USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 952 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 133 GLN : amide:sc= 0.477 K(o=2.1,f=-3!) USER MOD Set 1.2: A 137 THR OG1 : rot 151:sc= 1.38 USER MOD Set 1.3: A 139 ASN : amide:sc= 0.198 K(o=2.1,f=-4.1!) USER MOD Set 2.1: A 131 ASN : amide:sc= -5.35! K(o=-3.2!,f=1.5) USER MOD Set 2.2: A 134 SER OG : rot -34:sc= 1.16 USER MOD Set 2.3: A 135 THR OG1 : rot -58:sc= 1.03 USER MOD Set 3.1: A 46 HIS : no HD1:sc= -2.21 K(o=-10,f=-21!) USER MOD Set 3.2: A 48 HIS : no HD1:sc= -0.943 K(o=-10,f=-8.5) USER MOD Set 3.3: A 63 HIS : no HE2:sc= -2.41 K(o=-10,f=-13!) USER MOD Set 3.4: A 71 HIS : no HD1:sc= -3.44! C(o=-10!,f=-18!) USER MOD Set 3.5: A 80 HIS : no HD1:sc= -0.862 K(o=-10,f=-11) USER MOD Set 3.6: A 120 HIS : no HE2:sc= -0.171 K(o=-10,f=-14!) USER MOD Single : A 3 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0475) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.0343 K(o=-0.034,f=-1) USER MOD Single : A 19 ASN : amide:sc= -0.361 X(o=-0.36,f=-0.23) USER MOD Single : A 30 LYS NZ :NH3+ 161:sc= 1.12 (180deg=1.02) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc=-0.00713 USER MOD Single : A 43 HIS : no HE2:sc= -3.18! C(o=-2!,f=-10!) USER MOD Single : A 65 ASN : amide:sc= 0.836 K(o=0.84,f=-11!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00604) USER MOD Single : A 86 ASN : amide:sc= -0.656 K(o=-0.66,f=-2.8!) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 157:sc= 0.554 (180deg=-0.719!) USER MOD Single : A 98 SER OG : rot 52:sc= 0.72 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 23:sc= 1.06 USER MOD Single : A 110 HIS : no HE2:sc= -0.328 K(o=-0.33,f=-3.3!) USER MOD Single : A 111 SER OG : rot 180:sc= 0.0441 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0.289 USER MOD Single : A 146 CYS SG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD ----------------------------------------------------------------- ATOM 27 N LYS A 3 12.735 5.707 10.459 1.00 0.00 N ATOM 28 CA LYS A 3 11.860 5.243 11.515 1.00 0.00 C ATOM 29 C LYS A 3 10.509 5.898 11.262 1.00 0.00 C ATOM 30 O LYS A 3 10.159 6.881 11.912 1.00 0.00 O ATOM 31 CB LYS A 3 12.412 5.676 12.892 1.00 0.00 C ATOM 32 CG LYS A 3 13.506 4.773 13.471 1.00 0.00 C ATOM 33 CD LYS A 3 12.913 3.440 13.961 1.00 0.00 C ATOM 34 CE LYS A 3 13.993 2.486 14.478 1.00 0.00 C ATOM 35 NZ LYS A 3 14.865 1.990 13.388 1.00 0.00 N ATOM 0 HA LYS A 3 11.782 4.156 11.520 1.00 0.00 H new ATOM 0 HB2 LYS A 3 12.807 6.688 12.805 1.00 0.00 H new ATOM 0 HB3 LYS A 3 11.585 5.717 13.600 1.00 0.00 H new ATOM 0 HG2 LYS A 3 14.265 4.581 12.712 1.00 0.00 H new ATOM 0 HG3 LYS A 3 14.003 5.281 14.298 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.191 3.634 14.754 1.00 0.00 H new ATOM 0 HD3 LYS A 3 12.369 2.964 13.145 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.601 2.997 15.224 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.520 1.640 14.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.504 1.259 13.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.278 1.584 12.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.426 2.778 13.006 1.00 0.00 H new ATOM 49 N ALA A 4 9.753 5.366 10.305 1.00 0.00 N ATOM 50 CA ALA A 4 8.361 5.736 10.121 1.00 0.00 C ATOM 51 C ALA A 4 7.523 4.465 10.077 1.00 0.00 C ATOM 52 O ALA A 4 8.044 3.398 9.758 1.00 0.00 O ATOM 53 CB ALA A 4 8.239 6.621 8.885 1.00 0.00 C ATOM 0 H ALA A 4 10.090 4.670 9.640 1.00 0.00 H new ATOM 0 HA ALA A 4 7.978 6.329 10.951 1.00 0.00 H new ATOM 0 HB1 ALA A 4 7.196 6.903 8.741 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.842 7.519 9.019 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.592 6.075 8.010 1.00 0.00 H new ATOM 59 N VAL A 5 6.249 4.566 10.456 1.00 0.00 N ATOM 60 CA VAL A 5 5.357 3.440 10.678 1.00 0.00 C ATOM 61 C VAL A 5 3.940 3.888 10.327 1.00 0.00 C ATOM 62 O VAL A 5 3.624 5.070 10.473 1.00 0.00 O ATOM 63 CB VAL A 5 5.492 2.962 12.144 1.00 0.00 C ATOM 64 CG1 VAL A 5 5.031 4.030 13.147 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.766 1.646 12.454 1.00 0.00 C ATOM 0 H VAL A 5 5.799 5.467 10.621 1.00 0.00 H new ATOM 0 HA VAL A 5 5.611 2.589 10.046 1.00 0.00 H new ATOM 0 HB VAL A 5 6.561 2.780 12.258 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.144 3.649 14.162 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.637 4.928 13.027 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.984 4.272 12.965 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.914 1.387 13.502 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.701 1.763 12.256 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.167 0.852 11.824 1.00 0.00 H new ATOM 75 N ALA A 6 3.085 2.968 9.865 1.00 0.00 N ATOM 76 CA ALA A 6 1.654 3.237 9.779 1.00 0.00 C ATOM 77 C ALA A 6 0.886 2.034 10.309 1.00 0.00 C ATOM 78 O ALA A 6 0.934 0.963 9.712 1.00 0.00 O ATOM 79 CB ALA A 6 1.253 3.585 8.345 1.00 0.00 C ATOM 0 H ALA A 6 3.361 2.039 9.548 1.00 0.00 H new ATOM 0 HA ALA A 6 1.406 4.102 10.394 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.182 3.782 8.304 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.797 4.472 8.020 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.494 2.750 7.687 1.00 0.00 H new ATOM 85 N VAL A 7 0.202 2.198 11.441 1.00 0.00 N ATOM 86 CA VAL A 7 -0.643 1.172 12.005 1.00 0.00 C ATOM 87 C VAL A 7 -2.018 1.218 11.327 1.00 0.00 C ATOM 88 O VAL A 7 -2.863 2.056 11.632 1.00 0.00 O ATOM 89 CB VAL A 7 -0.667 1.279 13.540 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.761 1.324 14.101 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.463 2.461 14.115 1.00 0.00 C ATOM 0 H VAL A 7 0.226 3.058 11.989 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.242 0.179 11.803 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.195 0.380 13.858 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.723 1.400 15.188 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.292 0.415 13.819 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.284 2.190 13.695 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.412 2.439 15.204 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.039 3.397 13.751 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.503 2.387 13.799 1.00 0.00 H new ATOM 101 N LEU A 8 -2.233 0.327 10.365 1.00 0.00 N ATOM 102 CA LEU A 8 -3.525 0.091 9.759 1.00 0.00 C ATOM 103 C LEU A 8 -4.492 -0.462 10.801 1.00 0.00 C ATOM 104 O LEU A 8 -4.069 -1.231 11.664 1.00 0.00 O ATOM 105 CB LEU A 8 -3.362 -0.872 8.574 1.00 0.00 C ATOM 106 CG LEU A 8 -3.186 -0.083 7.274 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.837 0.643 7.271 1.00 0.00 C ATOM 108 CD2 LEU A 8 -3.275 -1.050 6.098 1.00 0.00 C ATOM 0 H LEU A 8 -1.493 -0.261 9.981 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.939 1.027 9.385 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.499 -1.517 8.736 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -4.235 -1.520 8.500 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.972 0.668 7.189 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.726 1.200 6.341 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.793 1.332 8.114 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.031 -0.086 7.356 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.151 -0.500 5.165 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.489 -1.801 6.184 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.248 -1.541 6.103 1.00 0.00 H new ATOM 120 N LYS A 9 -5.768 -0.077 10.700 1.00 0.00 N ATOM 121 CA LYS A 9 -6.879 -0.569 11.504 1.00 0.00 C ATOM 122 C LYS A 9 -8.112 -0.600 10.595 1.00 0.00 C ATOM 123 O LYS A 9 -8.247 0.278 9.743 1.00 0.00 O ATOM 124 CB LYS A 9 -7.089 0.389 12.684 1.00 0.00 C ATOM 125 CG LYS A 9 -8.136 -0.107 13.698 1.00 0.00 C ATOM 126 CD LYS A 9 -7.491 -0.551 15.016 1.00 0.00 C ATOM 127 CE LYS A 9 -7.017 0.663 15.835 1.00 0.00 C ATOM 128 NZ LYS A 9 -6.318 0.260 17.071 1.00 0.00 N ATOM 0 H LYS A 9 -6.064 0.622 10.019 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.689 -1.566 11.902 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.138 0.535 13.197 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.397 1.362 12.302 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.855 0.688 13.896 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.692 -0.940 13.267 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.208 -1.130 15.599 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.645 -1.207 14.808 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.351 1.274 15.225 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.875 1.285 16.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.016 1.108 17.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.961 -0.301 17.