THR A 45 9.901 -4.613 6.813 1.00 0.00 N ATOM 253 CA THR A 45 10.079 -3.126 6.845 1.00 0.00 C ATOM 254 C THR A 45 9.268 -2.437 5.748 1.00 0.00 C ATOM 255 O THR A 45 9.115 -2.958 4.657 1.00 0.00 O ATOM 256 CB THR A 45 11.581 -2.891 6.645 1.00 0.00 C ATOM 257 OG1 THR A 45 12.022 -3.590 5.488 1.00 0.00 O ATOM 258 CG2 THR A 45 12.359 -3.382 7.873 1.00 0.00 C ATOM 0 H THR A 45 10.187 -5.062 5.943 1.00 0.00 H new ATOM 0 HA THR A 45 9.722 -2.706 7.785 1.00 0.00 H new ATOM 0 HB THR A 45 11.761 -1.824 6.516 1.00 0.00 H new ATOM 0 HG1 THR A 45 12.606 -3.009 4.958 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.425 -3.211 7.721 1.00 0.00 H new ATOM 0 HG22 THR A 45 12.026 -2.837 8.756 1.00 0.00 H new ATOM 0 HG23 THR A 45 12.180 -4.448 8.015 1.00 0.00 H new ATOM 266 N LEU A 46 8.762 -1.259 6.033 1.00 0.00 N ATOM 267 CA LEU A 46 7.971 -0.504 5.019 1.00 0.00 C ATOM 268 C LEU A 46 8.773 0.698 4.509 1.00 0.00 C ATOM 269 O LEU A 46 9.184 1.549 5.279 1.00 0.00 O ATOM 270 CB LEU A 46 6.718 -0.028 5.754 1.00 0.00 C ATOM 271 CG LEU A 46 5.751 0.608 4.753 1.00 0.00 C ATOM 272 CD1 LEU A 46 4.320 0.499 5.282 1.00 0.00 C ATOM 273 CD2 LEU A 46 6.113 2.080 4.552 1.00 0.00 C ATOM 0 H LEU A 46 8.866 -0.789 6.932 1.00 0.00 H new ATOM 0 HA LEU A 46 7.726 -1.120 4.154 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.238 -0.867 6.257 1.00 0.00 H new ATOM 0 HB3 LEU A 46 6.988 0.694 6.525 1.00 0.00 H new ATOM 0 HG LEU A 46 5.824 0.086 3.799 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.633 0.952 4.568 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.061 -0.551 5.418 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.245 1.018 6.238 1.00 0.00 H new ATOM 0 HD21 LEU A 46 5.423 2.530 3.839 1.00 0.00 H new ATOM 0 HD22 LEU A 46 6.044 2.605 5.505 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.131 2.155 4.169 1.00 0.00 H new ATOM 285 N TYR A 47 8.982 0.773 3.219 1.00 0.00 N ATOM 286 CA TYR A 47 9.743 1.923 2.630 1.00 0.00 C ATOM 287 C TYR A 47 8.790 2.778 1.793 1.00 0.00 C ATOM 288 O TYR A 47 7.982 2.253 1.048 1.00 0.00 O ATOM 289 CB TYR A 47 10.824 1.309 1.726 1.00 0.00 C ATOM 290 CG TYR A 47 11.692 0.343 2.505 1.00 0.00 C ATOM 291 CD1 TYR A 47 11.335 -1.009 2.577 1.00 0.00 C ATOM 292 CD2 TYR A 47 12.849 0.797 3.145 1.00 0.00 C ATOM 293 CE1 TYR A 47 12.137 -1.906 3.287 1.00 0.00 C ATOM 294 CE2 TYR A 47 13.653 -0.102 3.858 1.00 0.00 C ATOM 295 CZ TYR A 47 13.296 -1.453 3.930 1.00 0.00 C ATOM 296 OH TYR A 47 14.092 -2.340 4.629 1.00 0.00 O ATOM 0 H TYR A 47 8.657 0.083 2.542 1.00 0.00 H new ATOM 0 HA TYR A 47 10.186 2.553 3.401 1.00 0.00 H new ATOM 0 HB2 TYR A 47 10.354 0.790 0.891 1.00 0.00 H new ATOM 0 HB3 TYR A 47 11.443 2.100 1.302 1.00 0.00 H new ATOM 0 HD1 TYR A 47 10.440 -1.358 2.084 1.00 0.00 H new ATOM 0 HD2 TYR A 47 13.123 1.840 3.090 1.00 0.00 H new ATOM 0 HE1 TYR A 47 11.863 -2.949 3.340 1.00 0.00 H new ATOM 0 HE2 TYR A 47 14.548 0.248 4.352 1.00 0.00 H new ATOM 0 HH TYR A 47 14.856 -1.861 5.013 1.00 0.00 H new ATOM 306 N ILE A 48 8.879 4.081 1.913 1.00 0.00 N ATOM 307 CA ILE A 48 7.974 4.977 1.122 1.00 0.00 C ATOM 308 C ILE A 48 8.770 5.685 0.019 1.00 0.00 C ATOM 309 O ILE A 48 9.749 6.361 0.287 1.00 0.00 O ATOM 310 CB ILE A 48 7.416 5.988 2.135 1.00 0.00 C ATOM 311 CG1 ILE A 48 6.646 5.246 3.234 1.00 0.00 C ATOM 312 CG2 ILE A 48 6.461 6.959 1.431 1.00 0.00 C ATOM 313 CD1 ILE A 48 7.612 4.840 4.350 1.00 0.00 C ATOM 0 H ILE A 48 9.538 4.563 2.524 1.00 0.00 H new ATOM 0 HA ILE A 48 7.173 4.426 0.629 1.00 0.00 H new ATOM 0 HB ILE A 48 8.246 6.542 2.573 1.00 0.00 H new ATOM 0 HG12 ILE A 48 5.858 5.884 3.635 1.00 0.00 H new ATOM 0 HG13 ILE A 48 6.161 4.362 2.819 1.00 0.00 H new ATOM 0 HG21 ILE A 48 6.069 7.673 2.155 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.998 7.494 0.648 1.00 0.00 H new ATOM 0 HG23 ILE A 48 5.636 6.401 0.989 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.064 4.313 5.131 1.00 0.00 H new ATOM 0 HD12 ILE A 48 8.384 4.186 3.943 1.00 0.00 H new ATOM 0 HD13 ILE A 48 8.077 5.732 4.771 1.00 0.00 H new ATOM 325 N ALA A 49 8.347 5.534 -1.214 1.00 0.00 N ATOM 326 CA ALA A 49 9.057 6.196 -2.351 1.00 0.00 C ATOM 327 C ALA A 49 8.294 7.449 -2.782 1.00 0.00 C ATOM 328 O ALA A 49 7.082 7.508 -2.693 1.00 0.00 O ATOM 329 CB ALA A 49 9.075 5.159 -3.474 1.00 0.00 C ATOM 0 H ALA A 49 7.535 4.977 -1.481 1.00 0.00 H new ATOM 0 HA ALA A 49 10.065 6.512 -2.083 1.00 0.00 H new ATOM 0 HB1 ALA A 49 9.582 5.575 -4.345 1.00 0.00 H new ATOM 0 HB2 ALA A 49 9.604 4.267 -3.137 1.00 0.00 H new ATOM 0 HB3 ALA A 49 8.052 4.895 -3.742 1.00 0.00 H new ATOM 335 N GLU A 50 8.999 8.456 -3.241 1.00 0.00 N ATOM 336 CA GLU A 50 8.334 9.740 -3.674 1.00 0.00 C ATOM 337 C GLU A 50 7.171 9.483 -4.645 1.00 0.00 C ATOM 338 O GLU A 50 6.262 10.291 -4.752 1.00 0.00 O ATOM 339 CB GLU A 50 9.433 10.547 -4.369 1.00 0.00 C ATOM 340 CG GLU A 50 8.897 11.936 -4.724 1.00 0.00 C ATOM 341 CD GLU A 50 9.962 12.713 -5.501 1.00 0.00 C ATOM 342 OE1 GLU A 50 10.686 12.093 -6.260 1.00 0.00 O ATOM 343 OE2 GLU A 50 10.036 13.919 -5.321 1.00 0.00 O ATOM 0 H GLU A 50 10.014 8.449 -3.337 1.00 0.00 H new ATOM 0 HA GLU A 50 7.905 10.264 -2.820 1.00 0.00 H new ATOM 0 HB2 GLU A 50 10.302 10.636 -3.717 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.763 10.031 -5.271 1.00 0.00 H new ATOM 0 HG2 GLU A 50 7.990 11.845 -5.322 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.628 12.476 -3.816 1.00 0.00 H new ATOM 350 N SER A 51 7.196 8.373 -5.347 1.00 0.00 N ATOM 351 CA SER A 51 6.095 8.063 -6.314 1.00 0.00 C ATOM 352 C SER A 51 5.731 6.575 -6.268 1.00 0.00 C ATOM 353 O SER A 51 5.207 6.036 -7.227 1.00 0.00 O ATOM 354 CB SER A 51 6.660 8.430 -7.685 1.00 0.00 C ATOM 355 OG SER A 51 6.278 9.760 -8.008 1.00 0.00 O ATOM 0 H SER A 51 7.932 7.669 -5.291 1.00 0.00 H new ATOM 0 HA SER A 51 5.183 8.613 -6.081 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.746 8.342 -7.679 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.289 7.739 -8.441 1.00 0.00 H new ATOM 0 HG SER A 51 6.640 10.000 -8.886 1.00 0.00 H new ATOM 361 N ARG A 52 6.004 5.908 -5.165 1.00 0.00 N ATOM 362 CA ARG A 52 5.670 4.447 -5.056 1.00 0.00 C ATOM 363 C ARG A 52 5.873 3.960 -3.620 1.00 0.00 C ATOM 364 O ARG A 52 6.466 4.642 -2.805 1.00 0.00 O ATOM 365 CB ARG A 52 6.651 3.740 -6.000 1.00 0.00 C ATOM 366 CG ARG A 52 6.099 2.364 -6.381 1.00 0.00 C ATOM 367 CD ARG A 52 6.975 1.750 -7.476 1.00 0.00 C ATOM 368 NE ARG A 52 6.244 0.529 -7.922 1.00 0.00 N ATOM 369 CZ ARG A 52 6.877 -0.408 -8.573 1.00 0.00 C ATOM 370 NH1 ARG A 52 7.520 -0.118 -9.671 1.00 0.00 N ATOM 371 NH2 ARG A 52 6.868 -1.634 -8.126 1.00 0.00 N ATOM 0 H ARG A 52 6.443 6.312 -4.338 1.00 0.00 H new ATOM 0 HA ARG A 52 4.631 4.245 -5.318 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.806 4.341 -6.896 1.00 0.00 H new ATOM 0 HB3 ARG A 52 7.622 3.632 -5.517 1.00 0.00 H new ATOM 0 HG2 ARG A 52 6.080 1.713 -5.507 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.071 2.457 -6.732 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.119 2.447 -8.302 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.965 1.499 -7.094 1.00 0.00 H new ATOM 0 HE ARG A 52 5.250 0.426 -7.718 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.527 0.841 -10.020 1.00 0.00 H new ATOM 0 HH12 ARG A 52 8.015 -0.850 -10.181 1.00 0.00 H new ATOM 0 HH21 ARG A 52 6.366 -1.860 -7.267 1.00 0.00 H new ATOM 0 HH22 ARG A 52 7.363 -2.366 -8.635 1.00 0.00 H new ATOM 385 N LEU A 53 5.388 2.778 -3.313 1.00 0.00 N ATOM 386 CA LEU A 53 5.554 2.222 -1.935 1.00 0.00 C ATOM 387 C LEU A 53 6.325 0.902 -2.010 1.00 0.00 C ATOM 388 O LEU A 53 5.947 0.007 -2.745 1.00 0.00 O ATOM 389 CB LEU A 53 4.134 1.991 -1.420 1.00 0.00 C ATOM 390 CG LEU A 53 4.096 2.218 0.090 1.00 0.00 C ATOM 391 CD1 LEU A 53 2.653 2.460 0.536 1.00 0.00 C ATOM 392 CD2 LEU A 53 4.650 0.984 0.806 1.00 0.00 C ATOM 0 H LEU A 53 4.883 2.174 -3.962 1.00 0.00 H new ATOM 0 HA LEU A 53 6.111 2.889 -1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.441 2.669 -1.918 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.811 0.976 -1.654 1.00 0.00 H new ATOM 0 HG LEU A 53 4.704 3.088 0.340 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.628 2.622 1.614 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.258 3.339 0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.044 1.591 0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.623 1.146 1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.043 0.114 0.554 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.679 0.812 0.491 1.00 0.00 H new ATOM 404 N SER A 54 7.401 0.781 -1.264 1.00 0.00 N ATOM 405 CA SER A 54 8.208 -0.479 -1.301 1.00 0.00 C ATOM 406 C SER A 54 8.199 -1.167 0.064 1.00 0.00 C ATOM 407 O SER A 54 8.598 -0.598 1.056 1.00 0.00 O ATOM 408 CB SER A 54 9.623 -0.029 -1.661 1.00 0.00 C ATOM 409 OG SER A 54 9.651 0.377 -3.024 1.00 0.00 O ATOM 0 H SER A 54 7.753 1.501 -0.633 1.00 0.00 H new ATOM 0 HA SER A 54 7.809 -1.198 -2.016 1.00 0.00 H new ATOM 0 HB2 SER A 54 9.931 0.795 -1.017 1.00 0.00 H new ATOM 0 HB3 SER A 54 10.329 -0.843 -1.497 1.00 0.00 H new ATOM 0 HG SER A 54 10.556 0.668 -3.260 1.00 0.00 H new ATOM 415 N TRP A 55 7.743 -2.394 0.107 1.00 0.00 N ATOM 416 CA TRP A 55 7.695 -3.153 1.394 1.00 0.00 C ATOM 417 C TRP A 55 8.577 -4.399 1.317 1.00 0.00 C ATOM 418 O TRP A 55 8.471 -5.172 0.379 1.00 0.00 O ATOM 419 CB TRP A 55 6.234 -3.558 1.547 1.00 0.00 C ATOM 420 CG TRP A 55 5.848 -3.542 2.989 1.00 0.00 C ATOM 421 CD1 TRP A 55 5.247 -2.507 3.612 1.00 0.00 C ATOM 422 CD2 TRP A 55 6.015 -4.584 3.996 1.00 0.00 C ATOM 423 NE1 TRP A 55 5.025 -2.849 4.933 1.00 0.00 N ATOM 424 CE2 TRP A 55 5.480 -4.117 5.218 1.00 0.00 C ATOM 425 CE3 TRP A 55 6.569 -5.875 3.969 1.00 0.00 C ATOM 426 CZ2 TRP A 55 5.489 -4.900 6.371 1.00 0.00 C ATOM 427 CZ3 TRP A 55 6.581 -6.668 5.127 1.00 0.00 C ATOM 428 CH2 TRP A 55 6.040 -6.182 6.325 1.00 0.00 C ATOM 0 H TRP A 55 7.398 -2.907 -0.704 1.00 0.00 H new ATOM 0 HA TRP A 55 8.057 -2.560 2.234 1.00 0.00 H new ATOM 0 HB2 TRP A 55 5.598 -2.875 0.984 1.00 0.00 H new ATOM 0 HB3 TRP A 55 6.079 -4.554 1.131 1.00 0.00 H new ATOM 0 HD1 TRP A 55 4.983 -1.565 3.154 1.00 0.00 H new ATOM 0 HE1 TRP A 55 4.578 -2.236 5.615 1.00 0.00 H new ATOM 0 HE3 TRP A 55 6.988 -6.260 3.051 1.00 0.00 H new ATOM 0 HZ2 TRP A 55 5.073 -4.518 7.292 1.00 0.00 H new ATOM 0 HZ3 TRP A 55 7.010 -7.659 5.095 1.00 0.00 H new ATOM 0 HH2 TRP A 55 6.049 -6.799 7.212 1.00 0.00 H new ATOM 439 N LEU A 56 9.423 -4.615 2.300 1.00 0.00 N ATOM 440 CA LEU A 56 10.285 -5.834 2.283 1.00 0.00 C ATOM 441 C LEU A 56 9.636 -6.918 3.138 1.00 0.00 C ATOM 442 O LEU A 56 9.290 -6.693 4.296 1.00 0.00 O ATOM 443 CB LEU A 56 11.645 -5.387 2.849 1.00 0.00 C ATOM 444 CG LEU A 56 12.698 -6.537 2.910 1.00 0.00 C ATOM 445 CD1 LEU A 56 12.406 -7.445 4.095 1.00 0.00 C ATOM 446 CD2 LEU A 56 12.713 -7.387 1.624 1.00 0.00 C ATOM 0 H LEU A 56 9.550 -4.002 3.106 1.00 0.00 H new ATOM 0 HA LEU A 56 10.412 -6.255 1.285 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.038 -4.577 2.234 1.00 0.00 H new ATOM 0 HB3 LEU A 56 11.499 -4.985 3.851 1.00 0.00 H new ATOM 0 