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.484 -0.312 16.828 1.00 0.00 H new ATOM 142 N GLY A 10 -8.992 -1.593 10.736 1.00 0.00 N ATOM 143 CA GLY A 10 -10.223 -1.671 9.969 1.00 0.00 C ATOM 144 C GLY A 10 -11.436 -1.729 10.880 1.00 0.00 C ATOM 145 O GLY A 10 -11.336 -1.492 12.084 1.00 0.00 O ATOM 0 H GLY A 10 -8.864 -2.366 11.390 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.300 -0.805 9.311 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.202 -2.555 9.331 1.00 0.00 H new ATOM 149 N ASP A 11 -12.579 -2.070 10.280 1.00 0.00 N ATOM 150 CA ASP A 11 -13.811 -2.360 10.997 1.00 0.00 C ATOM 151 C ASP A 11 -13.586 -3.527 11.960 1.00 0.00 C ATOM 152 O ASP A 11 -13.991 -3.479 13.121 1.00 0.00 O ATOM 153 CB ASP A 11 -14.904 -2.695 9.977 1.00 0.00 C ATOM 154 CG ASP A 11 -16.225 -2.982 10.674 1.00 0.00 C ATOM 155 OD1 ASP A 11 -16.983 -2.008 10.869 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.450 -4.170 10.986 1.00 0.00 O ATOM 0 H ASP A 11 -12.670 -2.152 9.267 1.00 0.00 H new ATOM 0 HA ASP A 11 -14.121 -1.495 11.582 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -15.027 -1.863 9.283 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.604 -3.561 9.387 1.00 0.00 H new ATOM 161 N GLY A 12 -12.893 -4.564 11.475 1.00 0.00 N ATOM 162 CA GLY A 12 -12.580 -5.742 12.249 1.00 0.00 C ATOM 163 C GLY A 12 -11.150 -5.640 12.769 1.00 0.00 C ATOM 164 O GLY A 12 -10.504 -4.598 12.650 1.00 0.00 O ATOM 0 H GLY A 12 -12.535 -4.596 10.520 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.276 -5.839 13.082 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.693 -6.635 11.634 1.00 0.00 H new ATOM 168 N PRO A 13 -10.605 -6.746 13.286 1.00 0.00 N ATOM 169 CA PRO A 13 -9.301 -6.778 13.924 1.00 0.00 C ATOM 170 C PRO A 13 -8.162 -6.835 12.901 1.00 0.00 C ATOM 171 O PRO A 13 -7.028 -7.121 13.272 1.00 0.00 O ATOM 172 CB PRO A 13 -9.347 -8.023 14.813 1.00 0.00 C ATOM 173 CG PRO A 13 -10.239 -8.975 14.014 1.00 0.00 C ATOM 174 CD PRO A 13 -11.241 -8.047 13.321 1.00 0.00 C ATOM 0 HA PRO A 13 -9.100 -5.874 14.498 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.354 -8.441 14.976 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -9.766 -7.804 15.795 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.662 -9.551 13.291 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.741 -9.692 14.664 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.470 -8.399 12.315 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.183 -8.008 13.868 1.00 0.00 H new ATOM 182 N VAL A 14 -8.447 -6.543 11.626 1.00 0.00 N ATOM 183 CA VAL A 14 -7.440 -6.287 10.615 1.00 0.00 C ATOM 184 C VAL A 14 -6.614 -5.101 11.097 1.00 0.00 C ATOM 185 O VAL A 14 -7.049 -3.953 10.984 1.00 0.00 O ATOM 186 CB VAL A 14 -8.107 -5.974 9.265 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.019 -5.736 8.210 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.020 -7.119 8.812 1.00 0.00 C ATOM 0 H VAL A 14 -9.402 -6.479 11.273 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.804 -7.160 10.468 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.721 -5.081 9.383 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.485 -5.514 7.250 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.395 -4.895 8.514 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.402 -6.630 8.115 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.475 -6.865 7.855 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.433 -8.031 8.704 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.802 -7.277 9.555 1.00 0.00 H new ATOM 198 N GLN A 15 -5.429 -5.388 11.628 1.00 0.00 N ATOM 199 CA GLN A 15 -4.439 -4.382 11.952 1.00 0.00 C ATOM 200 C GLN A 15 -3.300 -4.554 10.954 1.00 0.00 C ATOM 201 O GLN A 15 -3.154 -5.639 10.394 1.00 0.00 O ATOM 202 CB GLN A 15 -4.015 -4.529 13.421 1.00 0.00 C ATOM 203 CG GLN A 15 -3.212 -5.814 13.687 1.00 0.00 C ATOM 204 CD GLN A 15 -3.527 -6.462 15.035 1.00 0.00 C ATOM 205 OE1 GLN A 15 -3.628 -7.680 15.142 1.00 0.00 O ATOM 206 NE2 GLN A 15 -3.670 -5.661 16.087 1.00 0.00 N ATOM 0 H GLN A 15 -5.132 -6.339 11.846 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.821 -3.365 11.864 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -3.415 -3.666 13.709 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -4.903 -4.525 14.052 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.415 -6.531 12.892 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.148 -5.583 13.644 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.582 -4.651 15.975 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -3.868 -6.057 17.006 1.00 0.00 H new ATOM 215 N GLY A 16 -2.500 -3.519 10.699 1.00 0.00 N ATOM 216 CA GLY A 16 -1.323 -3.713 9.859 1.00 0.00 C ATOM 217 C GLY A 16 -0.169 -2.772 10.170 1.00 0.00 C ATOM 218 O GLY A 16 -0.284 -1.573 9.972 1.00 0.00 O ATOM 0 H GLY A 16 -2.638 -2.571 11.048 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.978 -4.741 9.969 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.611 -3.584 8.816 1.00 0.00 H new ATOM 222 N ILE A 17 0.954 -3.304 10.643 1.00 0.00 N ATOM 223 CA ILE A 17 2.103 -2.522 11.065 1.00 0.00 C ATOM 224 C ILE A 17 2.986 -2.270 9.837 1.00 0.00 C ATOM 225 O ILE A 17 3.894 -3.054 9.563 1.00 0.00 O ATOM 226 CB ILE A 17 2.827 -3.275 12.202 1.00 0.00 C ATOM 227 CG1 ILE A 17 1.856 -3.565 13.369 1.00 0.00 C ATOM 228 CG2 ILE A 17 4.019 -2.449 12.706 1.00 0.00 C ATOM 229 CD1 ILE A 17 2.446 -4.506 14.422 1.00 0.00 C ATOM 0 H ILE A 17 1.090 -4.310 10.744 1.00 0.00 H new ATOM 0 HA ILE A 17 1.817 -1.550 11.466 1.00 0.00 H new ATOM 0 HB ILE A 17 3.190 -4.224 11.809 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.579 -2.625 13.845 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.940 -4.003 12.972 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.523 -2.989 13.508 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.718 -2.281 11.887 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.664 -1.490 13.082 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.715 -4.670 15.214 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.698 -5.460 13.958 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.346 -4.060 14.845 1.00 0.00 H new ATOM 241 N ILE A 18 2.709 -1.198 9.086 1.00 0.00 N ATOM 242 CA ILE A 18 3.557 -0.743 7.984 1.00 0.00 C ATOM 243 C ILE A 18 4.778 -0.057 8.571 1.00 0.00 C ATOM 244 O ILE A 18 4.651 0.572 9.616 1.00 0.00 O ATOM 245 CB ILE A 18 2.787 0.242 7.092 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.618 -0.446 6.380 1.00 0.00 C ATOM 247 CG2 ILE A 18 3.701 0.944 6.077 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.123 -1.233 5.175 1.00 0.00 C ATOM 0 H ILE A 18 1.882 -0.618 9.229 1.00 0.00 H new ATOM 0 HA ILE A 18 3.859 -1.595 7.375 1.00 0.00 H new ATOM 0 HB ILE A 18 2.383 1.009 7.752 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.105 -1.115 7.071 1.00 0.00 H new ATOM 0 HG13 ILE A 18 0.890 0.299 6.058 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.111 1.630 5.470 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.473 1.501 6.607 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.169 0.200 5.433 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.282 -1.717 4.678 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.615 -0.555 4.478 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.833 -1.990 5.507 1.00 0.00 H new ATOM 260 N ASN A 19 5.927 -0.147 7.894 1.00 0.00 N ATOM 261 CA ASN A 19 7.199 0.406 8.333 1.00 0.00 C ATOM 262 C ASN A 19 7.877 1.016 7.111 1.00 0.00 C ATOM 263 O ASN A 19 7.874 0.400 6.045 1.00 0.00 O ATOM 264 CB ASN A 19 8.096 -0.674 8.965 1.00 0.00 C ATOM 265 CG ASN A 19 7.315 -1.616 9.880 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.279 -1.434 11.092 1.00 0.00 O ATOM 267 ND2 ASN A 19 6.650 -2.608 9.292 1.00 0.00 N ATOM 0 H ASN A 19 5.993 -0.625 6.995 1.00 0.00 H new ATOM 0 HA ASN A 19 7.030 1.161 9.101 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.575 -1.253 8.175 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.891 -0.194 9.535 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.087 -3.247 9.853 1.00 0.00 H new ATOM 0 HD22 ASN A 19 6.704 -2.729 8.281 1.00 0.00 H new ATOM 274 N PHE A 20 8.442 2.214 7.263 1.00 0.00 N ATOM 275 CA PHE A 20 9.173 2.910 6.214 1.00 0.00 C ATOM 276 C PHE A 20 10.570 3.236 6.722 1.00 0.00 C ATOM 277 O PHE A 20 10.698 3.888 7.764 1.00 0.00 O ATOM 278 CB PHE A 20 8.459 4.209 5.835 1.00 0.00 C ATOM 279 CG PHE A 20 7.165 4.028 5.084 1.00 0.00 C ATOM 280 CD1 PHE A 20 7.195 3.822 3.695 1.00 0.00 C ATOM 281 CD2 PHE A 20 5.935 4.076 5.766 1.00 0.00 C ATOM 282 CE1 PHE A 20 6.002 3.584 2.997 1.00 0.00 C ATOM 283 CE2 PHE A 20 4.742 3.846 5.063 1.00 0.00 C ATOM 284 CZ PHE A 20 4.789 3.530 3.695 1.00 0.00 C ATOM 0 H PHE A 20 8.401 2.735 8.139 1.00 0.00 H new ATOM 0 HA PHE A 20 9.229 2.271 5.333 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.258 4.774 6.745 1.00 0.00 H new ATOM 0 HB3 PHE A 20 9.133 4.813 5.227 1.00 0.00 H new ATOM 0 HD1 PHE A 20 8.136 3.847 3.165 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.909 4.289 6.825 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.019 3.443 1.926 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.792 3.912 5.572 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.885 3.244 3.179 1.00 0.00 H new ATOM 294 N GLU A 21 11.589 2.823 5.965 1.00 0.00 N ATOM 295 CA GLU A 21 12.980 3.179 6.212 1.00 0.00 C ATOM 296 C GLU A 21 13.553 3.920 4.999 1.00 0.00 C ATOM 297 O GLU A 21 13.169 3.629 3.864 1.00 0.00 O ATOM 298 CB GLU A 21 13.777 1.910 6.533 1.00 0.00 C ATOM 299 CG GLU A 21 13.407 1.371 7.928 1.00 0.00 C ATOM 300 CD GLU A 21 14.624 0.932 8.734 1.00 0.00 C ATOM 301 OE1 GLU A 21 15.524 1.784 8.905 1.00 0.00 O ATOM 302 OE2 GLU A 21 14.626 -0.229 9.192 1.00 0.00 O ATOM 0 H GLU A 21 11.464 2.222 5.150 1.00 0.00 H new ATOM 0 HA GLU A 21 13.049 3.850 7.068 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.577 1.149 5.779 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.845 2.126 6.493 1.00 0.00 H new ATOM 0 HG2 GLU A 21 12.871 2.143 8.480 1.00 0.00 H new ATOM 0 HG3 GLU A 21 12.726 0.527 7.817 1.00 0.00 H new ATOM 395 N PRO A 28 16.818 5.524 -1.763 1.00 0.00 N ATOM 396 CA PRO A 28 15.770 4.527 -1.896 1.00 0.00 C ATOM 397 C PRO A 28 15.030 4.345 -0.568 1.00 0.00 C ATOM 398 O PRO A 28 15.655 4.244 0.488 1.00 0.00 O ATOM 399 CB PRO A 28 16.482 3.243 -2.339 1.00 0.00 C ATOM 400 CG PRO A 28 17.909 3.423 -1.817 1.00 0.00 C ATOM 401 CD PRO A 28 18.133 4.930 -1.943 1.00 0.00 C ATOM 0 HA PRO A 28 15.010 4.819 -2.621 1.00 0.00 H new ATOM 0 HB2 PRO A 28 16.009 2.356 -1.916 1.00 0.00 H new ATOM 0 HB3 PRO A 28 16.463 3.128 -3.423 1.00 0.00 H new ATOM 0 HG2 PRO A 28 18.007 3.085 -0.785 1.00 0.00 H new ATOM 0 HG3 PRO A 28 18.629 2.857 -2.408 1.00 0.00 H new ATOM 0 HD2 PRO A 28 18.834 5.289 -1.190 1.00 0.00 H new ATOM 0 HD3 PRO A 28 18.552 5.186 -2.916 1.00 0.00 H new ATOM 409 N VAL A 29 13.699 4.301 -0.627 1.00 0.00 N ATOM 410 CA VAL A 29 12.833 3.996 0.491 1.00 0.00 C ATOM 411 C VAL A 29 12.538 2.520 0.447 1.00 0.00 C ATOM 412 O VAL A 29 12.192 2.003 -0.610 1.00 0.00 O ATOM 413 CB VAL A 29 11.506 4.731 0.316 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.398 4.179 1.217 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.712 6.175 0.696 1.00 0.00 C ATOM 0 