HG LEU A 56 13.676 -6.068 3.018 1.00 0.00 H new ATOM 0 HD11 LEU A 56 13.145 -8.245 4.131 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.453 -6.866 5.017 1.00 0.00 H new ATOM 0 HD13 LEU A 56 11.410 -7.875 3.987 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.462 -8.173 1.716 1.00 0.00 H new ATOM 0 HD22 LEU A 56 11.732 -7.837 1.474 1.00 0.00 H new ATOM 0 HD23 LEU A 56 12.956 -6.753 0.771 1.00 0.00 H new ATOM 458 N ASP A 57 9.479 -8.087 2.559 1.00 0.00 N ATOM 459 CA ASP A 57 8.847 -9.230 3.277 1.00 0.00 C ATOM 460 C ASP A 57 9.865 -9.975 4.146 1.00 0.00 C ATOM 461 O ASP A 57 10.963 -10.300 3.721 1.00 0.00 O ATOM 462 CB ASP A 57 8.307 -10.150 2.179 1.00 0.00 C ATOM 463 CG ASP A 57 7.232 -11.066 2.766 1.00 0.00 C ATOM 464 OD1 ASP A 57 7.400 -11.496 3.895 1.00 0.00 O ATOM 465 OD2 ASP A 57 6.259 -11.322 2.077 1.00 0.00 O ATOM 0 H ASP A 57 9.769 -8.295 1.603 1.00 0.00 H new ATOM 0 HA ASP A 57 8.062 -8.888 3.951 1.00 0.00 H new ATOM 0 HB2 ASP A 57 7.890 -9.557 1.365 1.00 0.00 H new ATOM 0 HB3 ASP A 57 9.117 -10.745 1.757 1.00 0.00 H new ATOM 470 N GLY A 58 9.470 -10.246 5.364 1.00 0.00 N ATOM 471 CA GLY A 58 10.334 -10.956 6.357 1.00 0.00 C ATOM 472 C GLY A 58 10.864 -12.302 5.839 1.00 0.00 C ATOM 473 O GLY A 58 11.794 -12.846 6.411 1.00 0.00 O ATOM 0 H GLY A 58 8.549 -9.995 5.724 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.177 -10.317 6.619 1.00 0.00 H new ATOM 0 HA3 GLY A 58 9.765 -11.124 7.271 1.00 0.00 H new ATOM 477 N SER A 59 10.296 -12.850 4.782 1.00 0.00 N ATOM 478 CA SER A 59 10.787 -14.166 4.255 1.00 0.00 C ATOM 479 C SER A 59 11.959 -13.980 3.274 1.00 0.00 C ATOM 480 O SER A 59 12.290 -14.889 2.534 1.00 0.00 O ATOM 481 CB SER A 59 9.584 -14.772 3.533 1.00 0.00 C ATOM 482 OG SER A 59 8.565 -15.064 4.483 1.00 0.00 O ATOM 0 H SER A 59 9.517 -12.442 4.266 1.00 0.00 H new ATOM 0 HA SER A 59 11.161 -14.802 5.057 1.00 0.00 H new ATOM 0 HB2 SER A 59 9.209 -14.078 2.781 1.00 0.00 H new ATOM 0 HB3 SER A 59 9.880 -15.681 3.008 1.00 0.00 H new ATOM 0 HG SER A 59 7.791 -15.451 4.024 1.00 0.00 H new ATOM 488 N GLY A 60 12.587 -12.817 3.259 1.00 0.00 N ATOM 489 CA GLY A 60 13.727 -12.583 2.329 1.00 0.00 C ATOM 490 C GLY A 60 13.216 -12.202 0.947 1.00 0.00 C ATOM 491 O GLY A 60 13.899 -12.396 -0.044 1.00 0.00 O ATOM 0 H GLY A 60 12.350 -12.025 3.856 1.00 0.00 H new ATOM 0 HA2 GLY A 60 14.365 -11.790 2.719 1.00 0.00 H new ATOM 0 HA3 GLY A 60 14.340 -13.482 2.262 1.00 0.00 H new ATOM 495 N LEU A 61 12.024 -11.666 0.876 1.00 0.00 N ATOM 496 CA LEU A 61 11.452 -11.269 -0.440 1.00 0.00 C ATOM 497 C LEU A 61 11.083 -9.794 -0.378 1.00 0.00 C ATOM 498 O LEU A 61 10.313 -9.387 0.472 1.00 0.00 O ATOM 499 CB LEU A 61 10.193 -12.139 -0.627 1.00 0.00 C ATOM 500 CG LEU A 61 10.548 -13.635 -0.509 1.00 0.00 C ATOM 501 CD1 LEU A 61 9.260 -14.469 -0.479 1.00 0.00 C ATOM 502 CD2 LEU A 61 11.423 -14.061 -1.698 1.00 0.00 C ATOM 0 H LEU A 61 11.421 -11.487 1.679 1.00 0.00 H new ATOM 0 HA LEU A 61 12.147 -11.411 -1.267 1.00 0.00 H new ATOM 0 HB2 LEU A 61 9.447 -11.876 0.123 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.748 -11.941 -1.602 1.00 0.00 H new ATOM 0 HG LEU A 61 11.103 -13.801 0.414 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.513 -15.526 -0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.654 -14.172 0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.697 -14.302 -1.397 1.00 0.00 H new ATOM 0 HD21 LEU A 61 11.670 -15.119 -1.608 1.00 0.00 H new ATOM 0 HD22 LEU A 61 10.880 -13.893 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 61 12.341 -13.474 -1.703 1.00 0.00 H new ATOM 514 N GLY A 62 11.625 -8.997 -1.262 1.00 0.00 N ATOM 515 CA GLY A 62 11.311 -7.540 -1.252 1.00 0.00 C ATOM 516 C GLY A 62 10.286 -7.260 -2.331 1.00 0.00 C ATOM 517 O GLY A 62 10.474 -7.664 -3.456 1.00 0.00 O ATOM 0 H GLY A 62 12.273 -9.295 -1.991 1.00 0.00 H new ATOM 0 HA2 GLY A 62 10.925 -7.243 -0.277 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.215 -6.957 -1.428 1.00 0.00 H new ATOM 521 N PHE A 63 9.215 -6.567 -2.004 1.00 0.00 N ATOM 522 CA PHE A 63 8.180 -6.259 -3.054 1.00 0.00 C ATOM 523 C PHE A 63 7.591 -4.868 -2.849 1.00 0.00 C ATOM 524 O PHE A 63 7.414 -4.415 -1.732 1.00 0.00 O ATOM 525 CB PHE A 63 7.118 -7.381 -2.979 1.00 0.00 C ATOM 526 CG PHE A 63 6.217 -7.281 -1.758 1.00 0.00 C ATOM 527 CD1 PHE A 63 6.745 -7.412 -0.469 1.00 0.00 C ATOM 528 CD2 PHE A 63 4.838 -7.107 -1.931 1.00 0.00 C ATOM 529 CE1 PHE A 63 5.898 -7.369 0.646 1.00 0.00 C ATOM 530 CE2 PHE A 63 3.990 -7.054 -0.817 1.00 0.00 C ATOM 531 CZ PHE A 63 4.518 -7.187 0.471 1.00 0.00 C ATOM 0 H PHE A 63 9.013 -6.206 -1.072 1.00 0.00 H new ATOM 0 HA PHE A 63 8.618 -6.239 -4.052 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.503 -7.349 -3.878 1.00 0.00 H new ATOM 0 HB3 PHE A 63 7.622 -8.348 -2.971 1.00 0.00 H new ATOM 0 HD1 PHE A 63 7.808 -7.547 -0.333 1.00 0.00 H new ATOM 0 HD2 PHE A 63 4.427 -7.013 -2.926 1.00 0.00 H new ATOM 0 HE1 PHE A 63 6.307 -7.476 1.640 1.00 0.00 H new ATOM 0 HE2 PHE A 63 2.928 -6.910 -0.953 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.864 -7.150 1.330 1.00 0.00 H new ATOM 541 N SER A 64 7.316 -4.176 -3.932 1.00 0.00 N ATOM 542 CA SER A 64 6.773 -2.795 -3.820 1.00 0.00 C ATOM 543 C SER A 64 5.447 -2.635 -4.557 1.00 0.00 C ATOM 544 O SER A 64 5.292 -3.048 -5.693 1.00 0.00 O ATOM 545 CB SER A 64 7.850 -1.906 -4.443 1.00 0.00 C ATOM 546 OG SER A 64 7.305 -0.624 -4.731 1.00 0.00 O ATOM 0 H SER A 64 7.446 -4.514 -4.886 1.00 0.00 H new ATOM 0 HA SER A 64 6.558 -2.535 -2.783 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.694 -1.808 -3.760 1.00 0.00 H new ATOM 0 HB3 SER A 64 8.230 -2.364 -5.356 1.00 0.00 H new ATOM 0 HG SER A 64 6.656 -0.381 -4.038 1.00 0.00 H new ATOM 552 N LEU A 65 4.502 -2.011 -3.905 1.00 0.00 N ATOM 553 CA LEU A 65 3.168 -1.770 -4.530 1.00 0.00 C ATOM 554 C LEU A 65 3.176 -0.409 -5.234 1.00 0.00 C ATOM 555 O LEU A 65 3.877 0.506 -4.828 1.00 0.00 O ATOM 556 CB LEU A 65 2.179 -1.777 -3.363 1.00 0.00 C ATOM 557 CG LEU A 65 2.194 -3.152 -2.689 1.00 0.00 C ATOM 558 CD1 LEU A 65 1.961 -2.990 -1.186 1.00 0.00 C ATOM 559 CD2 LEU A 65 1.088 -4.026 -3.286 1.00 0.00 C ATOM 0 H LEU A 65 4.599 -1.654 -2.955 1.00 0.00 H new ATOM 0 HA LEU A 65 2.907 -2.518 -5.278 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.445 -1.004 -2.642 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.176 -1.547 -3.721 1.00 0.00 H new ATOM 0 HG LEU A 65 3.162 -3.625 -2.856 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.972 -3.970 -0.708 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.750 -2.370 -0.760 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.995 -2.515 -1.017 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.099 -5.005 -2.806 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.121 -3.552 -3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 65 1.256 -4.145 -4.356 1.00 0.00 H new ATOM 571 N GLU A 66 2.411 -0.273 -6.293 1.00 0.00 N ATOM 572 CA GLU A 66 2.372 1.025 -7.051 1.00 0.00 C ATOM 573 C GLU A 66 1.997 2.193 -6.130 1.00 0.00 C ATOM 574 O GLU A 66 2.824 3.021 -5.798 1.00 0.00 O ATOM 575 CB GLU A 66 1.304 0.836 -8.132 1.00 0.00 C ATOM 576 CG GLU A 66 1.753 -0.252 -9.111 1.00 0.00 C ATOM 577 CD GLU A 66 0.727 -0.384 -10.237 1.00 0.00 C ATOM 578 OE1 GLU A 66 0.149 0.623 -10.613 1.00 0.00 O ATOM 579 OE2 GLU A 66 0.534 -1.495 -10.709 1.00 0.00 O ATOM 0 H GLU A 66 1.809 -1.006 -6.668 1.00 0.00 H new ATOM 0 HA GLU A 66 3.347 1.265 -7.475 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.354 0.559 -7.675 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.140 1.773 -8.664 1.00 0.00 H new ATOM 0 HG2 GLU A 66 2.731 -0.003 -9.524 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.860 -1.203 -8.589 1.00 0.00 H new ATOM 586 N TYR A 67 0.753 2.262 -5.707 1.00 0.00 N ATOM 587 CA TYR A 67 0.299 3.374 -4.792 1.00 0.00 C ATOM 588 C TYR A 67 -1.197 3.211 -4.455 1.00 0.00 C ATOM 589 O TYR A 67 -1.537 3.136 -3.292 1.00 0.00 O ATOM 590 CB TYR A 67 0.538 4.712 -5.535 1.00 0.00 C ATOM 591 CG TYR A 67 1.283 5.676 -4.637 1.00 0.00 C ATOM 592 CD1 TYR A 67 0.678 6.143 -3.462 1.00 0.00 C ATOM 593 CD2 TYR A 67 2.573 6.101 -4.974 1.00 0.00 C ATOM 594 CE1 TYR A 67 1.362 7.034 -2.628 1.00 0.00 C ATOM 595 CE2 TYR A 67 3.258 6.993 -4.139 1.00 0.00 C ATOM 596 CZ TYR A 67 2.652 7.459 -2.966 1.00 0.00 C ATOM 597 OH TYR A 67 3.327 8.338 -2.143 1.00 0.00 O ATOM 0 H TYR A 67 0.025 1.593 -5.956 1.00 0.00 H new ATOM 0 HA TYR A 67 0.856 3.351 -3.855 1.00 0.00 H new ATOM 0 HB2 TYR A 67 1.110 4.535 -6.446 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.416 5.146 -5.836 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.317 5.815 -3.200 1.00 0.00 H new ATOM 0 HD2 TYR A 67 3.041 5.741 -5.878 1.00 0.00 H new ATOM 0 HE1 TYR A 67 0.895 7.394 -1.723 1.00 0.00 H new ATOM 0 HE2 TYR A 67 4.253 7.321 -4.400 1.00 0.00 H new ATOM 0 HH TYR A 67 2.699 8.736 -1.504 1.00 0.00 H new ATOM 607 N PRO A 68 -2.058 3.170 -5.467 1.00 0.00 N ATOM 608 CA PRO A 68 -3.514 3.015 -5.197 1.00 0.00 C ATOM 609 C PRO A 68 -3.833 1.611 -4.661 1.00 0.00 C ATOM 610 O PRO A 68 -4.533 0.838 -5.291 1.00 0.00 O ATOM 611 CB PRO A 68 -4.165 3.239 -6.563 1.00 0.00 C ATOM 612 CG PRO A 68 -3.102 2.890 -7.552 1.00 0.00 C ATOM 613 CD PRO A 68 -1.789 3.266 -6.922 1.00 0.00 C ATOM 0 HA PRO A 68 -3.875 3.709 -4.438 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.046 2.609 -6.690 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -4.492 4.272 -6.681 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -3.128 1.826 -7.789 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -3.251 3.429 -8.488 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -0.990 2.590 -7.227 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -1.481 4.272 -7.207 1.00 0.00 H new ATOM 621 N THR A 69 -3.336 1.292 -3.491 1.00 0.00 N ATOM 622 CA THR A 69 -3.605 -0.046 -2.877 1.00 0.00 C ATOM 623 C THR A 69 -4.488 0.097 -1.630 1.00 0.00 C ATOM 624 O THR A 69 -5.159 -0.840 -1.228 1.00 0.00 O ATOM 625 CB THR A 69 -2.229 -0.600 -2.505 1.00 0.00 C ATOM 626 OG1 THR A 69 -1.365 -0.512 -3.631 1.00 0.00 O ATOM 627 CG2 THR A 69 -2.363 -2.061 -2.076 1.00 0.00 C ATOM 0 H THR A 69 -2.749 1.908 -2.929 1.00 0.00 H new ATOM 0 HA THR A 69 -4.138 -0.707 -3.560 1.00 0.00 H new ATOM 0 HB THR A 69 -1.814 -0.019 -1.681 1.00 0.00 H new ATOM 0 HG1 THR A 69 -0.524 -0.086 -3.365 1.00 0.00 H new ATOM 0 HG21 THR A 69 -1.381 -2.454 -1.811 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.025 -2.127 -1.213 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.778 -2.645 -2.898 1.00 0.00 H new ATOM 635 N ILE A 70 -4.494 1.258 -1.023 1.00 0.00 N ATOM 636 CA ILE A 70 -5.328 1.487 0.194 1.00 0.00 C ATOM 637 C ILE A 70 -6.580 2.293 -0.177 1.00 0.00 C ATOM 638 O ILE A 70 -6.542 3.138 -1.055 1.00 0.00 O ATOM 639 CB ILE A 70 -4.431 2.269 1.167 1.00 0.00 C ATOM 640 CG1 ILE A 70 -3.978 3.592 0.532 1.00 0.00 C ATOM 641 CG2 ILE A 70 -3.198 1.429 1.507 1.00 0.00 C ATOM 642 CD1 ILE A 70 -3.451 4.527 1.622 1.00 0.00 C ATOM 0 H ILE A 70 -3.949 2.066 -1.324 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.673 