H VAL A 29 13.185 4.485 -1.489 1.00 0.00 H new ATOM 0 HA VAL A 29 13.309 4.290 1.427 1.00 0.00 H new ATOM 0 HB VAL A 29 11.199 4.605 -0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.479 4.740 1.049 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.229 3.128 0.984 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.696 4.275 2.261 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.775 6.719 0.578 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.039 6.235 1.734 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.472 6.616 0.051 1.00 0.00 H new ATOM 425 N LYS A 30 12.582 1.885 1.609 1.00 0.00 N ATOM 426 CA LYS A 30 12.150 0.528 1.818 1.00 0.00 C ATOM 427 C LYS A 30 10.791 0.575 2.513 1.00 0.00 C ATOM 428 O LYS A 30 10.673 1.132 3.608 1.00 0.00 O ATOM 429 CB LYS A 30 13.220 -0.166 2.649 1.00 0.00 C ATOM 430 CG LYS A 30 14.349 -0.653 1.731 1.00 0.00 C ATOM 431 CD LYS A 30 15.582 -1.024 2.566 1.00 0.00 C ATOM 432 CE LYS A 30 16.614 -1.831 1.766 1.00 0.00 C ATOM 433 NZ LYS A 30 17.177 -1.060 0.642 1.00 0.00 N ATOM 0 H LYS A 30 12.934 2.325 2.459 1.00 0.00 H new ATOM 0 HA LYS A 30 12.027 -0.033 0.891 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.616 0.521 3.397 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.787 -1.009 3.188 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.015 -1.517 1.157 1.00 0.00 H new ATOM 0 HG3 LYS A 30 14.607 0.126 1.013 1.00 0.00 H new ATOM 0 HD2 LYS A 30 16.050 -0.114 2.941 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.268 -1.603 3.435 1.00 0.00 H new ATOM 0 HE2 LYS A 30 17.420 -2.144 2.429 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.146 -2.738 1.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 18.070 -1.496 0.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 16.503 -1.058 -0.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 17.356 -0.082 0.947 1.00 0.00 H new ATOM 447 N VAL A 31 9.781 0.014 1.844 1.00 0.00 N ATOM 448 CA VAL A 31 8.404 -0.096 2.282 1.00 0.00 C ATOM 449 C VAL A 31 8.212 -1.517 2.790 1.00 0.00 C ATOM 450 O VAL A 31 8.224 -2.467 2.006 1.00 0.00 O ATOM 451 CB VAL A 31 7.471 0.191 1.095 1.00 0.00 C ATOM 452 CG1 VAL A 31 5.991 0.083 1.488 1.00 0.00 C ATOM 453 CG2 VAL A 31 7.772 1.579 0.536 1.00 0.00 C ATOM 0 H VAL A 31 9.922 -0.400 0.922 1.00 0.00 H new ATOM 0 HA VAL A 31 8.173 0.619 3.071 1.00 0.00 H new ATOM 0 HB VAL A 31 7.656 -0.563 0.330 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.368 0.294 0.619 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.783 -0.924 1.848 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.770 0.803 2.276 1.00 0.00 H new ATOM 0 HG21 VAL A 31 7.111 1.783 -0.306 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.612 2.327 1.313 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.809 1.620 0.201 1.00 0.00 H new ATOM 463 N TRP A 32 8.038 -1.656 4.099 1.00 0.00 N ATOM 464 CA TRP A 32 7.775 -2.934 4.735 1.00 0.00 C ATOM 465 C TRP A 32 6.398 -2.900 5.370 1.00 0.00 C ATOM 466 O TRP A 32 5.863 -1.830 5.654 1.00 0.00 O ATOM 467 CB TRP A 32 8.811 -3.215 5.822 1.00 0.00 C ATOM 468 CG TRP A 32 10.047 -3.930 5.405 1.00 0.00 C ATOM 469 CD1 TRP A 32 10.127 -5.255 5.163 1.00 0.00 C ATOM 470 CD2 TRP A 32 11.413 -3.434 5.361 1.00 0.00 C ATOM 471 NE1 TRP A 32 11.433 -5.600 4.890 1.00 0.00 N ATOM 472 CE2 TRP A 32 12.277 -4.521 5.042 1.00 0.00 C ATOM 473 CE3 TRP A 32 12.014 -2.185 5.621 1.00 0.00 C ATOM 474 CZ2 TRP A 32 13.670 -4.376 4.976 1.00 0.00 C ATOM 475 CZ3 TRP A 32 13.410 -2.042 5.613 1.00 0.00 C ATOM 476 CH2 TRP A 32 14.240 -3.136 5.305 1.00 0.00 C ATOM 0 H TRP A 32 8.077 -0.874 4.753 1.00 0.00 H new ATOM 0 HA TRP A 32 7.828 -3.718 3.980 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.103 -2.264 6.266 1.00 0.00 H new ATOM 0 HB3 TRP A 32 8.330 -3.799 6.607 1.00 0.00 H new ATOM 0 HD1 TRP A 32 9.293 -5.941 5.181 1.00 0.00 H new ATOM 0 HE1 TRP A 32 11.736 -6.533 4.611 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.392 -1.327 5.829 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 14.294 -5.205 4.677 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 13.851 -1.084 5.845 1.00 0.00 H new ATOM 0 HH2 TRP A 32 15.314 -3.022 5.322 1.00 0.00 H new ATOM 487 N GLY A 33 5.847 -4.072 5.674 1.00 0.00 N ATOM 488 CA GLY A 33 4.639 -4.118 6.469 1.00 0.00 C ATOM 489 C GLY A 33 4.297 -5.522 6.915 1.00 0.00 C ATOM 490 O GLY A 33 5.023 -6.459 6.592 1.00 0.00 O ATOM 0 H GLY A 33 6.213 -4.980 5.386 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.759 -3.480 7.345 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.810 -3.711 5.890 1.00 0.00 H new ATOM 494 N SER A 34 3.196 -5.648 7.661 1.00 0.00 N ATOM 495 CA SER A 34 2.703 -6.893 8.204 1.00 0.00 C ATOM 496 C SER A 34 1.265 -6.608 8.585 1.00 0.00 C ATOM 497 O SER A 34 1.009 -5.944 9.590 1.00 0.00 O ATOM 498 CB SER A 34 3.558 -7.346 9.388 1.00 0.00 C ATOM 499 OG SER A 34 2.906 -8.313 10.190 1.00 0.00 O ATOM 0 H SER A 34 2.610 -4.850 7.906 1.00 0.00 H new ATOM 0 HA SER A 34 2.757 -7.717 7.493 1.00 0.00 H new ATOM 0 HB2 SER A 34 4.496 -7.759 9.017 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.811 -6.481 10.001 1.00 0.00 H new ATOM 0 HG SER A 34 3.492 -8.572 10.932 1.00 0.00 H new ATOM 505 N ILE A 35 0.342 -7.058 7.738 1.00 0.00 N ATOM 506 CA ILE A 35 -1.061 -7.135 8.115 1.00 0.00 C ATOM 507 C ILE A 35 -1.179 -8.237 9.158 1.00 0.00 C ATOM 508 O ILE A 35 -0.363 -9.153 9.175 1.00 0.00 O ATOM 509 CB ILE A 35 -1.969 -7.351 6.883 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.943 -6.176 6.694 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.799 -8.636 6.900 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.229 -4.940 6.152 1.00 0.00 C ATOM 0 H ILE A 35 0.543 -7.373 6.789 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.408 -6.195 8.545 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.261 -7.428 6.058 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.739 -6.468 6.008 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.415 -5.936 7.647 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.401 -8.693 5.993 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.134 -9.498 6.949 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.455 -8.634 7.771 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.947 -4.129 6.031 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.451 -4.634 6.851 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.779 -5.174 5.187 1.00 0.00 H new ATOM 524 N LYS A 36 -2.206 -8.173 9.996 1.00 0.00 N ATOM 525 CA LYS A 36 -2.615 -9.259 10.857 1.00 0.00 C ATOM 526 C LYS A 36 -4.129 -9.125 10.967 1.00 0.00 C ATOM 527 O LYS A 36 -4.633 -8.256 11.674 1.00 0.00 O ATOM 528 CB LYS A 36 -1.887 -9.169 12.209 1.00 0.00 C ATOM 529 CG LYS A 36 -1.641 -10.521 12.894 1.00 0.00 C ATOM 530 CD LYS A 36 -2.918 -11.255 13.328 1.00 0.00 C ATOM 531 CE LYS A 36 -2.567 -12.705 13.706 1.00 0.00 C ATOM 532 NZ LYS A 36 -3.752 -13.498 14.092 1.00 0.00 N ATOM 0 H LYS A 36 -2.788 -7.341 10.093 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.355 -10.243 10.468 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.928 -8.673 12.058 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.470 -8.538 12.879 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.081 -11.163 12.213 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.013 -10.361 13.770 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -3.373 -10.746 14.177 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.650 -11.244 12.520 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.072 -13.186 12.862 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.855 -12.698 14.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.458 -14.465 14.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.212 -13.058 14.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -4.422 -13.530 13.297 1.00 0.00 H new ATOM 546 N GLY A 37 -4.851 -9.958 10.224 1.00 0.00 N ATOM 547 CA GLY A 37 -6.286 -10.129 10.432 1.00 0.00 C ATOM 548 C GLY A 37 -7.061 -10.430 9.152 1.00 0.00 C ATOM 549 O GLY A 37 -8.256 -10.706 9.211 1.00 0.00 O ATOM 0 H GLY A 37 -4.465 -10.527 9.470 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.447 -10.940 11.143 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.689 -9.223 10.885 1.00 0.00 H new ATOM 553 N LEU A 38 -6.399 -10.341 7.996 1.00 0.00 N ATOM 554 CA LEU A 38 -6.992 -10.674 6.712 1.00 0.00 C ATOM 555 C LEU A 38 -7.207 -12.189 6.584 1.00 0.00 C ATOM 556 O LEU A 38 -7.078 -12.938 7.547 1.00 0.00 O ATOM 557 CB LEU A 38 -6.074 -10.125 5.601 1.00 0.00 C ATOM 558 CG LEU A 38 -6.694 -9.008 4.757 1.00 0.00 C ATOM 559 CD1 LEU A 38 -8.003 -9.435 4.079 1.00 0.00 C ATOM 560 CD2 LEU A 38 -6.887 -7.727 5.566 1.00 0.00 C ATOM 0 H LEU A 38 -5.429 -10.033 7.931 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.977 -10.216 6.621 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.157 -9.752 6.057 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.791 -10.946 4.942 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.979 -8.798 3.961 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.398 -8.604 3.494 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.812 -10.283 3.422 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.730 -9.721 4.839 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.329 -6.959 4.931 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.548 -7.926 6.410 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -5.922 -7.381 5.935 1.00 0.00 H new ATOM 572 N THR A 39 -7.494 -12.636 5.362 1.00 0.00 N ATOM 573 CA THR A 39 -7.345 -14.007 4.915 1.00 0.00 C ATOM 574 C THR A 39 -6.329 -13.984 3.776 1.00 0.00 C ATOM 575 O THR A 39 -5.995 -12.901 3.272 1.00 0.00 O ATOM 576 CB THR A 39 -8.709 -14.568 4.481 1.00 0.00 C ATOM 577 OG1 THR A 39 -8.596 -15.930 4.119 1.00 0.00 O ATOM 578 CG2 THR A 39 -9.336 -13.787 3.319 1.00 0.00 C ATOM 0 H THR A 39 -7.851 -12.021 4.631 1.00 0.00 H new ATOM 0 HA THR A 39 -6.988 -14.663 5.708 1.00 0.00 H new ATOM 0 HB THR A 39 -9.367 -14.463 5.343 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.474 -16.270 3.847 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.297 -14.231 3.059 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.485 -12.749 3.617 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.673 -13.825 2.455 1.00 0.00 H new ATOM 586 N GLU A 40 -5.862 -15.178 3.399 1.00 0.00 N ATOM 587 CA GLU A 40 -4.898 -15.422 2.345 1.00 0.00 C ATOM 588 C GLU A 40 -5.265 -14.735 1.030 1.00 0.00 C ATOM 589 O GLU A 40 -6.418 -14.361 0.805 1.00 0.00 O ATOM 590 CB GLU A 40 -4.737 -16.937 2.157 1.00 0.00 C ATOM 591 CG GLU A 40 -6.058 -17.680 1.875 1.00 0.00 C ATOM 592 CD GLU A 40 -6.090 -18.283 0.476 1.00 0.00 C ATOM 593 OE1 GLU A 40 -5.231 -19.152 0.217 1.00 0.00 O ATOM 594 OE2 GLU A 40 -6.965 -17.856 -0.308 1.00 0.00 O ATOM 0 H GLU A 40 -6.168 -16.040 3.851 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.947 -14.984 2.648 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.047 -17.119 1.333 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.280 -17.357 3.053 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.193 -18.471 2.613 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.893 -16.990 1.991 1.00 0.00 H new ATOM 601 N GLY A 41 -4.268 -14.565 0.160 1.00 0.00 N ATOM 602 CA GLY A 41 -4.490 -14.043 -1.174 1.00 0.00 C ATOM 603 C GLY A 41 -4.122 -12.570 -1.228 1.00 0.00 C ATOM 604 O GLY A 41 -3.676 -11.982 -0.239 1.00 0.00 O ATOM 0 H GLY A 41 -3.294 -14.786 0.366 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.893 -14.601 -1.895 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.535 -14.175 -1.455 1.00 0.00 H new ATOM 608 N LEU A 42 -4.244 -11.987 -2.418 1.00 0.00 N ATOM 609 CA LEU A 42 -3.625 -10.707 -2.697 1.00 0.00 C ATOM 610 C LEU A 42 -4.519 -9.563 -2.226 1.00 0.00 C ATOM 611 O LEU A 42 -5.744 -9.657 -2.286 1.00 0.00 O ATOM 612 CB LEU A 42 -3.248 -10.586 -4.176 1.00 0.00 C ATOM 613 CG LEU A 42 -1.955 -11.331 -4.548 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.044 -12.841 -4.301 1.00 0.00 C ATOM 615 CD2 LEU A 42 -1.661 -11.105 -6.034 1.00 0.00 C ATOM 0 H LEU A 42 -4.766 -12.385 -3.199 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.695 -10.640 -2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -4.067 -10.972 -4.783 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.134 -9.532 -4.428 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.163 -10.935 -3.912 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -1.102 -13.312 -4.582 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.241 -13.026 -3.245 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.852 -13.261 -4.900 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.746 -11.630 -6.308 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.490 -11.486 -6.631 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.538 -10.038 -6.223 1.00 0.00 H new ATOM 627 N HIS A 43 -3.895 -8.491 -1.736 1.00 0.00 N ATOM 628 CA HIS A 43 -4.558 -7.327 -1.181 1.00 0.00 C ATOM 629 C HIS A 43 -3.916 -6.066 -1.737 1.00 0.00 C ATOM 630 O HIS A 43 -2.728 -5.845 -1.502 1.00 0.00 O ATOM 631 CB HIS A 43 -4.422 -7.388 0.344 1.00 0.00 C ATOM 632 CG HIS A 43 -5.208 -8.531 0.928 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.533 -8.775 0.659 1.00 0.00 N ATOM 634 CD2 HIS A 43 -4.739 -9.562 1.693 1.00 0.00 C ATOM 635 CE1 HIS A 43 -6.868 -9.945 1.216 1.00 0.00 C ATOM 636 NE2 HIS A 43 -5.814 -10.411 1.903 1.00 0.00 N ATOM 0 H HIS A 43 -2.878 -8.414 -1.717 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.614 -7.313 -1.450 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.371 -7.495 0.612 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.767 -6.450 0.778 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.155 -8.168 0.126 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -3.732 -9.690 2.061 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -7.827 -10.433 1.127 1.00 0.00 H new ATOM 645 N GLY A 44 -4.681 -5.255 -2.479 1.00 0.00 N ATOM 646 CA GLY A 44 -4.211 -3.969 -2.972 1.00 0.00 C ATOM 647 C GLY A 44 -3.738 -3.105 -1.807 1.00 0.00 C ATOM 648 O GLY A 44 -4.364 -3.142 -0.747 1.00 0.00 O ATOM 0 H GLY A 44 -5.639 -5.477 -2.750 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.396 -4.118 -3.680 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.012 -3.462 -3.510 1.00 0.00 H new ATOM 652 N PHE A 45 -2.654 -2.349 -2.000 1.00 0.00 N ATOM 653 CA PHE A 45 -2.059 -1.508 -0.969 1.00 0.00 C ATOM 654 C PHE A 45 -1.682 -0.175 -1.591 1.00 0.00 C ATOM 655 O PHE A 45 -0.896 -0.154 -2.540 1.00 0.00 O ATOM 656 CB PHE A 45 -0.803 -2.176 -0.392 1.00 0.00 C ATOM 657 CG PHE A 45 -0.838 -2.358 1.111 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.119 -1.274 1.960 1.00 0.00 C ATOM 659 CD2 PHE A 45 -0.540 -3.611 1.663 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.120 -1.457 3.353 1.00 0.00 C ATOM 661 CE2 PHE A 45 -0.526 -3.795 3.053 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.842 -2.722 3.898 1.00 0.00 C ATOM 0 H PHE A 45 -2.161 -2.306 -2.892 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.776 -1.362 -0.161 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.673 -3.150 -0.863 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.068 -1.576 -0.655 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.334 -0.302 1.542 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.319 -4.443 1.011 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.335 -0.624 4.006 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -0.273 -4.758 3.470 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.872 -2.868 4.968 1.00 0.00 H new ATOM 672 N HIS A 46 -2.244 0.933 -1.095 1.00 0.00 N ATOM 673 CA HIS A 46 -2.019 2.227 -1.730 1.00 0.00 C ATOM 674 C HIS A 46 -1.991 3.354 -0.709 1.00 0.00 C ATOM 675 O HIS A 46 -2.578 3.235 0.369 1.00 0.00 O ATOM 676 CB HIS A 46 -3.101 2.508 -2.787 1.00 0.00 C ATOM 677 CG HIS A 46 -3.650 1.286 -3.468 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.930 0.764 -3.291 1.00 0.00 N ATOM 679 CD2 HIS A 46 -3.037 0.533 -4.422 1.00 0.00 C ATOM 680 CE1 HIS A 46 -5.057 -0.303 -4.106 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.929 -0.416 -4.804 1.00 0.00 N ATOM 0 H HIS A 46 -2.846 0.957 -0.272 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.045 2.184 -2.217 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.924 3.042 -2.311 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.685 3.173 -3.544 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -2.035 0.665 -4.802 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.919 -0.950 -4.179 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.759 -1.117 -5.525 1.00 0.00 H new ATOM 689 N VAL A 47 -1.358 4.467 -1.094 1.00 0.00 N ATOM 690 CA VAL A 47 -1.465 5.724 -0.370 1.00 0.00 C ATOM 691 C VAL A 47 -2.653 6.491 -0.950 1.00 0.00 C ATOM 692 O VAL A 47 -2.604 7.002 -2.072 1.00 0.00 O ATOM 693 CB VAL A 47 -0.165 6.548 -0.416 1.00 0.00 C ATOM 694 CG1 VAL A 47 -0.256 7.685 0.600 1.00 0.00 C ATOM 695 CG2 VAL A 47 1.071 5.693 -0.108 1.00 0.00 C ATOM 0 H VAL A 47 -0.758 4.515 -1.918 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.629 5.522 0.689 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.054 6.941 -1.427 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.662 8.272 0.572 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.104 8.325 0.355 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.391 7.270 1.599 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.964 6.316 -0.152 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.977 5.263 0.889 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.151 4.892 -0.842 1.00 0.00 H new ATOM 705 N HIS A 48 -3.753 6.516 -0.203 1.00 0.00 N ATOM 706 CA HIS A 48 -4.915 7.300 -0.550 1.00 0.00 C ATOM 707 C HIS A 48 -4.655 8.772 -0.268 1.00 0.00 C ATOM 708 O HIS A 48 -3.704 9.134 0.425 1.00 0.00 O ATOM 709 CB HIS A 48 -6.107 6.787 0.260 1.00 0.00 C ATOM 710 CG HIS A 48 -6.634 5.473 -0.264 1.00 0.00 C ATOM 711 ND1 HIS A 48 -7.949 5.203 -0.484 1.00 0.00 N ATOM 712 CD2 HIS A 48 -5.876 4.423 -0.689 1.00 0.00 C ATOM 713 CE1 HIS A 48 -8.037 3.981 -1.006 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.793 3.521 -1.220 1.00 0.00 N ATOM 0 H HIS A 48 -3.855 5.987 0.663 1.00 0.00 H new ATOM 0 HA HIS A 48 -5.134 7.200 -1.613 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.811 6.667 1.302 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.904 7.530 0.239 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.803 4.315 -0.627 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.953 3.450 -1.221 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -6.558 2.650 -1.696 1.00 0.00 H new ATOM 722 N GLU A 49 -5.526 9.607 -0.821 1.00 0.00 N ATOM 723 CA GLU A 49 -5.658 10.979 -0.375 1.00 0.00 C ATOM 724 C GLU A 49 -6.132 11.020 1.075 1.00 0.00 C ATOM 725 O GLU A 49 -6.479 9.981 1.636 1.00 0.00 O ATOM 726 CB GLU A 49 -6.625 11.733 -1.317 1.00 0.00 C ATOM 727 CG GLU A 49 -5.864 12.661 -2.280 1.00 0.00 C ATOM 728 CD GLU A 49 -5.328 13.899 -1.583 1.00 0.00 C ATOM 729 OE1 GLU A 49 -5.236 13.870 -0.337 1.00 0.00 O ATOM 730 OE2 GLU A 49 -5.030 14.859 -2.312 1.00 0.00 O ATOM 0 H GLU A 49 -6.153 9.351 -1.584 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.688 11.475 -0.413 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -7.211 11.014 -1.890 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -7.328 12.319 -0.725 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.036 12.113 -2.731 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.527 12.962 -3.091 1.00 0.00 H new ATOM 876 N PRO A 62 -9.814 8.688 -2.619 1.00 0.00 N ATOM 877 CA PRO A 62 -9.362 7.655 -3.527 1.00 0.00 C ATOM 878 C PRO A 62 -7.829 7.620 -3.620 1.00 0.00 C ATOM 879 O PRO A 62 -7.124 8.271 -2.846 1.00 0.00 O ATOM 880 CB PRO A 62 -10.062 7.977 -4.856 1.00 0.00 C ATOM 881 CG PRO A 62 -10.241 9.495 -4.804 1.00 0.00 C ATOM 882 CD PRO A 62 -10.498 9.760 -3.321 1.00 0.00 C ATOM 0 HA PRO A 62 -9.619 6.650 -3.194 