0.555 0.642 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.999 2.484 2.072 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.200 3.405 -0.209 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.811 4.060 0.008 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.560 1.982 2.197 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.511 0.494 1.972 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.643 1.212 0.595 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.129 5.466 1.172 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -4.242 4.724 2.346 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.606 4.058 2.126 1.00 0.00 H new ATOM 654 N SER A 71 -7.683 2.032 0.484 1.00 0.00 N ATOM 655 CA SER A 71 -8.947 2.776 0.177 1.00 0.00 C ATOM 656 C SER A 71 -9.463 3.454 1.452 1.00 0.00 C ATOM 657 O SER A 71 -9.252 4.638 1.652 1.00 0.00 O ATOM 658 CB SER A 71 -9.925 1.712 -0.336 1.00 0.00 C ATOM 659 OG SER A 71 -11.263 2.160 -0.153 1.00 0.00 O ATOM 0 H SER A 71 -7.763 1.335 1.224 1.00 0.00 H new ATOM 0 HA SER A 71 -8.809 3.565 -0.563 1.00 0.00 H new ATOM 0 HB2 SER A 71 -9.739 1.513 -1.391 1.00 0.00 H new ATOM 0 HB3 SER A 71 -9.769 0.774 0.197 1.00 0.00 H new ATOM 0 HG SER A 71 -11.884 1.478 -0.484 1.00 0.00 H new ATOM 665 N LEU A 72 -10.110 2.709 2.323 1.00 0.00 N ATOM 666 CA LEU A 72 -10.610 3.301 3.597 1.00 0.00 C ATOM 667 C LEU A 72 -9.548 3.064 4.664 1.00 0.00 C ATOM 668 O LEU A 72 -9.285 1.935 5.001 1.00 0.00 O ATOM 669 CB LEU A 72 -11.893 2.519 3.911 1.00 0.00 C ATOM 670 CG LEU A 72 -12.481 2.953 5.261 1.00 0.00 C ATOM 671 CD1 LEU A 72 -13.983 2.656 5.274 1.00 0.00 C ATOM 672 CD2 LEU A 72 -11.810 2.172 6.398 1.00 0.00 C ATOM 0 H LEU A 72 -10.310 1.716 2.201 1.00 0.00 H new ATOM 0 HA LEU A 72 -10.808 4.372 3.546 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -12.626 2.682 3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -11.677 1.451 3.930 1.00 0.00 H new ATOM 0 HG LEU A 72 -12.307 4.020 5.401 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -14.406 2.962 6.231 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.470 3.207 4.469 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.144 1.587 5.132 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -12.232 2.485 7.353 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -11.982 1.105 6.258 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -10.738 2.370 6.393 1.00 0.00 H new ATOM 684 N HIS A 73 -8.927 4.103 5.178 1.00 0.00 N ATOM 685 CA HIS A 73 -7.861 3.905 6.204 1.00 0.00 C ATOM 686 C HIS A 73 -8.355 4.281 7.605 1.00 0.00 C ATOM 687 O HIS A 73 -8.725 5.406 7.880 1.00 0.00 O ATOM 688 CB HIS A 73 -6.695 4.802 5.763 1.00 0.00 C ATOM 689 CG HIS A 73 -7.127 6.247 5.711 1.00 0.00 C ATOM 690 ND1 HIS A 73 -7.688 6.811 4.577 1.00 0.00 N ATOM 691 CD2 HIS A 73 -7.076 7.251 6.644 1.00 0.00 C ATOM 692 CE1 HIS A 73 -7.951 8.102 4.854 1.00 0.00 C ATOM 693 NE2 HIS A 73 -7.598 8.423 6.102 1.00 0.00 N ATOM 0 H HIS A 73 -9.115 5.074 4.929 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.560 2.860 6.269 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.861 4.691 6.456 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -6.338 4.488 4.782 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -6.690 7.148 7.647 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.393 8.794 4.153 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -7.691 9.330 6.559 1.00 0.00 H new ATOM 701 N ALA A 74 -8.344 3.318 8.484 1.00 0.00 N ATOM 702 CA ALA A 74 -8.789 3.534 9.887 1.00 0.00 C ATOM 703 C ALA A 74 -7.567 3.742 10.785 1.00 0.00 C ATOM 704 O ALA A 74 -6.701 2.885 10.876 1.00 0.00 O ATOM 705 CB ALA A 74 -9.511 2.234 10.269 1.00 0.00 C ATOM 0 H ALA A 74 -8.037 2.367 8.282 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.430 4.409 9.997 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.874 2.307 11.294 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.354 2.075 9.596 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.819 1.396 10.188 1.00 0.00 H new ATOM 711 N VAL A 75 -7.493 4.873 11.444 1.00 0.00 N ATOM 712 CA VAL A 75 -6.331 5.159 12.341 1.00 0.00 C ATOM 713 C VAL A 75 -6.821 5.495 13.754 1.00 0.00 C ATOM 714 O VAL A 75 -7.932 5.964 13.936 1.00 0.00 O ATOM 715 CB VAL A 75 -5.614 6.360 11.707 1.00 0.00 C ATOM 716 CG1 VAL A 75 -5.124 5.979 10.308 1.00 0.00 C ATOM 717 CG2 VAL A 75 -6.569 7.556 11.599 1.00 0.00 C ATOM 0 H VAL A 75 -8.192 5.614 11.398 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.665 4.302 12.437 1.00 0.00 H new ATOM 0 HB VAL A 75 -4.768 6.637 12.336 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -4.615 6.830 9.856 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.433 5.139 10.381 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.975 5.695 9.689 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.046 8.399 11.148 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.423 7.285 10.979 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -6.917 7.835 12.594 1.00 0.00 H new ATOM 727 N SER A 76 -5.996 5.259 14.746 1.00 0.00 N ATOM 728 CA SER A 76 -6.397 5.560 16.156 1.00 0.00 C ATOM 729 C SER A 76 -6.310 7.065 16.417 1.00 0.00 C ATOM 730 O SER A 76 -5.452 7.746 15.885 1.00 0.00 O ATOM 731 CB SER A 76 -5.396 4.805 17.033 1.00 0.00 C ATOM 732 OG SER A 76 -5.327 3.452 16.608 1.00 0.00 O ATOM 0 H SER A 76 -5.059 4.870 14.639 1.00 0.00 H new ATOM 0 HA SER A 76 -7.423 5.257 16.364 1.00 0.00 H new ATOM 0 HB2 SER A 76 -4.413 5.270 16.965 1.00 0.00 H new ATOM 0 HB3 SER A 76 -5.701 4.855 18.078 1.00 0.00 H new ATOM 0 HG SER A 76 -5.458 2.860 17.378 1.00 0.00 H new ATOM 738 N ARG A 77 -7.196 7.581 17.236 1.00 0.00 N ATOM 739 CA ARG A 77 -7.183 9.047 17.549 1.00 0.00 C ATOM 740 C ARG A 77 -7.306 9.275 19.061 1.00 0.00 C ATOM 741 O ARG A 77 -6.630 10.122 19.618 1.00 0.00 O ATOM 742 CB ARG A 77 -8.383 9.639 16.799 1.00 0.00 C ATOM 743 CG ARG A 77 -9.682 8.970 17.259 1.00 0.00 C ATOM 744 CD ARG A 77 -10.841 9.450 16.381 1.00 0.00 C ATOM 745 NE ARG A 77 -10.566 8.871 15.036 1.00 0.00 N ATOM 746 CZ ARG A 77 -11.268 7.857 14.608 1.00 0.00 C ATOM 747 NH1 ARG A 77 -11.322 6.758 15.308 1.00 0.00 N ATOM 748 NH2 ARG A 77 -11.911 7.942 13.475 1.00 0.00 N ATOM 0 H ARG A 77 -7.930 7.048 17.703 1.00 0.00 H new ATOM 0 HA ARG A 77 -6.251 9.521 17.241 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -8.437 10.713 16.976 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -8.254 9.499 15.726 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -9.588 7.886 17.195 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -9.878 9.212 18.304 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -11.800 9.108 16.770 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -10.883 10.538 16.342 1.00 0.00 H new ATOM 0 HE ARG A 77 -9.830 9.266 14.450 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -10.815 6.690 16.191 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -11.871 5.966 14.973 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -11.864 8.800 12.925 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -12.460 7.150 13.139 1.00 0.00 H new ATOM 762 N ASP A 78 -8.160 8.524 19.724 1.00 0.00 N ATOM 763 CA ASP A 78 -8.327 8.686 21.200 1.00 0.00 C ATOM 764 C ASP A 78 -7.453 7.671 21.941 1.00 0.00 C ATOM 765 O ASP A 78 -7.657 6.475 21.832 1.00 0.00 O ATOM 766 CB ASP A 78 -9.809 8.414 21.464 1.00 0.00 C ATOM 767 CG ASP A 78 -10.126 8.689 22.934 1.00 0.00 C ATOM 768 OD1 ASP A 78 -10.013 7.769 23.727 1.00 0.00 O ATOM 769 OD2 ASP A 78 -10.475 9.817 23.242 1.00 0.00 O ATOM 0 H ASP A 78 -8.748 7.806 19.301 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.029 9.676 21.545 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -10.425 9.046 20.824 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -10.049 7.380 21.217 1.00 0.00 H new ATOM 774 N LEU A 79 -6.485 8.144 22.687 1.00 0.00 N ATOM 775 CA LEU A 79 -5.581 7.224 23.444 1.00 0.00 C ATOM 776 C LEU A 79 -4.724 8.025 24.429 1.00 0.00 C ATOM 777 O LEU A 79 -3.706 8.581 24.055 1.00 0.00 O ATOM 778 CB LEU A 79 -4.689 6.561 22.376 1.00 0.00 C ATOM 779 CG LEU A 79 -5.109 5.097 22.163 1.00 0.00 C ATOM 780 CD1 LEU A 79 -4.995 4.740 20.676 1.00 0.00 C ATOM 781 CD2 LEU A 79 -4.189 4.171 22.971 1.00 0.00 C ATOM 0 H LEU A 79 -6.281 9.136 22.805 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.137 6.487 24.023 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.766 7.109 21.437 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.645 6.605 22.686 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.140 4.971 22.495 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -5.293 3.702 20.527 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.647 5.392 20.094 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.964 4.872 20.348 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.490 3.135 22.817 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.159 4.303 22.640 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.264 4.417 24.030 1.00 0.00 H new ATOM 793 N ASN A 80 -5.110 8.062 25.686 1.00 0.00 N ATOM 794 CA ASN A 80 -4.296 8.802 26.708 1.00 0.00 C ATOM 795 C ASN A 80 -2.970 8.069 26.855 1.00 0.00 C ATOM 796 O ASN A 80 -1.906 8.619 26.627 1.00 0.00 O ATOM 797 CB ASN A 80 -5.103 8.733 28.004 1.00 0.00 C ATOM 798 CG ASN A 80 -4.602 9.799 28.978 1.00 0.00 C ATOM 799 OD1 ASN A 80 -3.918 9.490 29.935 1.00 0.00 O ATOM 800 ND2 ASN A 80 -4.913 11.051 28.777 1.00 0.00 N ATOM 0 H ASN A 80 -5.951 7.613 26.047 1.00 0.00 H new ATOM 0 HA ASN A 80 -4.094 9.839 26.440 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -6.161 8.887 27.794 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -5.007 7.744 28.451 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -4.582 11.769 29.422 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -5.487 11.312 27.975 1.00 0.00 H new ATOM 807 N ALA A 81 -3.048 6.805 27.173 1.00 0.00 N ATOM 808 CA ALA A 81 -1.830 5.965 27.275 1.00 0.00 C ATOM 809 C ALA A 81 -1.851 5.012 26.089 1.00 0.00 C ATOM 810 O ALA A 81 -2.802 4.278 25.902 1.00 0.00 O ATOM 811 CB ALA A 81 -1.953 5.199 28.588 1.00 0.00 C ATOM 0 H ALA A 81 -3.921 6.315 27.369 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.901 6.535 27.262 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -1.080 4.560 28.719 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.014 5.905 29.417 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -2.853 4.585 28.568 1.00 0.00 H new ATOM 817 N TYR A 82 -0.835 5.052 25.271 1.00 0.00 N ATOM 818 CA TYR A 82 -0.798 4.183 24.057 1.00 0.00 C ATOM 819 C TYR A 82 -0.207 2.797 24.379 1.00 0.00 C ATOM 820 O TYR A 82 0.980 2.692 24.622 1.00 0.00 O ATOM 821 CB TYR A 82 0.116 4.928 23.080 1.00 0.00 C ATOM 822 CG TYR A 82 -0.714 5.734 22.103 1.00 0.00 C ATOM 823 CD1 TYR A 82 -1.135 5.157 20.899 1.00 0.00 C ATOM 824 CD2 TYR A 82 -1.063 7.055 22.407 1.00 0.00 C ATOM 825 CE1 TYR A 82 -1.903 5.904 19.997 1.00 0.00 C ATOM 826 CE2 TYR A 82 -1.832 7.800 21.506 1.00 0.00 C ATOM 827 CZ TYR A 82 -2.253 7.225 20.301 1.00 0.00 C ATOM 828 OH TYR A 82 -3.010 