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -9.459 7.673 -5.712 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -11.019 7.462 -4.941 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -9.354 10.018 -5.160 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -11.075 9.825 -5.423 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -10.113 10.735 -3.023 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.565 9.758 -3.100 1.00 0.00 H new ATOM 890 N HIS A 63 -7.310 6.830 -4.568 1.00 0.00 N ATOM 891 CA HIS A 63 -5.881 6.745 -4.844 1.00 0.00 C ATOM 892 C HIS A 63 -5.321 8.142 -5.114 1.00 0.00 C ATOM 893 O HIS A 63 -5.820 8.844 -5.993 1.00 0.00 O ATOM 894 CB HIS A 63 -5.618 5.875 -6.082 1.00 0.00 C ATOM 895 CG HIS A 63 -5.708 4.382 -5.889 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.990 3.412 -6.599 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.501 3.717 -5.000 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.364 2.195 -6.140 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.287 2.386 -5.185 1.00 0.00 N ATOM 0 H HIS A 63 -7.878 6.230 -5.166 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.396 6.301 -3.975 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -6.329 6.162 -6.857 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -4.623 6.111 -6.459 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -4.305 3.591 -7.333 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.174 4.164 -4.283 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.987 1.242 -6.481 1.00 0.00 H new ATOM 907 N PHE A 64 -4.271 8.530 -4.388 1.00 0.00 N ATOM 908 CA PHE A 64 -3.675 9.850 -4.521 1.00 0.00 C ATOM 909 C PHE A 64 -2.991 9.962 -5.894 1.00 0.00 C ATOM 910 O PHE A 64 -1.988 9.302 -6.166 1.00 0.00 O ATOM 911 CB PHE A 64 -2.744 10.067 -3.319 1.00 0.00 C ATOM 912 CG PHE A 64 -2.280 11.479 -2.992 1.00 0.00 C ATOM 913 CD1 PHE A 64 -2.226 12.501 -3.961 1.00 0.00 C ATOM 914 CD2 PHE A 64 -2.049 11.802 -1.641 1.00 0.00 C ATOM 915 CE1 PHE A 64 -1.973 13.829 -3.580 1.00 0.00 C ATOM 916 CE2 PHE A 64 -1.844 13.138 -1.255 1.00 0.00 C ATOM 917 CZ PHE A 64 -1.787 14.149 -2.226 1.00 0.00 C ATOM 0 H PHE A 64 -3.815 7.936 -3.695 1.00 0.00 H new ATOM 0 HA PHE A 64 -4.415 10.650 -4.500 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.248 9.674 -2.437 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.855 9.456 -3.477 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.380 12.262 -5.003 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.029 11.019 -0.897 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.922 14.605 -4.330 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.730 13.386 -0.210 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.600 15.171 -1.932 1.00 0.00 H new ATOM 927 N ASN A 65 -3.558 10.782 -6.784 1.00 0.00 N ATOM 928 CA ASN A 65 -3.054 11.009 -8.136 1.00 0.00 C ATOM 929 C ASN A 65 -1.948 12.081 -8.092 1.00 0.00 C ATOM 930 O ASN A 65 -2.162 13.088 -7.423 1.00 0.00 O ATOM 931 CB ASN A 65 -4.231 11.413 -9.045 1.00 0.00 C ATOM 932 CG ASN A 65 -4.182 10.670 -10.375 1.00 0.00 C ATOM 933 OD1 ASN A 65 -3.116 10.514 -10.953 1.00 0.00 O ATOM 934 ND2 ASN A 65 -5.307 10.181 -10.883 1.00 0.00 N ATOM 0 H ASN A 65 -4.401 11.318 -6.576 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.612 10.102 -8.548 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -5.173 11.199 -8.541 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -4.203 12.488 -9.225 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.288 9.669 -11.765 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -6.190 10.318 -10.391 1.00 0.00 H new ATOM 941 N PRO A 66 -0.772 11.911 -8.734 1.00 0.00 N ATOM 942 CA PRO A 66 0.327 12.853 -8.590 1.00 0.00 C ATOM 943 C PRO A 66 0.108 14.049 -9.508 1.00 0.00 C ATOM 944 O PRO A 66 -0.107 15.164 -9.044 1.00 0.00 O ATOM 945 CB PRO A 66 1.603 12.087 -8.955 1.00 0.00 C ATOM 946 CG PRO A 66 1.138 10.903 -9.805 1.00 0.00 C ATOM 947 CD PRO A 66 -0.379 10.820 -9.608 1.00 0.00 C ATOM 0 HA PRO A 66 0.399 13.244 -7.575 1.00 0.00 H new ATOM 0 HB2 PRO A 66 2.296 12.720 -9.509 1.00 0.00 H new ATOM 0 HB3 PRO A 66 2.126 11.747 -8.061 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.389 11.053 -10.855 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.625 9.980 -9.490 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -0.893 10.893 -10.566 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.656 9.861 -9.170 1.00 0.00 H new ATOM 955 N LEU A 67 0.169 13.800 -10.819 1.00 0.00 N ATOM 956 CA LEU A 67 -0.032 14.808 -11.852 1.00 0.00 C ATOM 957 C LEU A 67 -1.232 14.461 -12.737 1.00 0.00 C ATOM 958 O LEU A 67 -1.355 14.999 -13.833 1.00 0.00 O ATOM 959 CB LEU A 67 1.261 14.981 -12.667 1.00 0.00 C ATOM 960 CG LEU A 67 1.605 13.769 -13.558 1.00 0.00 C ATOM 961 CD1 LEU A 67 1.809 14.226 -15.008 1.00 0.00 C ATOM 962 CD2 LEU A 67 2.875 13.065 -13.069 1.00 0.00 C ATOM 0 H LEU A 67 0.364 12.872 -11.195 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.263 15.763 -11.379 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.167 15.867 -13.296 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.089 15.163 -11.982 1.00 0.00 H new ATOM 0 HG LEU A 67 0.773 13.067 -13.503 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.051 13.365 -15.630 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.895 14.693 -15.375 1.00 0.00 H new ATOM 0 HD13 LEU A 67 2.626 14.946 -15.051 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.092 12.215 -13.716 1.00 0.00 H new ATOM 0 HD22 LEU A 67 3.711 13.764 -13.095 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.726 12.714 -12.048 1.00 0.00 H new ATOM 974 N SER A 68 -2.103 13.558 -12.268 1.00 0.00 N ATOM 975 CA SER A 68 -3.253 13.051 -13.012 1.00 0.00 C ATOM 976 C SER A 68 -2.824 12.004 -14.051 1.00 0.00 C ATOM 977 O SER A 68 -2.379 12.344 -15.145 1.00 0.00 O ATOM 978 CB SER A 68 -4.092 14.186 -13.625 1.00 0.00 C ATOM 979 OG SER A 68 -5.398 13.723 -13.909 1.00 0.00 O ATOM 0 H SER A 68 -2.021 13.152 -11.336 1.00 0.00 H new ATOM 0 HA SER A 68 -3.908 12.545 -12.302 1.00 0.00 H new ATOM 0 HB2 SER A 68 -4.138 15.029 -12.935 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.619 14.547 -14.538 1.00 0.00 H new ATOM 0 HG SER A 68 -5.926 14.452 -14.297 1.00 0.00 H new ATOM 985 N ARG A 69 -2.985 10.724 -13.714 1.00 0.00 N ATOM 986 CA ARG A 69 -2.825 9.573 -14.594 1.00 0.00 C ATOM 987 C ARG A 69 -3.776 8.477 -14.115 1.00 0.00 C ATOM 988 O ARG A 69 -4.462 8.644 -13.102 1.00 0.00 O ATOM 989 CB ARG A 69 -1.363 9.088 -14.621 1.00 0.00 C ATOM 990 CG ARG A 69 -0.796 8.781 -13.225 1.00 0.00 C ATOM 991 CD ARG A 69 0.674 9.196 -13.137 1.00 0.00 C ATOM 992 NE ARG A 69 1.529 8.416 -14.048 1.00 0.00 N ATOM 993 CZ ARG A 69 2.866 8.539 -14.102 1.00 0.00 C ATOM 994 NH1 ARG A 69 3.482 9.409 -13.293 1.00 0.00 N ATOM 995 NH2 ARG A 69 3.589 7.808 -14.955 1.00 0.00 N ATOM 0 H ARG A 69 -3.245 10.451 -12.766 1.00 0.00 H new ATOM 0 HA ARG A 69 -3.072 9.849 -15.619 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -1.297 8.191 -15.237 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.744 9.849 -15.097 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -1.375 9.310 -12.467 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.892 7.716 -13.014 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.765 10.256 -13.375 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.025 9.068 -12.113 1.00 0.00 H new ATOM 0 HE ARG A 69 1.081 7.745 -14.673 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.937 9.973 -12.641 1.00 0.00 H new ATOM 0 HH12 ARG A 69 4.497 9.508 -13.328 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.127 7.145 -15.577 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.603 7.913 -14.984 1.00 0.00 H new ATOM 1009 N LYS A 70 -3.824 7.359 -14.839 1.00 0.00 N ATOM 1010 CA LYS A 70 -4.589 6.199 -14.460 1.00 0.00 C ATOM 1011 C LYS A 70 -3.819 5.350 -13.447 1.00 0.00 C ATOM 1012 O LYS A 70 -2.650 5.598 -13.151 1.00 0.00 O ATOM 1013 CB LYS A 70 -4.868 5.411 -15.732 1.00 0.00 C ATOM 1014 CG LYS A 70 -5.836 6.154 -16.658 1.00 0.00 C ATOM 1015 CD LYS A 70 -5.958 5.409 -17.990 1.00 0.00 C ATOM 1016 CE LYS A 70 -6.953 6.116 -18.917 1.00 0.00 C ATOM 1017 NZ LYS A 70 -6.900 5.561 -20.284 1.00 0.00 N ATOM 0 H LYS A 70 -3.320 7.245 -15.718 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.523 6.492 -13.981 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.931 5.225 -16.258 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.286 4.438 -15.473 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.815 6.235 -16.186 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.480 7.170 -16.831 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.982 5.352 -18.472 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.285 4.385 -17.811 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -7.962 6.011 -18.519 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.731 7.183 -18.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.584 6.060 -20.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -5.943 5.683 -20.