7.960 19.412 1.00 0.00 O ATOM 0 H TYR A 82 -0.021 5.655 25.392 1.00 0.00 H new ATOM 0 HA TYR A 82 -1.796 4.007 23.656 1.00 0.00 H new ATOM 0 HB2 TYR A 82 0.788 5.588 23.629 1.00 0.00 H new ATOM 0 HB3 TYR A 82 0.740 4.217 22.539 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -0.868 4.137 20.666 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -0.739 7.499 23.337 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -2.225 5.461 19.066 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -2.101 8.819 21.740 1.00 0.00 H new ATOM 0 HH TYR A 82 -3.164 8.856 19.777 1.00 0.00 H new ATOM 838 N PRO A 83 -1.037 1.758 24.351 1.00 0.00 N ATOM 839 CA PRO A 83 -0.522 0.398 24.625 1.00 0.00 C ATOM 840 C PRO A 83 0.150 -0.131 23.359 1.00 0.00 C ATOM 841 O PRO A 83 1.263 -0.623 23.391 1.00 0.00 O ATOM 842 CB PRO A 83 -1.773 -0.411 24.951 1.00 0.00 C ATOM 843 CG PRO A 83 -2.897 0.297 24.263 1.00 0.00 C ATOM 844 CD PRO A 83 -2.490 1.738 24.074 1.00 0.00 C ATOM 0 HA PRO A 83 0.211 0.355 25.430 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -1.680 -1.437 24.596 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -1.940 -0.459 26.027 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -3.109 -0.169 23.301 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -3.809 0.233 24.857 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -2.705 2.080 23.062 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -3.032 2.395 24.754 1.00 0.00 H new ATOM 852 N ARG A 84 -0.527 -0.011 22.243 1.00 0.00 N ATOM 853 CA ARG A 84 0.044 -0.478 20.948 1.00 0.00 C ATOM 854 C ARG A 84 -0.566 0.312 19.787 1.00 0.00 C ATOM 855 O ARG A 84 -1.767 0.508 19.721 1.00 0.00 O ATOM 856 CB ARG A 84 -0.348 -1.953 20.856 1.00 0.00 C ATOM 857 CG ARG A 84 0.756 -2.733 20.138 1.00 0.00 C ATOM 858 CD ARG A 84 1.880 -3.069 21.125 1.00 0.00 C ATOM 859 NE ARG A 84 1.669 -4.501 21.475 1.00 0.00 N ATOM 860 CZ ARG A 84 2.026 -5.437 20.640 1.00 0.00 C ATOM 861 NH1 ARG A 84 3.267 -5.841 20.606 1.00 0.00 N ATOM 862 NH2 ARG A 84 1.145 -5.968 19.838 1.00 0.00 N ATOM 0 H ARG A 84 -1.460 0.395 22.177 1.00 0.00 H new ATOM 0 HA ARG A 84 1.124 -0.337 20.896 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.505 -2.361 21.854 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.290 -2.057 20.317 1.00 0.00 H new ATOM 0 HG2 ARG A 84 0.348 -3.649 19.711 1.00 0.00 H new ATOM 0 HG3 ARG A 84 1.151 -2.144 19.310 1.00 0.00 H new ATOM 0 HD2 ARG A 84 2.860 -2.913 20.675 1.00 0.00 H new ATOM 0 HD3 ARG A 84 1.831 -2.435 22.010 1.00 0.00 H new ATOM 0 HE ARG A 84 1.245 -4.750 22.369 1.00 0.00 H new ATOM 0 HH11 ARG A 84 3.956 -5.425 21.232 1.00 0.00 H new ATOM 0 HH12 ARG A 84 3.547 -6.573 19.953 1.00 0.00 H new ATOM 0 HH21 ARG A 84 0.176 -5.651 19.864 1.00 0.00 H new ATOM 0 HH22 ARG A 84 1.425 -6.700 19.185 1.00 0.00 H new ATOM 876 N GLU A 85 0.257 0.753 18.872 1.00 0.00 N ATOM 877 CA GLU A 85 -0.242 1.525 17.693 1.00 0.00 C ATOM 878 C GLU A 85 -0.583 0.551 16.565 1.00 0.00 C ATOM 879 O GLU A 85 -0.092 -0.564 16.544 1.00 0.00 O ATOM 880 CB GLU A 85 0.922 2.435 17.300 1.00 0.00 C ATOM 881 CG GLU A 85 1.232 3.394 18.453 1.00 0.00 C ATOM 882 CD GLU A 85 0.487 4.712 18.237 1.00 0.00 C ATOM 883 OE1 GLU A 85 -0.618 4.669 17.725 1.00 0.00 O ATOM 884 OE2 GLU A 85 1.034 5.744 18.591 1.00 0.00 O ATOM 0 H GLU A 85 1.267 0.610 18.891 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.142 2.101 17.906 1.00 0.00 H new ATOM 0 HB2 GLU A 85 1.802 1.836 17.064 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.670 2.999 16.402 1.00 0.00 H new ATOM 0 HG2 GLU A 85 0.934 2.947 19.401 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.305 3.576 18.510 1.00 0.00 H new ATOM 891 N HIS A 86 -1.435 0.950 15.638 1.00 0.00 N ATOM 892 CA HIS A 86 -1.823 0.017 14.522 1.00 0.00 C ATOM 893 C HIS A 86 -2.612 0.743 13.420 1.00 0.00 C ATOM 894 O HIS A 86 -3.574 1.436 13.705 1.00 0.00 O ATOM 895 CB HIS A 86 -2.717 -1.048 15.203 1.00 0.00 C ATOM 896 CG HIS A 86 -3.913 -0.400 15.863 1.00 0.00 C ATOM 897 ND1 HIS A 86 -5.072 -0.102 15.162 1.00 0.00 N ATOM 898 CD2 HIS A 86 -4.139 0.010 17.154 1.00 0.00 C ATOM 899 CE1 HIS A 86 -5.936 0.459 16.029 1.00 0.00 C ATOM 900 NE2 HIS A 86 -5.417 0.551 17.256 1.00 0.00 N ATOM 0 H HIS A 86 -1.873 1.871 15.607 1.00 0.00 H new ATOM 0 HA HIS A 86 -0.946 -0.408 14.033 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -3.053 -1.775 14.463 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -2.137 -1.595 15.947 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -3.432 -0.075 17.966 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -6.928 0.794 15.764 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -5.862 0.935 18.089 1.00 0.00 H new ATOM 908 N LEU A 87 -2.233 0.566 12.157 1.00 0.00 N ATOM 909 CA LEU A 87 -2.983 1.220 11.055 1.00 0.00 C ATOM 910 C LEU A 87 -3.760 0.192 10.233 1.00 0.00 C ATOM 911 O LEU A 87 -3.192 -0.705 9.647 1.00 0.00 O ATOM 912 CB LEU A 87 -1.945 1.950 10.202 1.00 0.00 C ATOM 913 CG LEU A 87 -2.531 3.278 9.716 1.00 0.00 C ATOM 914 CD1 LEU A 87 -1.404 4.183 9.218 1.00 0.00 C ATOM 915 CD2 LEU A 87 -3.513 3.012 8.573 1.00 0.00 C ATOM 0 H LEU A 87 -1.439 -0.003 11.863 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.725 1.918 11.443 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.041 2.130 10.784 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.658 1.333 9.351 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.052 3.768 10.539 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.822 5.128 8.872 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.703 4.372 10.031 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.882 3.695 8.395 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.931 3.957 8.226 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -2.991 2.522 7.751 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.317 2.367 8.927 1.00 0.00 H new ATOM 927 N TYR A 88 -5.065 0.327 10.204 1.00 0.00 N ATOM 928 CA TYR A 88 -5.919 -0.633 9.438 1.00 0.00 C ATOM 929 C TYR A 88 -6.547 0.038 8.231 1.00 0.00 C ATOM 930 O TYR A 88 -7.313 0.956 8.431 1.00 0.00 O ATOM 931 CB TYR A 88 -7.052 -0.952 10.417 1.00 0.00 C ATOM 932 CG TYR A 88 -7.804 -2.196 10.002 1.00 0.00 C ATOM 933 CD1 TYR A 88 -7.378 -3.420 10.481 1.00 0.00 C ATOM 934 CD2 TYR A 88 -8.929 -2.128 9.160 1.00 0.00 C ATOM 935 CE1 TYR A 88 -8.054 -4.585 10.143 1.00 0.00 C ATOM 936 CE2 TYR A 88 -9.611 -3.300 8.812 1.00 0.00 C ATOM 937 CZ TYR A 88 -9.173 -4.532 9.307 1.00 0.00 C ATOM 938 OH TYR A 88 -9.846 -5.692 8.984 1.00 0.00 O ATOM 0 H TYR A 88 -5.578 1.068 10.683 1.00 0.00 H new ATOM 0 HA TYR A 88 -5.347 -1.492 9.089 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -6.643 -1.089 11.418 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -7.740 -0.108 10.467 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -6.512 -3.471 11.124 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -9.266 -1.174 8.783 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.714 -5.535 10.527 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -10.473 -3.253 8.163 1.00 0.00 H new ATOM 0 HH TYR A 88 -10.793 -5.490 8.833 1.00 0.00 H new ATOM 948 N VAL A 89 -6.315 -0.421 6.994 1.00 0.00 N ATOM 949 CA VAL A 89 -7.032 0.243 5.841 1.00 0.00 C ATOM 950 C VAL A 89 -7.785 -0.802 4.983 1.00 0.00 C ATOM 951 O VAL A 89 -7.232 -1.761 4.483 1.00 0.00 O ATOM 952 CB VAL A 89 -6.007 1.115 5.061 1.00 0.00 C ATOM 953 CG1 VAL A 89 -5.215 1.997 6.052 1.00 0.00 C ATOM 954 CG2 VAL A 89 -4.987 0.282 4.304 1.00 0.00 C ATOM 0 H VAL A 89 -5.690 -1.189 6.751 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.815 0.913 6.196 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.585 1.707 4.352 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.498 2.607 5.503 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.904 2.646 6.593 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -4.684 1.361 6.760 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.297 0.942 3.778 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.431 -0.339 5.006 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.500 -0.355 3.584 1.00 0.00 H new ATOM 964 N MET A 90 -9.077 -0.630 4.862 1.00 0.00 N ATOM 965 CA MET A 90 -9.920 -1.616 4.107 1.00 0.00 C ATOM 966 C MET A 90 -9.914 -1.340 2.605 1.00 0.00 C ATOM 967 O MET A 90 -10.086 -0.219 2.170 1.00 0.00 O ATOM 968 CB MET A 90 -11.318 -1.445 4.689 1.00 0.00 C ATOM 969 CG MET A 90 -11.299 -1.866 6.162 1.00 0.00 C ATOM 970 SD MET A 90 -12.581 -0.961 7.065 1.00 0.00 S ATOM 971 CE MET A 90 -12.620 -2.020 8.530 1.00 0.00 C ATOM 0 H MET A 90 -9.591 0.157 5.256 1.00 0.00 H new ATOM 0 HA MET A 90 -9.543 -2.633 4.213 1.00 0.00 H new ATOM 0 HB2 MET A 90 -11.640 -0.408 4.598 1.00 0.00 H new ATOM 0 HB3 MET A 90 -12.034 -2.051 4.133 1.00 0.00 H new ATOM 0 HG2 MET A 90 -11.469 -2.939 6.247 1.00 0.00 H new ATOM 0 HG3 MET A 90 -10.320 -1.663 6.597 1.00 0.00 H new ATOM 0 HE1 MET A 90 -13.576 -1.900 9.040 1.00 0.00 H new ATOM 0 HE2 MET A 90 -12.497 -3.061 8.230 1.00 0.00 H new ATOM 0 HE3 MET A 90 -11.811 -1.738 9.204 1.00 0.00 H new ATOM 981 N VAL A 91 -9.716 -2.373 1.816 1.00 0.00 N ATOM 982 CA VAL A 91 -9.695 -2.208 0.331 1.00 0.00 C ATOM 983 C VAL A 91 -10.666 -3.204 -0.319 1.00 0.00 C ATOM 984 O VAL A 91 -10.795 -4.339 0.119 1.00 0.00 O ATOM 985 CB VAL A 91 -8.246 -2.502 -0.091 1.00 0.00 C ATOM 986 CG1 VAL A 91 -8.105 -2.346 -1.608 1.00 0.00 C ATOM 987 CG2 VAL A 91 -7.296 -1.518 0.601 1.00 0.00 C ATOM 0 H VAL A 91 -9.568 -3.328 2.143 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.006 -1.210 0.020 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.994 -3.522 0.198 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.076 -2.555 -1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.775 -3.045 -2.109 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.363 -1.327 -1.895 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -6.270 -1.730 0.299 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -7.556 -0.499 0.314 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -7.386 -1.625 1.682 1.00 0.00 H new ATOM 997 N ASN A 92 -11.343 -2.783 -1.361 1.00 0.00 N ATOM 998 CA ASN A 92 -12.310 -3.685 -2.057 1.00 0.00 C ATOM 999 C ASN A 92 -11.590 -4.475 -3.152 1.00 0.00 C ATOM 1000 O ASN A 92 -10.670 -3.981 -3.780 1.00 0.00 O ATOM 1001 CB ASN A 92 -13.360 -2.752 -2.670 1.00 0.00 C ATOM 1002 CG ASN A 92 -14.057 -1.948 -1.565 1.00 0.00 C ATOM 1003 OD1 ASN A 92 -13.995 -2.300 -0.401 1.00 0.00 O ATOM 1004 ND2 ASN A 92 -14.725 -0.874 -1.883 1.00 0.00 N ATOM 0 H ASN A 92 -11.265 -1.848 -1.760 1.00 0.00 H new ATOM 0 HA ASN A 92 -12.761 -4.410 -1.380 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -12.886 -2.074 -3.380 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -14.095 -3.334 -3.226 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -15.194 -0.331 -1.158 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -14.779 -0.577 -2.857 1.00 0.00 H new ATOM 1011 N ALA A 93 -12.005 -5.699 -3.382 1.00 0.00 N ATOM 1012 CA ALA A 93 -11.356 -6.539 -4.435 1.00 0.00 C ATOM 1013 C ALA A 93 -12.176 -6.498 -5.725 1.00 0.00 C ATOM 1014 O ALA A 93 -13.380 -6.687 -5.709 1.00 0.00 O ATOM 1015 CB ALA A 93 -11.335 -7.954 -3.861 1.00 0.00 C ATOM 0 H ALA A 93 -12.769 -6.153 -2.882 1.00 0.00 H new ATOM 0 HA ALA A 93 -10.355 -6.185 -4.682 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -10.872 -8.631 -4.579 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -10.763 -7.962 -2.933 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -12.355 -8.281 -3.661 1.00 0.00 H new ATOM 1021 N LYS A 94 -11.525 -6.251 -6.834 1.00 0.00 N ATOM 1022 CA LYS A 94 -12.244 -6.195 -8.143 1.00 0.00 C ATOM 1023 C LYS A 94 -11.723 -7.284 -9.082 1.00 0.00 C ATOM 1024 O LYS A 94 -10.526 -7.463 -9.233 1.00 0.00 O ATOM 1025 CB LYS A 94 -11.938 -4.806 -8.700 1.00 0.00 C ATOM 1026 CG LYS A 94 -12.935 -3.799 -8.124 1.00 0.00 C ATOM 1027 CD LYS A 94 -12.733 -2.437 -8.788 1.00 0.00 C ATOM 1028 CE LYS A 94 -13.877 -1.505 -8.390 1.00 0.00 C ATOM 1029 NZ LYS A 94 -14.062 -0.600 -9.560 1.00 0.00 N ATOM 0 H LYS A 94 -10.520 -6.085 -6.889 1.00 0.00 H new ATOM 0 HA LYS A 94 -13.316 -6.363 -8.035 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.920 -4.515 -8.443 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -12.001 -4.816 -9.788 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.955 -4.147 -8.289 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.798 -3.713 -7.046 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -11.778 -2.009 -8.483 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -12.701 -2.549 -9.872 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -14.787 -2.066 -8.177 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -13.632 -0.941 -7.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -14.832 0.070 -9.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -13.182 -0.074 -9.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -14.301 -1.164 -10.401 1.00 0.00 H new ATOM 1043 N PHE A 95 -12.616 -8.007 -9.712 1.00 0.00 N ATOM 1044 CA PHE A 95 -12.195 -9.094 -10.649 1.00 0.00 C ATOM 1045 C PHE A 95 -12.641 -8.765 -12.076 1.00 0.00 C ATOM 1046 O PHE A 95 -13.669 -8.146 -12.284 1.00 0.00 O ATOM 1047 CB PHE A 95 -12.903 -10.354 -10.144 1.00 0.00 C ATOM 1048 CG PHE A 95 -11.984 -11.119 -9.222 1.00 0.00 C ATOM 1049 CD1 PHE A 95 -11.451 -10.495 -8.087 1.00 0.00 C ATOM 1050 CD2 PHE A 95 -11.663 -12.453 -9.502 1.00 0.00 C ATOM 1051 CE1 PHE A 95 -10.599 -11.205 -7.233 1.00 0.00 C ATOM 1052 CE2 PHE A 95 -10.810 -13.163 -8.647 1.00 0.00 C ATOM 1053 CZ PHE A 95 -10.280 -12.539 -7.513 1.00 0.00 C ATOM 0 H PHE A 95 -13.625 -7.890 -9.617 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.112 -9.218 -10.674 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -13.818 -10.082 -9.618 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -13.194 -10.982 -10.986 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -11.697 -9.466 -7.871 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -12.073 -12.935 -10.377 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -10.188 -10.724 -6.358 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -10.562 -14.192 -8.863 1.00 0.00 H new ATOM 0 HZ PHE A 95 -9.624 -13.087 -6.853 1.00 0.00 H new ATOM 1063 N GLY A 96 -11.872 -9.181 -13.054 1.00 0.00 N ATOM 1064 CA GLY A 96 -12.230 -8.904 -14.477 1.00 0.00 C ATOM 1065 C GLY A 96 -12.955 -10.118 -15.064 1.00 0.00 C ATOM 1066 O GLY A 96 -14.163 -10.130 -15.190 1.00 0.00 O ATOM 0 H GLY A 96 -11.006 -9.704 -12.924 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -12.867 -8.022 -14.538 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -11.331 -8.689 -15.055 1.00 0.00 H new ATOM 1070 N GLU A 97 -12.217 -11.146 -15.427 1.00 0.00 N ATOM 1071 CA GLU A 97 -12.839 -12.386 -16.014 1.00 0.00 C ATOM 1072 C GLU A 97 -13.753 -12.043 -17.199 1.00 0.00 C ATOM 1073 O GLU A 97 -13.917 -10.888 -17.550 1.00 0.00 O ATOM 1074 CB GLU A 97 -13.650 -13.018 -14.877 1.00 0.00 C ATOM 1075 CG GLU A 97 -12.707 -13.433 -13.744 1.00 0.00 C ATOM 1076 CD GLU A 97 -13.497 -14.153 -12.646 1.00 0.00 C ATOM 1077 OE1 GLU A 97 -14.657 -13.825 -12.459 1.00 0.00 O ATOM 1078 OE2 GLU A 97 -12.925 -15.025 -12.012 1.00 0.00 O ATOM 0 H GLU A 97 -11.201 -11.180 -15.341 1.00 0.00 H new ATOM 0 HA GLU A 97 -12.078 -13.065 -16.399 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -14.390 -12.309 -14.507 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -14.197 -13.886 -15.245 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -11.926 -14.087 -14.131 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -12.212 -12.554 -13.331 1.00 0.00 H new ATOM 1085 N GLU A 98 -14.342 -13.043 -17.810 1.00 0.00 N ATOM 1086 CA GLU A 98 -15.250 -12.797 -18.975 1.00 0.00 C ATOM 1087 C GLU A 98 -16.461 -13.733 -18.907 1.00 0.00 C ATOM 1088 O GLU A 98 -16.926 -14.230 -19.916 1.00 0.00 O ATOM 1089 CB GLU A 98 -14.401 -13.106 -20.209 1.00 0.00 C ATOM 1090 CG GLU A 98 -13.215 -12.141 -20.268 1.00 0.00 C ATOM 1091 CD GLU A 98 -12.426 -12.374 -21.557 1.00 0.00 C ATOM 1092 OE1 GLU A 98 -13.039 -12.707 -22.557 1.00 0.00 O ATOM 1093 OE2 GLU A 98 -11.215 -12.215 -21.523 1.00 0.00 O ATOM 0 H GLU A 98 -14.232 -14.023 -17.551 1.00 0.00 H new ATOM 0 HA GLU A 98 -15.637 -11.778 -18.991 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -14.044 -14.135 -20.170 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -15.005 -13.012 -21.112 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -13.569 -11.111 -20.228 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -12.569 -12.290 -19.403 1.00 0.00 H new ATOM 1100 N SER A 99 -16.969 -13.971 -17.720 1.00 0.00 N ATOM 1101 CA SER A 99 -18.151 -14.874 -17.565 1.00 0.00 C ATOM 1102 C SER A 99 -19.386 -14.070 -17.144 1.00 0.00 C ATOM 1103 O SER A 99 -20.278 -14.587 -16.492 1.00 0.00 O ATOM 1104 CB SER A 99 -17.756 -15.860 -16.467 1.00 0.00 C ATOM 1105 OG SER A 99 -18.361 -17.120 -16.725 1.00 0.00 O ATOM 0 H SER A 99 -16.613 -13.576 -16.850 1.00 0.00 H new ATOM 0 HA SER A 99 -18.406 -15.380 -18.496 1.00 0.00 H new ATOM 0 HB2 SER A 99 -16.672 -15.965 -16.430 1.00 0.00 H new ATOM 0 HB3 SER A 99 -18.073 -15.484 -15.494 1.00 0.00 H new ATOM 0 HG SER A 99 -18.108 -17.755 -16.022 1.00 0.00 H new ATOM 1111 N LYS A 100 -19.441 -12.811 -17.516 1.00 0.00 N ATOM 1112 CA LYS A 100 -20.611 -11.955 -17.146 1.00 0.00 C ATOM 1113 C LYS A 100 -21.143 -11.230 -18.385 1.00 0.00 C ATOM 1114 O LYS A 100 -20.762 -10.107 -18.665 1.00 0.00 O ATOM 1115 CB LYS A 100 -20.062 -10.953 -16.129 1.00 0.00 C ATOM 1116 CG LYS A 100 -21.195 -10.054 -15.628 1.00 0.00 C ATOM 1117 CD LYS A 100 -22.073 -10.833 -14.646 1.00 0.00 C ATOM 1118 CE LYS A 100 -23.096 -9.885 -14.015 1.00 0.00 C ATOM 1119 NZ LYS A 100 -22.380 -9.254 -12.871 1.00 0.00 N ATOM 0 H LYS A 100 -18.721 -12.339 -18.063 1.00 0.00 H new ATOM 0 HA LYS A 100 -21.438 -12.535 -16.738 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -19.607 -11.482 -15.292 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -19.279 -10.348 -16.586 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -20.783 -9.170 -15.141 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -21.794 -9.704 -16.469 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -22.584 -11.645 -15.163 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -21.456 -11.288 -13.871 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -23.434 -9.136 -14.731 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -23.980 -10.426 -13.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -22.684 -8.264 -12.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -22.601 -9.771 -11.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -21.355 -9.286 -13.043 1.00 0.00 H new ATOM 1133 N GLU A 101 -22.020 -11.868 -19.125 1.00 0.00 N ATOM 1134 CA GLU A 101 -22.591 -11.230 -20.352 1.00 0.00 C ATOM 1135 C GLU A 101 -23.770 -12.051 -20.878 1.00 0.00 C ATOM 1136 O GLU A 101 -24.881 -11.563 -20.974 1.00 0.00 O ATOM 1137 CB GLU A 101 -21.446 -11.229 -21.368 1.00 0.00 C ATOM 1138 CG GLU A 101 -21.892 -10.499 -22.637 1.00 0.00 C ATOM 1139 CD GLU A 101 -20.795 -10.605 -23.699 1.00 0.00 C ATOM 1140 OE1 GLU A 101 -20.138 -11.633 -23.747 1.00 0.00 O ATOM 1141 OE2 GLU A 101 -20.630 -9.657 -24.449 1.00 0.00 O ATOM 0 H GLU A 101 -22.365 -12.808 -18.930 1.00 0.00 H new ATOM 0 HA GLU A 101 -22.966 -10.225 -20.156 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -20.569 -10.740 -20.943 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -21.156 -12.252 -21.607 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -22.819 -10.933 -23.012 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -22.097 -9.452 -22.414 1.00 0.00 H new ATOM 1148 N SER A 102 -23.529 -13.297 -21.220 1.00 0.00 N ATOM 1149 CA SER A 102 -24.631 -14.170 -21.747 1.00 0.00 C ATOM 1150 C SER A 102 -25.752 -14.298 -20.709 1.00 0.00 C ATOM 1151 O SER A 102 -26.920 -14.342 -21.054 1.00 0.00 O ATOM 1152 CB SER A 102 -23.988 -15.534 -22.007 1.00 0.00 C ATOM 1153 OG SER A 102 -22.869 -15.371 -22.869 1.00 0.00 O ATOM 0 H SER A 102 -22.616 -13.748 -21.157 1.00 0.00 H new ATOM 0 HA SER A 102 -25.077 -13.755 -22.651 1.00 0.00 H new ATOM 0 HB2 SER A 102 -23.674 -15.986 -21.066 1.00 0.00 H new ATOM 0 HB3 SER A 102 -24.714 -16.210 -22.459 1.00 0.00 H new ATOM 0 HG SER A 102 -22.455 -16.243 -23.036 1.00 0.00 H new ATOM 1159 N VAL A 103 -25.400 -14.356 -19.446 1.00 0.00 N ATOM 1160 CA VAL A 103 -26.432 -14.481 -18.370 1.00 0.00 C ATOM 1161 C VAL A 103 -26.176 -13.446 -17.263 1.00 0.00 C ATOM 1162 O VAL A 103 -25.042 -13.158 -16.923 1.00 0.00 O ATOM 1163 CB VAL A 103 -26.281 -15.918 -17.842 1.00 0.00 C ATOM 1164 CG1 VAL A 103 -24.867 -16.135 -17.287 1.00 0.00 C ATOM 1165 CG2 VAL A 103 -27.307 -16.168 -16.733 1.00 0.00 C ATOM 0 H VAL A 103 -24.436 -14.322 -19.114 1.00 0.00 H new ATOM 0 HA VAL A 103 -27.442 -14.294 -18.734 1.00 0.00 H new ATOM 0 HB VAL A 103 -26.451 -16.614 -18.663 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -24.774 -17.156 -16.917 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -24.136 -15.968 -18.078 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -24.685 -15.435 -16.471 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -27.199 -17.186 -16.360 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -27.141 -15.464 -15.918 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -28.313 -16.032 -17.131 1.00 0.00 H new ATOM 1175 N ALA A 104 -27.229 -12.892 -16.707 1.00 0.00 N ATOM 1176 CA ALA A 104 -27.069 -11.874 -15.617 1.00 0.00 C ATOM 1177 C ALA A 104 -26.559 -12.542 -14.337 1.00 0.00 C ATOM 1178 O ALA A 104 -25.788 -11.963 -13.592 1.00 0.00 O ATOM 1179 CB ALA A 104 -28.466 -11.288 -15.394 1.00 0.00 C ATOM 0 H ALA A 104 -28.194 -13.101 -16.962 1.00 0.00 H new ATOM 0 HA ALA A 104 -26.347 -11.103 -15.885 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -28.423 -10.534 -14.608 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -28.820 -10.829 -16.317 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -29.151 -12.083 -15.098 1.00 0.00 H new ATOM 1185 N GLU A 105 -26.988 -13.756 -14.081 1.00 0.00 N ATOM 1186 CA GLU A 105 -26.539 -14.479 -12.849 1.00 0.00 C ATOM 1187 C GLU A 105 -26.873 -15.972 -12.954 1.00 0.00 C ATOM 1188 O GLU A 105 -27.910 -16.348 -13.472 1.00 0.00 O ATOM 1189 CB GLU A 105 -27.308 -13.824 -11.691 1.00 0.00 C ATOM 1190 CG GLU A 105 -28.820 -13.951 -11.915 1.00 0.00 C ATOM 1191 CD GLU A 105 -29.564 -13.153 -10.843 1.00 0.00 C ATOM 1192 OE1 GLU A 105 -29.274 -11.977 -10.699 1.00 0.00 O ATOM 1193 OE2 GLU A 105 -30.414 -13.732 -10.185 1.00 0.00 O ATOM 0 H GLU A 105 -27.632 -14.278 -14.675 1.00 0.00 H new ATOM 0 HA GLU A 105 -25.461 -14.411 -12.703 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -27.032 -14.298 -10.749 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -27.033 -12.772 -11.612 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -29.084 -13.582 -12.906 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -29.117 -14.999 -11.875 1.00 0.00 H new ATOM 1200 N GLU A 106 -25.999 -16.819 -12.463 1.00 0.00 N ATOM 1201 CA GLU A 106 -26.247 -18.293 -12.522 1.00 0.00 C ATOM 1202 C GLU A 106 -26.641 -18.819 -11.135 1.00 0.00 C ATOM 1203 O GLU A 106 -27.790 -19.139 -10.892 1.00 0.00 O ATOM 1204 CB GLU A 106 -24.917 -18.902 -12.972 1.00 0.00 C ATOM 1205 CG GLU A 106 -24.697 -18.609 -14.460 1.00 0.00 C ATOM 1206 CD GLU A 106 -25.758 -19.338 -15.290 1.00 0.00 C ATOM 1207 OE1 GLU A 106 -26.160 -20.419 -14.891 1.00 0.00 O ATOM 1208 OE2 GLU A 106 -26.150 -18.801 -16.313 1.00 0.00 O ATOM 0 H GLU A 106 -25.120 -16.550 -12.022 1.00 0.00 H new ATOM 0 HA GLU A 106 -27.061 -18.549 -13.201 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -24.098 -18.488 -12.384 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -24.921 -19.978 -12.799 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -24.753 -17.536 -14.642 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -23.700 -18.932 -14.761 1.00 0.00 H new ATOM 1215 N GLU A 107 -25.690 -18.907 -10.233 1.00 0.00 N ATOM 1216 CA GLU A 107 -25.991 -19.411 -8.856 1.00 0.00 C ATOM 1217 C GLU A 107 -26.013 -18.251 -7.858 1.00 0.00 C ATOM 1218 O GLU A 107 -26.864 -18.190 -6.988 1.00 0.00 O ATOM 1219 CB GLU A 107 -24.851 -20.377 -8.531 1.00 0.00 C ATOM 1220 CG GLU A 107 -24.867 -21.542 -9.523 1.00 0.00 C ATOM 1221 CD GLU A 107 -23.787 -22.559 -9.143 1.00 0.00 C ATOM 1222 OE1 GLU A 107 -23.536 -22.717 -7.959 1.00 0.00 O ATOM 1223 OE2 GLU A 107 -23.228 -23.163 -10.044 1.00 0.00 O ATOM 0 H GLU A 107 -24.716 -18.650 -10.393 1.00 0.00 H new ATOM 0 HA GLU A 107 -26.966 -19.895 -8.798 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -23.895 -19.857 -8.581 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -24.957 -20.752 -7.513 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -25.847 -22.020 -9.522 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -24.694 -21.174 -10.534 1.00 0.00 H new ATOM 1230 N ASP A 108 -25.080 -17.334 -7.981 1.00 0.00 N ATOM 1231 CA ASP A 108 -25.032 -16.166 -7.043 1.00 0.00 C ATOM 1232 C ASP A 108 -26.134 -15.163 -7.390 1.00 0.00 C ATOM 1233 O ASP A 108 -26.425 -14.928 -8.549 1.00 0.00 O ATOM 1234 CB ASP A 108 -23.650 -15.536 -7.247 1.00 0.00 C ATOM 1235 CG ASP A 108 -22.565 -16.531 -6.828 1.00 0.00 C ATOM 1236 OD1 ASP A 108 -22.801 -17.281 -5.896 1.00 0.00 O ATOM 1237 OD2 ASP A 108 -21.513 -16.525 -7.447 1.00 0.00 O ATOM 0 H ASP A 108 -24.349 -17.345 -8.692 1.00 0.00 H new ATOM 0 HA ASP A 108 -25.189 -16.468 -6.007 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -23.517 -15.257 -8.292 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -23.566 -14.622 -6.659 1.00 0.00 H new ATOM 1242 N SER A 109 -26.745 -14.572 -6.390 1.00 0.00 N ATOM 1243 CA SER A 109 -27.833 -13.578 -6.641 1.00 0.00 C ATOM 1244 C SER A 109 -28.124 -12.776 -5.368 1.00 0.00 C ATOM 1245 O SER A 109 -28.206 -11.563 -5.398 1.00 0.00 O ATOM 1246 CB SER A 109 -29.049 -14.413 -7.036 1.00 0.00 C ATOM 1247 OG SER A 109 -29.575 -15.053 -5.881 1.00 0.00 O ATOM 0 H SER A 109 -26.534 -14.738 -5.406 1.00 0.00 H new ATOM 0 HA SER A 109 -27.563 -12.859 -7.414 1.00 0.00 H new ATOM 0 HB2 SER A 109 -29.809 -13.777 -7.491 1.00 0.00 H new ATOM 0 HB3 SER A 109 -28.767 -15.157 -7.781 1.00 0.00 H new ATOM 0 HG SER A 109 -30.357 -15.588 -6.131 1.00 0.00 H new ATOM 1253 N ASP A 110 -28.277 -13.454 -4.254 1.00 0.00 N ATOM 1254 CA ASP A 110 -28.565 -12.744 -2.963 1.00 0.00 C ATOM 1255 C ASP A 110 -27.430 -11.775 -2.627 1.00 0.00 C ATOM 1256 O ASP A 110 -27.659 -10.669 -2.177 1.00 0.00 O ATOM 1257 CB ASP A 110 -28.662 -13.843 -1.899 1.00 0.00 C ATOM 1258 CG ASP A 110 -29.862 -14.745 -2.197 1.00 0.00 C ATOM 1259 OD1 ASP A 110 -30.853 -14.237 -2.695 1.00 0.00 O ATOM 1260 OD2 ASP A 110 -29.769 -15.930 -1.922 1.00 0.00 O ATOM 0 H ASP A 110 -28.215 -14.470 -4.182 1.00 0.00 H new ATOM 0 HA ASP A 110 -29.482 -12.158 -3.020 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -27.745 -14.433 -1.887 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -28.767 -13.397 -0.910 1.00 0.00 H new ATOM 1265 N ASP A 111 -26.197 -12.182 -2.842 1.00 0.00 N ATOM 1266 CA ASP A 111 -25.015 -11.297 -2.540 1.00 0.00 C ATOM 1267 C ASP A 111 -25.069 -10.781 -1.094 1.00 0.00 C ATOM 1268 O ASP A 111 -24.915 -9.598 -0.845 1.00 0.00 O ATOM 1269 CB ASP A 111 -25.106 -10.130 -3.531 1.00 0.00 C ATOM 1270 CG ASP A 111 -24.882 -10.645 -4.957 1.00 0.00 C ATOM 1271 OD1 ASP A 111 -25.267 -11.770 -5.231 1.00 0.00 O ATOM 1272 OD2 ASP A 111 -24.327 -9.903 -5.751 1.00 0.00 O ATOM 0 H ASP A 111 -25.955 -13.099 -3.218 1.00 0.00 H new ATOM 0 HA ASP A 111 -24.076 -11.841 -2.641 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -26.083 -9.652 -3.456 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -24.361 -9.373 -3.286 1.00 0.00 H new ATOM 1277 N ASP A 112 -25.290 -11.664 -0.149 1.00 0.00 N ATOM 1278 CA ASP A 112 -25.362 -11.243 1.290 1.00 0.00 C ATOM 1279 C ASP A 112 -24.048 -10.577 1.719 1.00 0.00 C ATOM 1280 O ASP A 112 -24.048 -9.647 2.506 1.00 0.00 O ATOM 1281 CB ASP A 112 -25.607 -12.532 2.090 1.00 0.00 C ATOM 1282 CG ASP A 112 -24.479 -13.538 1.831 1.00 0.00 C ATOM 1283 OD1 ASP A 112 -23.497 -13.495 2.553 1.00 0.00 O ATOM 1284 OD2 ASP A 112 -24.620 -14.334 0.916 1.00 0.00 O ATOM 0 H ASP A 112 -25.424 -12.662 -0.311 1.00 0.00 H new ATOM 0 HA ASP A 112 -26.155 -10.514 1.459 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -25.663 -12.303 3.154 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -26.565 -12.968 1.807 1.00 0.00 H new ATOM 1289 N VAL A 113 -22.937 -11.052 1.207 1.00 0.00 N ATOM 1290 CA VAL A 113 -21.613 -10.459 1.577 1.00 0.00 C ATOM 1291 C VAL A 113 -20.824 -10.090 0.311 1.00 0.00 C ATOM 1292 O VAL A 113 -20.784 -10.843 -0.646 1.00 0.00 O ATOM 1293 CB VAL A 113 -20.898 -11.555 2.385 1.00 0.00 C ATOM 1294 CG1 VAL A 113 -20.726 -12.817 1.532 1.00 0.00 C ATOM 1295 CG2 VAL A 113 -19.522 -11.050 2.829 1.00 0.00 C ATOM 0 H VAL A 113 -22.891 -11.828 0.546 1.00 0.00 H new ATOM 0 HA VAL A 113 -21.712 -9.540 2.154 1.00 0.00 H new ATOM 0 HB VAL A 113 -21.501 -11.797 3.260 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -20.219 -13.585 2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -21.705 -13.184 1.223 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -20.132 -12.581 0.649 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -19.016 -11.828 3.402 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -18.926 -10.800 1.952 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -19.643 -10.163 3.450 1.00 0.00 H new ATOM 1305 N GLU A 114 -20.202 -8.934 0.309 1.00 0.00 N ATOM 1306 CA GLU A 114 -19.411 -8.492 -0.876 1.00 0.00 C ATOM 1307 C GLU A 114 -17.966 -9.019 -0.779 1.00 0.00 C ATOM 1308 O GLU A 114 -17.429 -9.108 0.309 1.00 0.00 O ATOM 1309 CB GLU A 114 -19.431 -6.966 -0.800 1.00 0.00 C ATOM 1310 CG GLU A 114 -20.529 -6.419 -1.714 1.00 0.00 C ATOM 1311 CD GLU A 114 -20.463 -4.891 -1.735 1.00 0.00 C ATOM 1312 OE1 GLU A 114 -19.460 -4.368 -2.191 1.00 0.00 O ATOM 1313 OE2 GLU A 114 -21.417 -4.271 -1.295 1.00 0.00 O ATOM 0 H GLU A 114 -20.211 -8.274 1.087 1.00 0.00 H new ATOM 0 HA GLU A 114 -19.819 -8.865 -1.815 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -19.606 -6.646 0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -18.463 -6.565 -1.098 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -20.406 -6.813 -2.723 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -21.507 -6.746 -1.361 1.00 0.00 H new ATOM 1320 N PRO A 115 -17.365 -9.358 -1.912 1.00 0.00 N ATOM 1321 CA PRO A 115 -15.971 -9.872 -1.887 1.00 0.00 C ATOM 1322 C PRO A 115 -14.989 -8.735 -1.587 1.00 0.00 C ATOM 1323 O PRO A 115 -14.398 -8.165 -2.485 1.00 0.00 O ATOM 1324 CB PRO A 115 -15.755 -10.416 -3.297 1.00 0.00 C ATOM 1325 CG PRO A 115 -16.719 -9.662 -4.156 1.00 0.00 C ATOM 1326 CD PRO A 115 -17.896 -9.303 -3.291 1.00 0.00 C ATOM 0 HA PRO A 115 -15.810 -10.628 -1.118 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -14.728 -10.260 -3.627 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -15.944 -11.489 -3.339 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -16.252 -8.765 -4.563 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -17.035 -10.269 -5.004 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -18.278 -8.311 -3.531 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -18.719 -10.004 -3.429 1.00 0.00 H new ATOM 1334 N ILE A 116 -14.819 -8.407 -0.328 1.00 0.00 N ATOM 1335 CA ILE A 116 -13.879 -7.305 0.053 1.00 0.00 C ATOM 1336 C ILE A 116 -12.752 -7.850 0.928 1.00 0.00 C ATOM 1337 O ILE A 116 -12.927 -8.807 1.662 1.00 0.00 O ATOM 1338 CB ILE A 116 -14.723 -6.286 0.832 1.00 0.00 C ATOM 1339 CG1 ILE A 116 -15.898 -5.793 -0.033 1.00 0.00 C ATOM 1340 CG2 ILE A 116 -13.854 -5.088 1.239 1.00 0.00 C ATOM 1341 CD1 ILE A 116 -15.393 -5.134 -1.325 1.00 0.00 C ATOM 0 H ILE A 116 -15.293 -8.857 0.455 1.00 0.00 H new ATOM 0 HA ILE A 116 -13.414 -6.851 -0.822 1.00 0.00 H new ATOM 0 HB ILE A 116 -15.115 -6.772 1.726 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -16.550 -6.631 -0.279 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -16.497 -5.079 0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -14.460 -4.370 1.791 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -13.034 -5.431 1.869 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -13.450 -4.611 0.346 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -16.243 -4.795 -1.917 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -14.761 -4.281 -1.076 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -14.815 -5.857 -1.901 1.00 0.00 H new ATOM 1353 N ALA A 117 -11.598 -7.240 0.847 1.00 0.00 N ATOM 1354 CA ALA A 117 -10.435 -7.692 1.663 1.00 0.00 C ATOM 1355 C ALA A 117 -10.034 -6.584 2.632 1.00 0.00 C ATOM 1356 O ALA A 117 -10.054 -5.416 2.258 1.00 0.00 O ATOM 1357 CB ALA A 117 -9.326 -7.925 0.638 1.00 0.00 C ATOM 0 H ALA A 117 -11.411 -6.439 0.243 1.00 0.00 H new ATOM 0 HA ALA A 117 -10.647 -8.582 2.255 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -8.424 -8.262 1.148 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -9.644 -8.685 -0.076 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -9.118 -6.995 0.110 1.00 0.00 H new ATOM 1363 N GLU A 118 -9.662 -6.918 3.862 1.00 0.00 N ATOM 1364 CA GLU A 118 -9.255 -5.824 4.812 1.00 0.00 C ATOM 1365 C GLU A 118 -7.743 -5.806 4.953 1.00 0.00 C ATOM 1366 O GLU A 118 -7.154 -6.722 5.484 1.00 0.00 O ATOM 1367 CB GLU A 118 -9.915 -6.099 6.171 1.00 0.00 C ATOM 1368 CG GLU A 118 -11.421 -6.378 6.026 1.00 0.00 C ATOM 1369 CD GLU A 118 -12.128 -5.200 5.345 1.00 0.00 C ATOM 1370 OE1 GLU A 118 -11.820 -4.931 4.194 1.00 0.00 O ATOM 1371 OE2 GLU A 118 -12.970 -4.591 5.983 1.00 0.00 O ATOM 0 H GLU A 118 -9.625 -7.867 4.233 1.00 0.00 H new ATOM 0 HA GLU A 118 -9.576 -4.853 4.435 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -9.431 -6.953 6.645 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -9.765 -5.243 6.828 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -11.573 -7.286 5.443 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -11.860 -6.553 7.008 1.00 0.00 H new ATOM 1378 N PHE A 119 -7.118 -4.758 4.489 1.00 0.00 N ATOM 1379 CA PHE A 119 -5.638 -4.654 4.592 1.00 0.00 C ATOM 1380 C PHE A 119 -5.324 -3.932 5.895 1.00 0.00 C ATOM 1381 O PHE A 119 -5.821 -2.851 6.148 1.00 0.00 O ATOM 1382 CB PHE A 119 -5.262 -3.862 3.309 1.00 0.00 C ATOM 1383 CG PHE A 119 -3.847 -3.303 3.311 1.00 0.00 C ATOM 1384 CD1 PHE A 119 -3.480 -2.300 4.209 1.00 0.00 C ATOM 1385 CD2 PHE A 119 -2.917 -3.744 2.357 1.00 0.00 C ATOM 1386 CE1 PHE A 119 -2.208 -1.744 4.172 1.00 0.00 C ATOM 1387 CE2 PHE A 119 -1.628 -3.188 2.323 1.00 0.00 C ATOM 1388 CZ PHE A 119 -1.281 -2.181 3.235 1.00 0.00 C ATOM 0 H PHE A 119 -7.575 -3.964 4.040 1.00 0.00 H new ATOM 0 HA PHE A 119 -5.079 -5.589 4.632 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.381 -4.515 2.445 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.965 -3.039 3.185 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.193 -1.952 4.941 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -3.193 -4.511 1.649 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -1.939 -0.969 4.874 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -0.907 -3.535 1.597 1.00 0.00 H new ATOM 0 HZ PHE A 119 -0.293 -1.745 3.209 1.00 0.00 H new ATOM 1398 N ARG A 120 -4.505 -4.522 6.729 1.00 0.00 N ATOM 1399 CA ARG A 120 -4.155 -3.855 8.010 1.00 0.00 C ATOM 1400 C ARG A 120 -2.651 -3.746 8.088 1.00 0.00 C ATOM 1401 O ARG A 120 -1.963 -4.736 8.058 1.00 0.00 O ATOM 1402 CB ARG A 120 -4.736 -4.779 9.097 1.00 0.00 C ATOM 1403 CG ARG A 120 -4.270 -4.356 10.503 1.00 0.00 C ATOM 1404 CD ARG A 120 -4.871 -5.301 11.547 1.00 0.00 C ATOM 1405 NE ARG A 120 -4.514 -4.708 12.864 1.00 0.00 N ATOM 1406 CZ ARG A 120 -5.337 -3.885 13.456 1.00 0.00 C ATOM 1407 NH1 ARG A 120 -5.366 -2.627 13.111 1.00 0.00 N ATOM 1408 NH2 ARG A 120 -6.130 -4.322 14.395 1.00 0.00 N ATOM 0 H ARG A 120 -4.068 -5.431 6.576 1.00 0.00 H new ATOM 0 HA ARG A 120 -4.551 -2.845 8.118 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -5.825 -4.757 9.051 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -4.429 -5.807 8.905 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.182 -4.380 10.559 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -4.577 -3.330 10.706 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -5.952 -5.379 11.431 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -4.466 -6.308 11.446 1.00 0.00 H new ATOM 0 HE ARG A 120 -3.625 -4.945 13.305 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -4.745 -2.285 12.378 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -6.010 -1.986 13.575 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -6.107 -5.305 14.666 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -6.774 -3.681 14.859 1.00 0.00 H new ATOM 1422 N PHE A 121 -2.126 -2.551 8.183 1.00 0.00 N ATOM 1423 CA PHE A 121 -0.649 -2.394 8.272 1.00 0.00 C ATOM 1424 C PHE A 121 -0.353 -1.733 9.603 1.00 0.00 C ATOM 1425 O PHE A 121 -0.713 -0.603 9.874 1.00 0.00 O ATOM 1426 CB PHE A 121 -0.185 -1.631 7.016 1.00 0.00 C ATOM 1427 CG PHE A 121 0.301 -2.655 5.970 1.00 0.00 C ATOM 1428 CD1 PHE A 121 -0.511 -3.752 5.609 1.00 0.00 C ATOM 1429 CD2 PHE A 121 1.574 -2.546 5.396 1.00 0.00 C ATOM 1430 CE1 PHE A 121 -0.069 -4.705 4.697 1.00 0.00 C ATOM 1431 CE2 PHE A 121 2.008 -3.512 4.465 1.00 0.00 C ATOM 1432 CZ PHE A 121 1.183 -4.588 4.123 1.00 0.00 C ATOM 0 H PHE A 121 -2.658 -1.681 8.203 1.00 0.00 H new ATOM 0 HA PHE A 121 -0.088 -3.328 8.268 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.003 -1.036 6.611 1.00 0.00 H new ATOM 0 HB3 PHE A 121 0.618 -0.939 7.269 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -1.492 -3.853 6.048 1.00 0.00 H new ATOM 0 HD2 PHE A 121 2.221 -1.725 5.666 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -0.705 -5.538 4.437 1.00 0.00 H new ATOM 0 HE2 PHE A 121 2.984 -3.420 4.013 1.00 0.00 H new ATOM 0 HZ PHE A 121 1.523 -5.326 3.412 1.00 0.00 H new ATOM 1442 N VAL A 122 0.226 -2.508 10.470 1.00 0.00 N ATOM 1443 CA VAL A 122 0.497 -2.058 11.858 1.00 0.00 C ATOM 1444 C VAL A 122 2.002 -2.222 12.159 1.00 0.00 C ATOM 1445 O VAL A 122 2.527 -3.316 12.080 1.00 0.00 O ATOM 1446 CB VAL A 122 -0.404 -2.989 12.745 1.00 0.00 C ATOM 1447 CG1 VAL A 122 -1.891 -2.695 12.494 1.00 0.00 C ATOM 1448 CG2 VAL A 122 -0.233 -4.464 12.389 1.00 0.00 C ATOM 0 H VAL A 122 0.531 -3.460 10.269 1.00 0.00 H new ATOM 0 HA VAL A 122 0.268 -1.008 12.042 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.102 -2.795 13.774 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.501 -3.349 13.117 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.103 -1.655 12.743 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.125 -2.872 11.444 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -0.876 -5.069 13.028 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -0.508 -4.621 11.346 1.00 0.00 H new ATOM 0 HG23 VAL A 122 0.806 -4.756 12.538 1.00 0.00 H new ATOM 1458 N PRO A 123 2.677 -1.121 12.479 1.00 0.00 N ATOM 1459 CA PRO A 123 4.120 -1.189 12.761 1.00 0.00 C ATOM 1460 C PRO A 123 4.419 -1.399 14.253 1.00 0.00 C ATOM 1461 O PRO A 123 5.569 -1.415 14.650 1.00 0.00 O ATOM 1462 CB PRO A 123 4.624 0.181 12.321 1.00 0.00 C ATOM 1463 CG PRO A 123 3.441 1.106 12.423 1.00 0.00 C ATOM 1464 CD PRO A 123 2.199 0.267 12.600 1.00 0.00 C ATOM 0 HA PRO A 123 4.593 -2.028 12.251 1.00 0.00 H new ATOM 0 HB2 PRO A 123 5.441 0.520 12.958 1.00 0.00 H new ATOM 0 HB3 PRO A 123 5.007 0.148 11.301 1.00 0.00 H new ATOM 0 HG2 PRO A 123 3.563 1.787 13.265 1.00 0.00 H new ATOM 0 HG3 PRO A 123 3.360 1.720 11.526 1.00 0.00 H new ATOM 0 HD2 PRO A 123 1.734 0.444 13.570 1.00 0.00 H new ATOM 0 HD3 PRO A 123 1.451 0.498 11.841 1.00 0.00 H new ATOM 1472 N SER A 124 3.407 -1.555 15.093 1.00 0.00 N ATOM 1473 CA SER A 124 3.645 -1.752 16.571 1.00 0.00 C ATOM 1474 C SER A 124 4.642 -0.704 17.131 1.00 0.00 C ATOM 1475 O SER A 124 5.329 -0.945 18.107 1.00 0.00 O ATOM 1476 CB SER A 124 4.219 -3.164 16.667 1.00 0.00 C ATOM 1477 OG SER A 124 4.795 -3.365 17.952 1.00 0.00 O ATOM 0 H SER A 124 2.425 -1.554 14.816 1.00 0.00 H new ATOM 0 HA SER A 124 2.735 -1.627 17.158 1.00 0.00 H new ATOM 0 HB2 SER A 124 3.433 -3.898 16.492 1.00 0.00 H new ATOM 0 HB3 SER A 124 4.972 -3.313 15.894 1.00 0.00 H new ATOM 0 HG SER A 124 5.476 -2.680 18.116 1.00 0.00 H new ATOM 1483 N ASP A 125 4.724 0.447 16.498 1.00 0.00 N ATOM 1484 CA ASP A 125 5.673 1.511 16.958 1.00 0.00 C ATOM 1485 C ASP A 125 5.047 2.899 16.837 1.00 0.00 C ATOM 1486 O ASP A 125 4.629 3.312 15.772 1.00 0.00 O ATOM 1487 CB ASP A 125 6.881 1.372 16.030 1.00 0.00 C ATOM 1488 CG ASP A 125 7.970 2.370 16.433 1.00 0.00 C ATOM 1489 OD1 ASP A 125 8.066 2.676 17.613 1.00 0.00 O ATOM 1490 OD2 ASP A 125 8.695 2.809 15.556 1.00 0.00 O ATOM 0 H ASP A 125 4.170 0.694 15.678 1.00 0.00 H new ATOM 0 HA ASP A 125 5.941 1.397 18.008 1.00 0.00 H new ATOM 0 HB2 ASP A 125 7.272 0.356 16.079 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.579 1.548 14.998 1.00 0.00 H new ATOM 1495 N LYS A 126 4.998 3.629 17.933 1.00 0.00 N ATOM 1496 CA LYS A 126 4.419 5.014 17.904 1.00 0.00 C ATOM 1497 C LYS A 126 5.228 5.878 16.941 1.00 0.00 C ATOM 1498 O LYS A 126 4.685 6.699 16.223 1.00 0.00 O ATOM 1499 CB LYS A 126 4.537 5.546 19.336 1.00 0.00 C ATOM 1500 CG LYS A 126 3.916 6.943 19.415 1.00 0.00 C ATOM 1501 CD LYS A 126 3.945 7.436 20.863 1.00 0.00 C ATOM 1502 CE LYS A 126 3.163 8.746 20.971 1.00 0.00 C ATOM 1503 NZ LYS A 126 3.058 9.013 22.433 1.00 0.00 N ATOM 0 H LYS A 126 5.335 3.323 18.846 1.00 0.00 H new ATOM 0 HA LYS A 126 3.382 5.023 17.567 1.00 0.00 H new ATOM 0 HB2 LYS A 126 4.032 4.872 20.028 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.584 5.585 19.636 1.00 0.00 H new ATOM 0 HG2 LYS A 126 4.465 7.633 18.774 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.889 6.917 19.049 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.510 6.685 21.523 1.00 0.00 H new ATOM 0 HD3 LYS A 126 4.975 7.587 21.187 1.00 0.00 H new ATOM 0 HE2 LYS A 126 3.679 9.557 20.458 1.00 0.00 H new ATOM 0 HE3 LYS A 126 2.177 8.656 20.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 2.533 9.897 22.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 2.556 8.227 22.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 4.011 9.101 22.839 1.00 0.00 H new ATOM 1517 N SER A 127 6.522 5.666 16.908 1.00 0.00 N ATOM 1518 CA SER A 127 7.389 6.441 15.969 1.00 0.00 C ATOM 1519 C SER A 127 7.000 6.080 14.537 1.00 0.00 C ATOM 1520 O SER A 127 7.055 6.909 13.642 1.00 0.00 O ATOM 1521 CB SER A 127 8.826 6.010 16.267 1.00 0.00 C ATOM 1522 OG SER A 127 9.728 6.917 15.648 1.00 0.00 O ATOM 0 H SER A 127 7.014 4.989 17.491 1.00 0.00 H new ATOM 0 HA SER A 127 7.280 7.519 16.088 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.995 5.989 17.344 1.00 0.00 H new ATOM 0 HB3 SER A 127 8.998 4.999 15.897 1.00 0.00 H new ATOM 0 HG SER A 127 10.649 6.643 15.839 1.00 0.00 H new ATOM 1528 N ALA A 128 6.582 4.846 14.323 1.00 0.00 N ATOM 1529 CA ALA A 128 6.159 4.431 12.949 1.00 0.00 C ATOM 1530 C ALA A 128 4.768 4.995 12.656 1.00 0.00 C ATOM 1531 O ALA A 128 4.444 5.309 11.525 1.00 0.00 O ATOM 1532 CB ALA A 128 6.125 2.905 12.970 1.00 0.00 C ATOM 0 H ALA A 128 6.518 4.120 15.036 1.00 0.00 H new ATOM 0 HA ALA A 128 6.835 4.799 12.178 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.822 2.534 11.991 1.00 0.00 H new ATOM 0 HB2 ALA A 128 7.117 2.522 13.212 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.412 2.567 13.723 1.00 0.00 H new ATOM 1538 N LEU A 129 3.950 5.126 13.676 1.00 0.00 N ATOM 1539 CA LEU A 129 2.571 5.675 13.478 1.00 0.00 C ATOM 1540 C LEU A 129 2.647 7.161 13.116 1.00 0.00 C ATOM 1541 O LEU A 129 1.983 7.612 12.197 1.00 0.00 O ATOM 1542 CB LEU A 129 1.849 5.474 14.825 1.00 0.00 C ATOM 1543 CG LEU A 129 0.478 4.802 14.611 1.00 0.00 C ATOM 1544 CD1 LEU A 129 -0.405 5.675 13.714 1.00 0.00 C ATOM 1545 CD2 LEU A 129 0.662 3.426 13.959 1.00 0.00 C ATOM 0 H LEU A 129 4.180 4.876 14.638 1.00 0.00 H new ATOM 0 HA LEU A 129 2.042 5.176 12.666 1.00 0.00 H new ATOM 0 HB2 LEU A 129 2.462 4.860 15.484 1.00 0.00 H new ATOM 0 HB3 LEU A 129 1.715 6.436 15.319 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.004 4.681 15.581 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -1.370 5.190 13.570 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.554 6.647 14.185 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.080 5.811 12.747 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.312 2.960 13.812 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.157 3.543 12.995 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.272 2.796 14.606 1.00 0.00 H new ATOM 1557 N GLU A 130 3.452 7.922 13.829 1.00 0.00 N ATOM 1558 CA GLU A 130 3.576 9.381 13.521 1.00 0.00 C ATOM 1559 C GLU A 130 4.241 9.564 12.152 1.00 0.00 C ATOM 1560 O GLU A 130 3.849 10.421 11.375 1.00 0.00 O ATOM 1561 CB GLU A 130 4.421 9.983 14.658 1.00 0.00 C ATOM 1562 CG GLU A 130 5.836 9.389 14.676 1.00 0.00 C ATOM 1563 CD GLU A 130 6.636 10.028 15.813 1.00 0.00 C ATOM 1564 OE1 GLU A 130 6.600 9.495 16.910 1.00 0.00 O ATOM 1565 OE2 GLU A 130 7.270 11.042 15.568 1.00 0.00 O ATOM 0 H GLU A 130 4.024 7.593 14.607 1.00 0.00 H new ATOM 0 HA GLU A 130 2.609 9.880 13.466 1.00 0.00 H new ATOM 0 HB2 GLU A 130 4.480 11.065 14.537 1.00 0.00 H new ATOM 0 HB3 GLU A 130 3.933 9.796 15.615 1.00 0.00 H new ATOM 0 HG2 GLU A 130 5.788 8.309 14.812 1.00 0.00 H new ATOM 0 HG3 GLU A 130 6.331 9.569 13.722 1.00 0.00 H new ATOM 1572 N ALA A 131 5.227 8.749 11.849 1.00 0.00 N ATOM 1573 CA ALA A 131 5.909 8.849 10.521 1.00 0.00 C ATOM 1574 C ALA A 131 4.916 8.471 9.422 1.00 0.00 C ATOM 1575 O ALA A 131 4.837 9.118 8.392 1.00 0.00 O ATOM 1576 CB ALA A 131 7.068 7.849 10.572 1.00 0.00 C ATOM 0 H ALA A 131 5.587 8.020 12.465 1.00 0.00 H new ATOM 0 HA ALA A 131 6.272 9.855 10.311 1.00 0.00 H new ATOM 0 HB1 ALA A 131 7.610 7.872 9.627 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.743 8.116 11.385 1.00 0.00 H new ATOM 0 HB3 ALA A 131 6.676 6.846 10.741 1.00 0.00 H new ATOM 1582 N MET A 132 4.149 7.431 9.651 1.00 0.00 N ATOM 1583 CA MET A 132 3.136 6.995 8.638 1.00 0.00 C ATOM 1584 C MET A 132 2.072 8.082 8.481 1.00 0.00 C ATOM 1585 O MET A 132 1.582 8.328 7.396 1.00 0.00 O ATOM 1586 CB MET A 132 2.515 5.711 9.198 1.00 0.00 C ATOM 1587 CG MET A 132 1.581 5.096 8.153 1.00 0.00 C ATOM 1588 SD MET A 132 2.559 4.446 6.777 1.00 0.00 S ATOM 1589 CE MET A 132 2.046 2.718 6.933 1.00 0.00 C ATOM 0 H MET A 132 4.181 6.864 10.498 1.00 0.00 H new ATOM 0 HA MET A 132 3.579 6.824 7.657 1.00 0.00 H new ATOM 0 HB2 MET A 132 3.299 5.001 9.463 1.00 0.00 H new ATOM 0 HB3 MET A 132 1.962 5.931 10.111 1.00 0.00 H new ATOM 0 HG2 MET A 132 0.991 4.298 8.603 1.00 0.00 H new ATOM 0 HG3 MET A 132 0.879 5.847 7.791 1.00 0.00 H new ATOM 0 HE1 MET A 132 2.185 2.210 5.979 1.00 0.00 H new ATOM 0 HE2 MET A 132 2.649 2.227 7.697 1.00 0.00 H new ATOM 0 HE3 MET A 132 0.995 2.675 7.217 1.00 0.00 H new ATOM 1599 N PHE A 133 1.722 8.735 9.568 1.00 0.00 N ATOM 1600 CA PHE A 133 0.695 9.823 9.501 1.00 0.00 C ATOM 1601 C PHE A 133 1.222 10.960 8.662 1.00 0.00 C ATOM 1602 O PHE A 133 0.500 11.538 7.872 1.00 0.00 O ATOM 1603 CB PHE A 133 0.434 10.238 10.964 1.00 0.00 C ATOM 1604 CG PHE A 133 -0.602 9.325 11.655 1.00 0.00 C ATOM 1605 CD1 PHE A 133 -1.033 8.101 11.079 1.00 0.00 C ATOM 1606 CD2 PHE A 133 -1.129 9.716 12.893 1.00 0.00 C ATOM 1607 CE1 PHE A 133 -1.970 7.299 11.739 1.00 0.00 C ATOM 1608 CE2 PHE A 133 -2.068 8.908 13.551 1.00 0.00 C ATOM 1609 CZ PHE A 133 -2.488 7.703 12.974 1.00 0.00 C ATOM 0 H PHE A 133 2.104 8.560 10.497 1.00 0.00 H new ATOM 0 HA PHE A 133 -0.236 9.504 9.032 1.00 0.00 H new ATOM 0 HB2 PHE A 133 1.371 10.208 11.521 1.00 0.00 H new ATOM 0 HB3 PHE A 133 0.081 11.269 10.990 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -0.635 7.787 10.125 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -0.810 10.645 13.343 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.293 6.369 11.295 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -2.468 9.216 14.506 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.213 7.085 13.483 1.00 0.00 H new ATOM 1619 N THR A 134 2.492 11.252 8.791 1.00 0.00 N ATOM 1620 CA THR A 134 3.101 12.318 7.946 1.00 0.00 C ATOM 1621 C THR A 134 3.080 11.831 6.494 1.00 0.00 C ATOM 1622 O THR A 134 2.894 12.605 5.572 1.00 0.00 O ATOM 1623 CB THR A 134 4.537 12.490 8.451 1.00 0.00 C ATOM 1624 OG1 THR A 134 4.518 12.760 9.845 1.00 0.00 O ATOM 1625 CG2 THR A 134 5.204 13.651 7.712 1.00 0.00 C ATOM 0 H THR A 134 3.130 10.798 9.444 1.00 0.00 H new ATOM 0 HA THR A 134 2.570 13.268 7.999 1.00 0.00 H new ATOM 0 HB THR A 134 5.100 11.575 8.266 1.00 0.00 H new ATOM 0 HG1 THR A 134 4.412 11.920 10.339 1.00 0.00 H new ATOM 0 HG21 THR A 134 6.226 13.773 8.072 1.00 0.00 H new ATOM 0 HG22 THR A 134 5.219 13.441 6.643 1.00 0.00 H new ATOM 0 HG23 THR A 134 4.644 14.568 7.894 1.00 0.00 H new ATOM 1633 N ALA A 135 3.248 10.536 6.298 1.00 0.00 N ATOM 1634 CA ALA A 135 3.211 9.972 4.911 1.00 0.00 C ATOM 1635 C ALA A 135 1.786 10.056 4.354 1.00 0.00 C ATOM 1636 O ALA A 135 1.570 10.486 3.235 1.00 0.00 O ATOM 1637 CB ALA A 135 3.647 8.512 5.049 1.00 0.00 C ATOM 0 H ALA A 135 3.408 9.853 7.038 1.00 0.00 H new ATOM 0 HA ALA A 135 3.860 10.519 4.228 1.00 0.00 H new ATOM 0 HB1 ALA A 135 3.643 8.037 4.068 1.00 0.00 H new ATOM 0 HB2 ALA A 135 4.652 8.471 5.468 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.957 7.987 5.710 1.00 0.00 H new ATOM 1643 N MET A 136 0.820 9.647 5.143 1.00 0.00 N ATOM 1644 CA MET A 136 -0.608 9.695 4.689 1.00 0.00 C ATOM 1645 C MET A 136 -1.090 11.144 4.631 1.00 0.00 C ATOM 1646 O MET A 136 -1.689 11.568 3.659 1.00 0.00 O ATOM 1647 CB MET A 136 -1.402 8.908 5.737 1.00 0.00 C ATOM 1648 CG MET A 136 -2.869 8.826 5.311 1.00 0.00 C ATOM 1649 SD MET A 136 -3.851 8.127 6.660 1.00 0.00 S ATOM 1650 CE MET A 136 -3.126 6.468 6.633 1.00 0.00 C ATOM 0 H MET A 136 0.959 9.281 6.085 1.00 0.00 H new ATOM 0 HA MET A 136 -0.733 9.272 3.692 1.00 0.00 H new ATOM 0 HB2 MET A 136 -0.987 7.906 5.846 1.00 0.00 H new ATOM 0 HB3 MET A 136 -1.321 9.393 6.710 1.00 0.00 H new ATOM 0 HG2 MET A 136 -3.240 9.818 5.053 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.966 8.208 4.418 1.00 0.00 H new ATOM 0 HE1 MET A 136 -3.810 5.764 7.108 1.00 0.00 H new ATOM 0 HE2 MET A 136 -2.952 6.164 5.601 1.00 0.00 H new ATOM 0 HE3 MET A 136 -2.180 6.476 7.174 1.00 0.00 H new ATOM 1660 N CYS A 137 -0.831 11.898 5.674 1.00 0.00 N ATOM 1661 CA CYS A 137 -1.272 13.332 5.699 1.00 0.00 C ATOM 1662 C CYS A 137 -0.621 14.105 4.550 1.00 0.00 C ATOM 1663 O CYS A 137 -1.271 14.875 3.866 1.00 0.00 O ATOM 1664 CB CYS A 137 -0.806 13.884 7.049 1.00 0.00 C ATOM 1665 SG CYS A 137 -1.657 15.445 7.388 1.00 0.00 S ATOM 0 H CYS A 137 -0.334 11.584 6.508 1.00 0.00 H new ATOM 0 HA CYS A 137 -2.351 13.427 5.579 1.00 0.00 H new ATOM 0 HB2 CYS A 137 -1.015 13.164 7.840 1.00 0.00 H new ATOM 0 HB3 CYS A 137 0.273 14.040 7.037 1.00 0.00 H new ATOM 0 HG CYS A 137 -1.264 15.914 8.535 1.00 0.00 H new ATOM 1671 N GLU A 138 0.660 13.899 4.337 1.00 0.00 N ATOM 1672 CA GLU A 138 1.369 14.616 3.227 1.00 0.00 C ATOM 1673 C GLU A 138 0.870 14.118 1.876 1.00 0.00 C ATOM 1674 O GLU A 138 0.754 14.869 0.926 1.00 0.00 O ATOM 1675 CB GLU A 138 2.855 14.293 3.407 1.00 0.00 C ATOM 1676 CG GLU A 138 3.676 15.062 2.368 1.00 0.00 C ATOM 1677 CD GLU A 138 5.144 14.642 2.461 1.00 0.00 C ATOM 1678 OE1 GLU A 138 5.393 13.483 2.749 1.00 0.00 O ATOM 1679 OE2 GLU A 138 5.996 15.487 2.243 1.00 0.00 O ATOM 0 H GLU A 138 1.244 13.266 4.884 1.00 0.00 H new ATOM 0 HA GLU A 138 1.189 15.691 3.257 1.00 0.00 H new ATOM 0 HB2 GLU A 138 3.177 14.563 4.413 1.00 0.00 H new ATOM 0 HB3 GLU A 138 3.021 13.221 3.296 1.00 0.00 H new ATOM 0 HG2 GLU A 138 3.293 14.863 1.367 1.00 0.00 H new ATOM 0 HG3 GLU A 138 3.583 16.135 2.537 1.00 0.00 H new ATOM 1686 N CYS A 139 0.573 12.854 1.803 1.00 0.00 N ATOM 1687 CA CYS A 139 0.068 12.256 0.526 1.00 0.00 C ATOM 1688 C CYS A 139 -1.355 12.747 0.249 1.00 0.00 C ATOM 1689 O CYS A 139 -1.699 13.078 -0.871 1.00 0.00 O ATOM 1690 CB CYS A 139 0.078 10.742 0.750 1.00 0.00 C ATOM 1691 SG CYS A 139 1.714 10.083 0.339 1.00 0.00 S ATOM 0 H CYS A 139 0.657 12.197 2.579 1.00 0.00 H new ATOM 0 HA CYS A 139 0.681 12.538 -0.330 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -0.167 10.515 1.788 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -0.683 10.267 0.131 1.00 0.00 H new ATOM 0 HG CYS A 139 2.408 9.935 1.428 1.00 0.00 H new ATOM 1697 N GLN A 140 -2.179 12.795 1.271 1.00 0.00 N ATOM 1698 CA GLN A 140 -3.591 13.265 1.087 1.00 0.00 C ATOM 1699 C GLN A 140 -3.607 14.747 0.718 1.00 0.00 C ATOM 1700 O GLN A 140 -4.394 15.178 -0.108 1.00 0.00 O ATOM 1701 CB GLN A 140 -4.277 13.049 2.441 1.00 0.00 C ATOM 1702 CG GLN A 140 -5.050 11.730 2.420 1.00 0.00 C ATOM 1703 CD GLN A 140 -5.896 11.612 3.675 1.00 0.00 C ATOM 1704 OE1 GLN A 140 -6.729 12.454 3.954 1.00 0.00 O ATOM 1705 NE2 GLN A 140 -5.710 10.588 4.453 1.00 0.00 N ATOM 0 H GLN A 140 -1.934 12.529 2.225 1.00 0.00 H new ATOM 0 HA GLN A 140 -4.097 12.725 0.287 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.534 13.034 3.238 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -4.955 13.876 2.653 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -5.686 11.684 1.536 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -4.356 10.892 2.358 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -5.010 9.886 4.213 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -6.264 10.486 5.303 1.00 0.00 H new ATOM 1714 N ALA A 141 -2.743 15.527 1.326 1.00 0.00 N ATOM 1715 CA ALA A 141 -2.699 16.993 1.020 1.00 0.00 C ATOM 1716 C ALA A 141 -2.142 17.220 -0.388 1.00 0.00 C ATOM 1717 O ALA A 141 -2.613 18.076 -1.117 1.00 0.00 O ATOM 1718 CB ALA A 141 -1.770 17.606 2.070 1.00 0.00 C ATOM 0 H ALA A 141 -2.067 15.211 2.021 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.690 17.445 1.051 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.692 18.681 1.904 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.173 17.421 3.065 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.781 17.154 1.989 1.00 0.00 H new ATOM 1724 N LEU A 142 -1.148 16.454 -0.769 1.00 0.00 N ATOM 1725 CA LEU A 142 -0.545 16.612 -2.134 1.00 0.00 C ATOM 1726 C LEU A 142 -1.558 16.189 -3.203 1.00 0.00 C ATOM 1727 O LEU A 142 -1.617 16.767 -4.274 1.00 0.00 O ATOM 1728 CB LEU A 142 0.680 15.682 -2.156 1.00 0.00 C ATOM 1729 CG LEU A 142 1.753 16.209 -3.128 1.00 0.00 C ATOM 1730 CD1 LEU A 142 1.185 16.298 -4.550 1.00 0.00 C ATOM 1731 CD2 LEU A 142 2.229 17.595 -2.680 1.00 0.00 C ATOM 0 H LEU A 142 -0.726 15.725 -0.194 1.00 0.00 H new ATOM 0 HA LEU A 142 -0.266 17.645 -2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 142 1.100 15.603 -1.153 1.00 0.00 H new ATOM 0 HB3 LEU A 142 0.375 14.679 -2.454 1.00 0.00 H new ATOM 0 HG LEU A 142 2.596 15.518 -3.124 1.00 0.00 H new ATOM 0 HD11 LEU A 142 1.954 16.672 -5.226 1.00 0.00 H new ATOM 0 HD12 LEU A 142 0.865 15.309 -4.876 1.00 0.00 H new ATOM 0 HD13 LEU A 142 0.332 16.977 -4.559 1.00 0.00 H new ATOM 0 HD21 LEU A 142 2.987 17.961 -3.372 1.00 0.00 H new ATOM 0 HD22 LEU A 142 1.384 18.284 -2.670 1.00 0.00 H new ATOM 0 HD23 LEU A 142 2.654 17.528 -1.679 1.00 0.00 H new TER 1743 LEU A 142