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.136 4.548 -20.257 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.521 4.363 -12.894 1.00 0.00 N ATOM 1032 CA HIS A 71 -4.005 3.457 -11.888 1.00 0.00 C ATOM 1033 C HIS A 71 -3.042 2.437 -12.494 1.00 0.00 C ATOM 1034 O HIS A 71 -3.174 2.090 -13.666 1.00 0.00 O ATOM 1035 CB HIS A 71 -5.200 2.725 -11.275 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.819 1.829 -10.141 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -4.017 2.143 -9.047 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -5.024 0.489 -10.091 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.595 0.995 -8.501 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.313 0.020 -9.040 1.00 0.00 N ATOM 0 H HIS A 71 -5.491 4.172 -13.145 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.453 4.023 -11.138 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.926 3.458 -10.923 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.692 2.134 -12.048 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.638 -0.093 -10.763 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.816 0.885 -7.761 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.327 -0.945 -8.710 1.00 0.00 H new ATOM 1048 N GLY A 72 -2.144 1.900 -11.663 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.356 0.724 -11.991 1.00 0.00 C ATOM 1050 C GLY A 72 -0.486 0.349 -10.802 1.00 0.00 C ATOM 1051 O GLY A 72 -0.922 0.514 -9.665 1.00 0.00 O ATOM 0 H GLY A 72 -1.947 2.278 -10.736 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -2.013 -0.106 -12.251 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.733 0.922 -12.863 1.00 0.00 H new ATOM 1055 N GLY A 73 0.726 -0.143 -11.048 1.00 0.00 N ATOM 1056 CA GLY A 73 1.666 -0.585 -10.026 1.00 0.00 C ATOM 1057 C GLY A 73 3.043 0.051 -10.220 1.00 0.00 C ATOM 1058 O GLY A 73 3.271 0.761 -11.202 1.00 0.00 O ATOM 0 H GLY A 73 1.091 -0.247 -11.995 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.281 -0.327 -9.040 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.757 -1.671 -10.059 1.00 0.00 H new ATOM 1062 N PRO A 74 4.009 -0.275 -9.345 1.00 0.00 N ATOM 1063 CA PRO A 74 5.372 0.234 -9.422 1.00 0.00 C ATOM 1064 C PRO A 74 6.113 -0.232 -10.684 1.00 0.00 C ATOM 1065 O PRO A 74 7.218 0.238 -10.946 1.00 0.00 O ATOM 1066 CB PRO A 74 6.056 -0.239 -8.135 1.00 0.00 C ATOM 1067 CG PRO A 74 5.293 -1.512 -7.769 1.00 0.00 C ATOM 1068 CD PRO A 74 3.869 -1.206 -8.236 1.00 0.00 C ATOM 0 HA PRO A 74 5.380 1.321 -9.502 1.00 0.00 H new ATOM 0 HB2 PRO A 74 7.116 -0.439 -8.294 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.988 0.510 -7.346 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.703 -2.387 -8.272 1.00 0.00 H new ATOM 0 HG3 PRO A 74 5.332 -1.712 -6.698 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.356 -2.115 -8.551 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.278 -0.769 -7.431 1.00 0.00 H new ATOM 1076 N LYS A 75 5.525 -1.148 -11.465 1.00 0.00 N ATOM 1077 CA LYS A 75 6.076 -1.624 -12.726 1.00 0.00 C ATOM 1078 C LYS A 75 5.238 -1.210 -13.944 1.00 0.00 C ATOM 1079 O LYS A 75 5.638 -1.550 -15.056 1.00 0.00 O ATOM 1080 CB LYS A 75 6.280 -3.148 -12.632 1.00 0.00 C ATOM 1081 CG LYS A 75 7.630 -3.453 -11.968 1.00 0.00 C ATOM 1082 CD LYS A 75 8.764 -3.381 -13.009 1.00 0.00 C ATOM 1083 CE LYS A 75 10.031 -2.682 -12.492 1.00 0.00 C ATOM 1084 NZ LYS A 75 10.583 -3.316 -11.276 1.00 0.00 N ATOM 0 H LYS A 75 4.634 -1.584 -11.226 1.00 0.00 H new ATOM 0 HA LYS A 75 7.041 -1.145 -12.889 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.471 -3.597 -12.056 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.246 -3.591 -13.628 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.818 -2.740 -11.165 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.605 -4.444 -11.515 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.020 -4.392 -13.325 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.403 -2.853 -13.892 1.00 0.00 H new ATOM 0 HE2 LYS A 75 10.789 -2.689 -13.275 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.802 -1.638 -12.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.463 -2.835 -11.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 9.893 -3.241 -10.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 10.782 -4.319 -11.467 1.00 0.00 H new ATOM 1098 N ASP A 76 4.139 -0.457 -13.778 1.00 0.00 N ATOM 1099 CA ASP A 76 3.393 0.063 -14.920 1.00 0.00 C ATOM 1100 C ASP A 76 3.908 1.454 -15.253 1.00 0.00 C ATOM 1101 O ASP A 76 4.587 2.094 -14.446 1.00 0.00 O ATOM 1102 CB ASP A 76 1.896 0.161 -14.618 1.00 0.00 C ATOM 1103 CG ASP A 76 1.228 -1.186 -14.436 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.382 -2.048 -15.326 1.00 0.00 O ATOM 1105 OD2 ASP A 76 0.549 -1.310 -13.399 1.00 0.00 O ATOM 0 H ASP A 76 3.755 -0.200 -12.869 1.00 0.00 H new ATOM 0 HA ASP A 76 3.534 -0.622 -15.756 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.754 0.754 -13.714 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.404 0.695 -15.430 1.00 0.00 H new ATOM 1110 N GLU A 77 3.534 1.947 -16.427 1.00 0.00 N ATOM 1111 CA GLU A 77 3.797 3.296 -16.900 1.00 0.00 C ATOM 1112 C GLU A 77 2.789 4.271 -16.286 1.00 0.00 C ATOM 1113 O GLU A 77 3.127 5.413 -15.973 1.00 0.00 O ATOM 1114 CB GLU A 77 3.713 3.340 -18.433 1.00 0.00 C ATOM 1115 CG GLU A 77 4.573 2.257 -19.108 1.00 0.00 C ATOM 1116 CD GLU A 77 3.851 0.924 -19.300 1.00 0.00 C ATOM 1117 OE1 GLU A 77 2.794 0.734 -18.653 1.00 0.00 O ATOM 1118 OE2 GLU A 77 4.375 0.119 -20.097 1.00 0.00 O ATOM 0 H GLU A 77 3.015 1.389 -17.105 1.00 0.00 H new ATOM 0 HA GLU A 77 4.801 3.591 -16.595 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.674 3.216 -18.739 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.033 4.322 -18.782 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.904 2.623 -20.080 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.468 2.091 -18.508 1.00 0.00 H new ATOM 1125 N GLU A 78 1.553 3.810 -16.108 1.00 0.00 N ATOM 1126 CA GLU A 78 0.478 4.561 -15.480 1.00 0.00 C ATOM 1127 C GLU A 78 0.363 4.030 -14.066 1.00 0.00 C ATOM 1128 O GLU A 78 -0.053 2.898 -13.866 1.00 0.00 O ATOM 1129 CB GLU A 78 -0.828 4.372 -16.255 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.836 5.316 -17.459 1.00 0.00 C ATOM 1131 CD GLU A 78 -2.157 5.253 -18.211 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -2.559 4.128 -18.587 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -2.775 6.331 -18.348 1.00 0.00 O ATOM 0 H GLU A 78 1.268 2.877 -16.406 1.00 0.00 H new ATOM 0 HA GLU A 78 0.683 5.631 -15.475 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.922 3.338 -16.587 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.682 4.578 -15.609 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.656 6.337 -17.123 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.020 5.054 -18.133 1.00 0.00 H new ATOM 1140 N ARG A 79 0.787 4.836 -13.100 1.00 0.00 N ATOM 1141 CA ARG A 79 0.754 4.501 -11.690 1.00 0.00 C ATOM 1142 C ARG A 79 0.518 5.814 -10.961 1.00 0.00 C ATOM 1143 O ARG A 79 1.182 6.804 -11.273 1.00 0.00 O ATOM 1144 CB ARG A 79 2.060 3.799 -11.284 1.00 0.00 C ATOM 1145 CG ARG A 79 3.250 4.747 -11.066 1.00 0.00 C ATOM 1146 CD ARG A 79 4.554 3.950 -10.974 1.00 0.00 C ATOM 1147 NE ARG A 79 5.095 3.657 -12.312 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.010 4.380 -12.977 1.00 0.00 C ATOM 1149 NH1 ARG A 79 6.520 5.495 -12.441 1.00 0.00 N ATOM 1150 NH2 ARG A 79 6.396 3.985 -14.191 1.00 0.00 N ATOM 0 H ARG A 79 1.172 5.762 -13.285 1.00 0.00 H new ATOM 0 HA ARG A 79 -0.038 3.796 -11.437 1.00 0.00 H new ATOM 0 HB2 ARG A 79 1.886 3.237 -10.366 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.324 3.076 -12.055 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.310 5.462 -11.887 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.102 5.323 -10.152 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.288 4.514 -10.398 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.376 3.017 -10.439 1.00 0.00 H new ATOM 0 HE ARG A 79 4.740 2.823 -12.779 1.00 0.00 H new ATOM 0 HH11 ARG A 79 6.214 5.803 -11.518 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.215 6.037 -12.955 1.00 0.00 H new ATOM 0 HH21 ARG A 79 5.997 3.142 -14.604 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.090 4.526 -14.706 1.00 0.00 H new ATOM 1164 N HIS A 80 -0.443 5.860 -10.041 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.667 7.049 -9.239 1.00 0.00 C ATOM 1166 C HIS A 80 0.491 7.227 -8.242 1.00 0.00 C ATOM 1167 O HIS A 80 1.389 6.387 -8.187 1.00 0.00 O ATOM 1168 CB HIS A 80 -2.008 6.967 -8.511 1.00 0.00 C ATOM 1169 CG HIS A 80 -3.215 6.580 -9.327 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -4.133 5.585 -9.003 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -3.677 7.179 -10.463 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -5.203 5.752 -9.795 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -4.890 6.620 -10.757 1.00 0.00 N ATOM 0 H HIS A 80 -1.075 5.086 -9.836 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.701 7.918 -9.896 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.907 6.249 -7.697 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -2.205 7.938 -8.057 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.176 7.953 -11.026 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -6.159 5.264 -9.673 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -5.460 6.832 -11.576 1.00 0.00 H new ATOM 1181 N VAL A 81 0.486 8.301 -7.436 1.00 0.00 N ATOM 1182 CA VAL A 81 1.634 8.609 -6.579 1.00 0.00 C ATOM 1183 C VAL A 81 1.898 7.465 -5.601 1.00 0.00 C ATOM 1184 O VAL A 81 3.043 7.108 -5.339 1.00 0.00 O ATOM 1185 CB VAL A 81 1.454 9.966 -5.865 1.00 0.00 C ATOM 1186 CG1 VAL A 81 0.716 9.891 -4.524 1.00 0.00 C ATOM 1187 CG2 VAL A 81 2.817 10.607 -5.585 1.00 0.00 C ATOM 0 H VAL A 81 -0.289 8.960 -7.362 1.00 0.00 H new ATOM 0 HA VAL A 81 2.518 8.706 -7.209 1.00 0.00 H new ATOM 0 HB VAL A 81 0.848 10.555 -6.553 1.00 0.00 H new ATOM 0 HG11 VAL A 81 0.636 10.890 -4.096 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -0.282 9.483 -4.681 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.268 9.246 -3.840 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.673 11.563 -5.081 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.406 9.947 -4.948 1.00 0.00 H new ATOM 0 HG23 VAL A 81 3.343 10.768 -6.526 1.00 0.00 H new ATOM 1197 N GLY A 82 0.815 6.897 -5.066 1.00 0.00 N ATOM 1198 CA GLY A 82 0.860 5.893 -4.027 1.00 0.00 C ATOM 1199 C GLY A 82 0.353 4.549 -4.513 1.00 0.00 C ATOM 1200 O GLY A 82 -0.388 3.896 -3.782 1.00 0.00 O ATOM 0 H GLY A 82 -0.133 7.135 -5.357 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.884 5.786 -3.670 1.00 0.00 H new ATOM 0 HA3 GLY A 82 0.259 6.222 -3.179 1.00 0.00 H new ATOM 1204 N ASP A 83 0.741 4.133 -5.721 1.00 0.00 N ATOM 1205 CA ASP A 83 0.345 2.855 -6.287 1.00 0.00 C ATOM 1206 C ASP A 83 1.443 1.819 -6.120 1.00 0.00 C ATOM 1207 O ASP A 83 2.198 1.528 -7.044 1.00 0.00 O ATOM 1208 CB ASP A 83 -0.029 3.069 -7.752 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.431 3.623 -7.895 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -2.093 3.883 -6.868 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.880 3.771 -9.048 1.00 0.00 O ATOM 0 H ASP A 83 1.344 4.683 -6.333 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.523 2.465 -5.755 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.682 3.754 -8.213 1.00 0.00 H new ATOM 0 HB3 ASP A 83 0.046 2.123 -8.289 1.00 0.00 H new ATOM 1216 N LEU A 84 1.455 1.207 -4.938 1.00 0.00 N ATOM 1217 CA LEU A 84 2.376 0.151 -4.562 1.00 0.00 C ATOM 1218 C LEU A 84 1.717 -1.211 -4.816 1.00 0.00 C ATOM 1219 O LEU A 84 1.880 -2.142 -4.033 1.00 0.00 O ATOM 1220 CB LEU A 84 2.752 0.341 -3.086 1.00 0.00 C ATOM 1221 CG LEU A 84 3.482 1.654 -2.744 1.00 0.00 C ATOM 1222 CD1 LEU A 84 4.804 1.796 -3.506 1.00 0.00 C ATOM 1223 CD2 LEU A 84 2.667 2.940 -2.897 1.00 0.00 C ATOM 0 H LEU A 84 0.799 1.445 -4.194 1.00 0.00 H new ATOM 0 HA LEU A 84 3.287 0.191 -5.159 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.842 0.287 -2.489 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.383 -0.494 -2.781 1.00 0.00 H new ATOM 0 HG LEU A 84 3.670 1.548 -1.675 1.00 0.00 H new ATOM 0 HD11 LEU A 84 5.282 2.736 -3.232 1.00 0.00 H new ATOM 0 HD12 LEU A 84 5.462 0.966 -3.250 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.609 1.787 -4.578 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.285 3.797 -2.629 1.00 0.00 H new ATOM 0 HD22 LEU A 84 2.337 3.041 -3.931 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.798 2.900 -2.241 1.00 0.00 H new ATOM 1235 N GLY A 85 0.972 -1.322 -5.924 1.00 0.00 N ATOM 1236 CA GLY A 85 0.236 -2.513 -6.320 1.00 0.00 C ATOM 1237 C GLY A 85 -0.494 -3.200 -5.161 1.00 0.00 C ATOM 1238 O GLY A 85 -1.455 -2.662 -4.606 1.00 0.00 O ATOM 0 H GLY A 85 0.867 -0.554 -6.587 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.491 -2.242 -7.086 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.928 -3.223 -6.774 1.00 0.00 H new ATOM 1242 N ASN A 86 -0.051 -4.414 -4.820 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.698 -5.293 -3.859 1.00 0.00 C ATOM 1244 C ASN A 86 0.345 -6.134 -3.130 1.00 0.00 C ATOM 1245 O ASN A 86 1.507 -6.157 -3.532 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.737 -6.180 -4.567 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.141 -7.206 -5.528 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -0.351 -8.053 -5.128 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -1.544 -7.184 -6.798 1.00 0.00 N ATOM 0 H ASN A 86 0.795 -4.819 -5.222 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.221 -4.689 -3.117 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.323 -6.705 -3.813 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.426 -5.541 -5.119 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.194 -7.880 -7.456 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.202 -6.471 -7.112 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.083 -6.810 -2.060 1.00 0.00 N ATOM 1257 CA VAL A 87 0.728 -7.733 -1.276 1.00 0.00 C ATOM 1258 C VAL A 87 -0.024 -9.053 -1.171 1.00 0.00 C ATOM 1259 O VAL A 87 -1.195 -9.098 -1.528 1.00 0.00 O ATOM 1260 CB VAL A 87 0.995 -7.131 0.109 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.683 -5.775 -0.086 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.294 -7.021 0.940 1.00 0.00 C ATOM 0 H VAL A 87 -1.036 -6.724 -1.708 1.00 0.00 H new ATOM 0 HA VAL A 87 1.692 -7.908 -1.754 1.00 0.00 H new ATOM 0 HB VAL A 87 1.652 -7.788 0.680 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.884 -5.326 0.887 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.622 -5.917 -0.621 1.00 0.00 H new ATOM 0 HG13 VAL A 87 1.033 -5.117 -0.662 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.063 -6.590 1.914 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.008 -6.382 0.421 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.726 -8.013 1.075 1.00 0.00 H new ATOM 1272 N THR A 88 0.620 -10.099 -0.654 1.00 0.00 N ATOM 1273 CA THR A 88 0.061 -11.447 -0.544 1.00 0.00 C ATOM 1274 C THR A 88 -0.114 -11.785 0.935 1.00 0.00 C ATOM 1275 O THR A 88 0.872 -11.800 1.664 1.00 0.00 O ATOM 1276 CB THR A 88 1.033 -12.426 -1.221 1.00 0.00 C ATOM 1277 OG1 THR A 88 1.337 -11.964 -2.522 1.00 0.00 O ATOM 1278 CG2 THR A 88 0.453 -13.837 -1.349 1.00 0.00 C ATOM 0 H THR A 88 1.570 -10.031 -0.290 1.00 0.00 H new ATOM 0 HA THR A 88 -0.911 -11.515 -1.033 1.00 0.00 H new ATOM 0 HB THR A 88 1.922 -12.473 -0.592 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.958 -12.587 -2.954 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.181 -14.487 -1.834 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.222 -14.227 -0.358 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.458 -13.803 -1.947 1.00 0.00 H new ATOM 1286 N ALA A 89 -1.343 -12.056 1.385 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.563 -12.608 2.714 1.00 0.00 C ATOM 1288 C ALA A 89 -1.301 -14.106 2.711 1.00 0.00 C ATOM 1289 O ALA A 89 -1.668 -14.799 1.760 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.982 -12.330 3.199 1.00 0.00 C ATOM 0 H ALA A 89 -2.195 -11.901 0.846 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.867 -12.122 3.398 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.116 -12.754 4.194 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -3.149 -11.254 3.238 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.697 -12.783 2.512 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.700 -14.576 3.804 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.440 -15.972 4.075 1.00 0.00 C ATOM 1298 C ASP A 90 -1.706 -16.677 4.552 1.00 0.00 C ATOM 1299 O ASP A 90 -2.712 -16.036 4.853 1.00 0.00 O ATOM 1300 CB ASP A 90 0.708 -16.102 5.099 1.00 0.00 C ATOM 1301 CG ASP A 90 1.477 -17.397 4.907 1.00 0.00 C ATOM 1302 OD1 ASP A 90 1.042 -18.212 4.069 1.00 0.00 O ATOM 1303 OD2 ASP A 90 2.483 -17.648 5.599 1.00 0.00 O ATOM 0 H ASP A 90 -0.371 -13.962 4.549 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.129 -16.462 3.153 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.387 -15.255 4.996 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.302 -16.064 6.110 1.00 0.00 H new ATOM 1308 N LYS A 91 -1.624 -17.997 4.710 1.00 0.00 N ATOM 1309 CA LYS A 91 -2.674 -18.849 5.237 1.00 0.00 C ATOM 1310 C LYS A 91 -3.093 -18.435 6.651 1.00 0.00 C ATOM 1311 O LYS A 91 -4.176 -18.800 7.101 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.219 -20.315 5.171 1.00 0.00 C ATOM 1313 CG LYS A 91 -0.892 -20.625 5.887 1.00 0.00 C ATOM 1314 CD LYS A 91 0.233 -20.946 4.889 1.00 0.00 C ATOM 1315 CE LYS A 91 1.615 -20.765 5.549 1.00 0.00 C ATOM 1316 NZ LYS A 91 2.622 -20.233 4.608 1.00 0.00 N ATOM 0 H LYS A 91 -0.784 -18.519 4.461 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.565 -18.733 4.620 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.000 -20.940 5.603 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.123 -20.602 4.124 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.602 -19.772 6.500 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.032 -21.470 6.562 1.00 0.00 H new ATOM 0 HD2 LYS A 91 0.127 -21.970 4.531 1.00 0.00 H new ATOM 0 HD3 LYS A 91 0.152 -20.294 4.019 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.523 -20.089 6.399 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.957 -21.724 5.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 3.385 -19.770 5.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 3.017 -21.013 4.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.174 -19.541 3.974 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.240 -17.675 7.348 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.525 -17.187 8.698 1.00 0.00 C ATOM 1332 C ASP A 92 -3.318 -15.878 8.644 1.00 0.00 C ATOM 1333 O ASP A 92 -3.882 -15.431 9.641 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.213 -16.985 9.466 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.459 -16.940 10.973 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -1.587 -18.042 11.548 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.508 -15.821 11.531 1.00 0.00 O ATOM 0 H ASP A 92 -1.331 -17.382 6.989 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.130 -17.930 9.218 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.522 -17.795 9.231 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -0.739 -16.058 9.144 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.340 -15.243 7.470 1.00 0.00 N ATOM 1343 CA GLY A 93 -3.959 -13.943 7.295 1.00 0.00 C ATOM 1344 C GLY A 93 -3.029 -12.808 7.730 1.00 0.00 C ATOM 1345 O GLY A 93 -3.486 -11.745 8.172 1.00 0.00 O ATOM 0 H GLY A 93 -2.927 -15.622 6.618 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.232 -13.808 6.248 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.882 -13.899 7.873 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.719 -13.041 7.567 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.653 -12.058 7.705 1.00 0.00 C ATOM 1351 C VAL A 94 -0.110 -11.795 6.305 1.00 0.00 C ATOM 1352 O VAL A 94 0.298 -12.747 5.651 1.00 0.00 O ATOM 1353 CB VAL A 94 0.453 -12.611 8.626 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.589 -11.598 8.862 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.149 -13.015 9.976 1.00 0.00 C ATOM 0 H VAL A 94 -1.365 -13.966 7.324 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.020 -11.134 8.151 1.00 0.00 H new ATOM 0 HB VAL A 94 0.882 -13.478 8.123 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.340 -12.040 9.517 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.048 -11.337 7.908 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.184 -10.700 9.328 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.637 -13.405 10.623 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.607 -12.144 10.446 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.906 -13.784 9.821 1.00 0.00 H new ATOM 1365 N ALA A 95 -0.109 -10.545 5.833 1.00 0.00 N ATOM 1366 CA ALA A 95 0.586 -10.173 4.608 1.00 0.00 C ATOM 1367 C ALA A 95 1.794 -9.357 5.020 1.00 0.00 C ATOM 1368 O ALA A 95 1.637 -8.198 5.411 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.299 -9.368 3.647 1.00 0.00 C ATOM 0 H ALA A 95 -0.589 -9.770 6.290 1.00 0.00 H new ATOM 0 HA ALA A 95 0.872 -11.074 4.065 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.270 -9.118 2.752 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.169 -9.963 3.370 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.627 -8.451 4.136 1.00 0.00 H new ATOM 1375 N ASP A 96 2.972 -9.972 4.968 1.00 0.00 N ATOM 1376 CA ASP A 96 4.236 -9.277 5.066 1.00 0.00 C ATOM 1377 C ASP A 96 4.443 -8.501 3.767 1.00 0.00 C ATOM 1378 O ASP A 96 4.057 -8.956 2.690 1.00 0.00 O ATOM 1379 CB ASP A 96 5.369 -10.273 5.349 1.00 0.00 C ATOM 1380 CG ASP A 96 5.472 -11.368 4.294 1.00 0.00 C ATOM 1381 OD1 ASP A 96 4.423 -12.009 4.053 1.00 0.00 O ATOM 1382 OD2 ASP A 96 6.592 -11.555 3.776 1.00 0.00 O ATOM 0 H ASP A 96 3.069 -10.981 4.855 1.00 0.00 H new ATOM 0 HA ASP A 96 4.237 -8.573 5.898 1.00 0.00 H new ATOM 0 HB2 ASP A 96 6.315 -9.734 5.400 1.00 0.00 H new ATOM 0 HB3 ASP A 96 5.209 -10.730 6.326 1.00 0.00 H new ATOM 1387 N VAL A 97 4.997 -7.294 3.875 1.00 0.00 N ATOM 1388 CA VAL A 97 5.342 -6.458 2.733 1.00 0.00 C ATOM 1389 C VAL A 97 6.831 -6.176 2.822 1.00 0.00 C ATOM 1390 O VAL A 97 7.354 -6.080 3.930 1.00 0.00 O ATOM 1391 CB VAL A 97 4.541 -5.142 2.728 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.620 -4.466 1.352 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.096 -5.360 3.194 1.00 0.00 C ATOM 0 H VAL A 97 5.221 -6.866 4.773 1.00 0.00 H new ATOM 0 HA VAL A 97 5.094 -6.973 1.805 1.00 0.00 H new ATOM 0 HB VAL A 97 4.995 -4.462 3.449 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.048 -3.538 1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.661 -4.246 1.114 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.207 -5.133 0.595 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.561 -4.410 3.178 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.601 -6.066 2.527 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.097 -5.758 4.209 1.00 0.00 H new ATOM 1403 N SER A 98 7.486 -6.031 1.671 1.00 0.00 N ATOM 1404 CA SER A 98 8.914 -5.799 1.536 1.00 0.00 C ATOM 1405 C SER A 98 9.184 -5.356 0.096 1.00 0.00 C ATOM 1406 O SER A 98 9.546 -6.184 -0.739 1.00 0.00 O ATOM 1407 CB SER A 98 9.674 -7.091 1.875 1.00 0.00 C ATOM 1408 OG SER A 98 9.225 -8.157 1.060 1.00 0.00 O ATOM 0 H SER A 98 7.010 -6.075 0.770 1.00 0.00 H new ATOM 0 HA SER A 98 9.255 -5.023 2.221 1.00 0.00 H new ATOM 0 HB2 SER A 98 10.744 -6.940 1.730 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.527 -7.342 2.926 1.00 0.00 H new ATOM 0 HG SER A 98 9.262 -7.887 0.119 1.00 0.00 H new ATOM 1414 N ILE A 99 8.970 -4.075 -0.205 1.00 0.00 N ATOM 1415 CA ILE A 99 9.230 -3.491 -1.519 1.00 0.00 C ATOM 1416 C ILE A 99 10.048 -2.212 -1.322 1.00 0.00 C ATOM 1417 O ILE A 99 10.286 -1.810 -0.183 1.00 0.00 O ATOM 1418 CB ILE A 99 7.903 -3.326 -2.296 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.136 -3.031 -3.788 1.00 0.00 C ATOM 1420 CG2 ILE A 99 6.978 -2.271 -1.679 1.00 0.00 C ATOM 1421 CD1 ILE A 99 6.917 -3.369 -4.652 1.00 0.00 C ATOM 0 H ILE A 99 8.605 -3.403 0.470 1.00 0.00 H new ATOM 0 HA ILE A 99 9.833 -4.143 -2.151 1.00 0.00 H new ATOM 0 HB ILE A 99 7.398 -4.288 -2.215 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.384 -1.977 -3.912 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.995 -3.603 -4.138 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.063 -2.200 -2.268 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.731 -2.557 -0.657 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.481 -1.304 -1.673 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.136 -3.142 -5.695 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.684 -4.429 -4.553 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.063 -2.777 -4.323 1.00 0.00 H new ATOM 1433 N GLU A 100 10.538 -1.608 -2.405 1.00 0.00 N ATOM 1434 CA GLU A 100 11.424 -0.458 -2.366 1.00 0.00 C ATOM 1435 C GLU A 100 11.048 0.473 -3.517 1.00 0.00 C ATOM 1436 O GLU A 100 10.750 -0.016 -4.609 1.00 0.00 O ATOM 1437 CB GLU A 100 12.876 -0.956 -2.463 1.00 0.00 C ATOM 1438 CG GLU A 100 13.898 0.135 -2.814 1.00 0.00 C ATOM 1439 CD GLU A 100 15.313 -0.343 -2.545 1.00 0.00 C ATOM 1440 OE1 GLU A 100 15.614 -0.532 -1.346 1.00 0.00 O ATOM 1441 OE2 GLU A 100 16.074 -0.517 -3.515 1.00 0.00 O ATOM 0 H GLU A 100 10.321 -1.917 -3.353 1.00 0.00 H new ATOM 0 HA GLU A 100 11.327 0.101 -1.435 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.157 -1.407 -1.511 1.00 0.00 H new ATOM 0 HB3 GLU A 100 12.928 -1.742 -3.216 1.00 0.00 H new ATOM 0 HG2 GLU A 100 13.796 0.410 -3.864 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.695 1.031 -2.228 1.00 0.00 H new ATOM 1448 N ASP A 101 11.074 1.788 -3.271 1.00 0.00 N ATOM 1449 CA ASP A 101 10.742 2.814 -4.249 1.00 0.00 C ATOM 1450 C ASP A 101 11.752 3.954 -4.141 1.00 0.00 C ATOM 1451 O ASP A 101 12.422 4.101 -3.122 1.00 0.00 O ATOM 1452 CB ASP A 101 9.330 3.353 -3.993 1.00 0.00 C ATOM 1453 CG ASP A 101 8.249 2.351 -4.370 1.00 0.00 C ATOM 1454 OD1 ASP A 101 7.919 1.515 -3.503 1.00 0.00 O ATOM 1455 OD2 ASP A 101 7.763 2.460 -5.518 1.00 0.00 O ATOM 0 H ASP A 101 11.334 2.171 -2.362 1.00 0.00 H new ATOM 0 HA ASP A 101 10.777 2.381 -5.249 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.229 3.613 -2.939 1.00 0.00 H new ATOM 0 HB3 ASP A 101 9.186 4.271 -4.563 1.00 0.00 H new ATOM 1460 N SER A 102 11.843 4.768 -5.197 1.00 0.00 N ATOM 1461 CA SER A 102 12.684 5.958 -5.257 1.00 0.00 C ATOM 1462 C SER A 102 11.868 7.245 -5.436 1.00 0.00 C ATOM 1463 O SER A 102 12.451 8.321 -5.518 1.00 0.00 O ATOM 1464 CB SER A 102 13.692 5.813 -6.402 1.00 0.00 C ATOM 1465 OG SER A 102 14.435 4.618 -6.260 1.00 0.00 O ATOM 0 H SER A 102 11.317 4.609 -6.056 1.00 0.00 H new ATOM 0 HA SER A 102 13.206 6.041 -4.304 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.168 5.811 -7.358 1.00 0.00 H new ATOM 0 HB3 SER A 102 14.367 6.669 -6.411 1.00 0.00 H new ATOM 0 HG SER A 102 15.073 4.540 -7.000 1.00 0.00 H new ATOM 1471 N VAL A 103 10.540 7.139 -5.561 1.00 0.00 N ATOM 1472 CA VAL A 103 9.671 8.278 -5.833 1.00 0.00 C ATOM 1473 C VAL A 103 9.139 8.824 -4.510 1.00 0.00 C ATOM 1474 O VAL A 103 9.416 9.965 -4.148 1.00 0.00 O ATOM 1475 CB VAL A 103 8.553 7.859 -6.806 1.00 0.00 C ATOM 1476 CG1 VAL A 103 7.545 8.993 -7.025 1.00 0.00 C ATOM 1477 CG2 VAL A 103 9.162 7.476 -8.163 1.00 0.00 C ATOM 0 H VAL A 103 10.040 6.254 -5.475 1.00 0.00 H new ATOM 0 HA VAL A 103 10.224 9.082 -6.320 1.00 0.00 H new ATOM 0 HB VAL A 103 8.034 7.008 -6.365 1.00 0.00 H new ATOM 0 HG11 VAL A 103 6.770 8.663 -7.717 1.00 0.00 H new ATOM 0 HG12 VAL A 103 7.090 9.264 -6.073 1.00 0.00 H new ATOM 0 HG13 VAL A 103 8.058 9.860 -7.442 1.00 0.00 H new ATOM 0 HG21 VAL A 103 8.367 7.180 -8.848 1.00 0.00 H new ATOM 0 HG22 VAL A 103 9.697 8.331 -8.576 1.00 0.00 H new ATOM 0 HG23 VAL A 103 9.854 6.645 -8.030 1.00 0.00 H new ATOM 1487 N ILE A 104 8.368 8.008 -3.785 1.00 0.00 N ATOM 1488 CA ILE A 104 7.911 8.341 -2.457 1.00 0.00 C ATOM 1489 C ILE A 104 9.120 8.472 -1.510 1.00 0.00 C ATOM 1490 O ILE A 104 10.193 7.947 -1.800 1.00 0.00 O ATOM 1491 CB ILE A 104 6.813 7.343 -2.038 1.00 0.00 C ATOM 1492 CG1 ILE A 104 7.134 5.837 -2.118 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.554 7.594 -2.887 1.00 0.00 C ATOM 1494 CD1 ILE A 104 8.155 5.373 -1.081 1.00 0.00 C ATOM 0 H ILE A 104 8.049 7.097 -4.115 1.00 0.00 H new ATOM 0 HA ILE A 104 7.431 9.319 -2.415 1.00 0.00 H new ATOM 0 HB ILE A 104 6.689 7.545 -0.974 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.212 5.270 -1.987 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.511 5.607 -3.115 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.773 6.892 -2.596 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.204 8.613 -2.726 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.793 7.455 -3.941 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.331 4.304 -1.197 1.00 0.00 H new ATOM 0 HD12 ILE A 104 9.091 5.913 -1.225 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.772 5.571 -0.080 1.00 0.00 H new ATOM 1506 N SER A 105 8.991 9.242 -0.425 1.00 0.00 N ATOM 1507 CA SER A 105 10.060 9.581 0.505 1.00 0.00 C ATOM 1508 C SER A 105 9.407 10.108 1.772 1.00 0.00 C ATOM 1509 O SER A 105 8.261 10.546 1.717 1.00 0.00 O ATOM 1510 CB SER A 105 11.012 10.609 -0.119 1.00 0.00 C ATOM 1511 OG SER A 105 11.896 9.965 -1.014 1.00 0.00 O ATOM 0 H SER A 105 8.098 9.661 -0.164 1.00 0.00 H new ATOM 0 HA SER A 105 10.666 8.706 0.741 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.441 11.374 -0.645 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.578 11.115 0.663 1.00 0.00 H new ATOM 0 HG SER A 105 11.501 9.119 -1.312 1.00 0.00 H new ATOM 1517 N LEU A 106 10.126 10.070 2.895 1.00 0.00 N ATOM 1518 CA LEU A 106 9.772 10.754 4.136 1.00 0.00 C ATOM 1519 C LEU A 106 10.642 12.006 4.229 1.00 0.00 C ATOM 1520 O LEU A 106 11.198 12.331 5.277 1.00 0.00 O ATOM 1521 CB LEU A 106 9.898 9.827 5.356 1.00 0.00 C ATOM 1522 CG LEU A 106 11.138 8.918 5.344 1.00 0.00 C ATOM 1523 CD1 LEU A 106 11.643 8.716 6.770 1.00 0.00 C ATOM 1524 CD2 LEU A 106 10.795 7.543 4.751 1.00 0.00 C ATOM 0 H LEU A 106 10.998 9.545 2.966 1.00 0.00 H new ATOM 0 HA LEU A 106 8.723 11.049 4.130 1.00 0.00 H new ATOM 0 HB2 LEU A 106 9.920 10.437 6.259 1.00 0.00 H new ATOM 0 HB3 LEU A 106 9.007 9.203 5.415 1.00 0.00 H new ATOM 0 HG LEU A 106 11.904 9.396 4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 106 12.522 8.071 6.757 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.907 9.681 7.202 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.861 8.251 7.371 1.00 0.00 H new ATOM 0 HD21 LEU A 106 11.685 6.914 4.751 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.018 7.071 5.352 1.00 0.00 H new ATOM 0 HD23 LEU A 106 10.438 7.666 3.728 1.00 0.00 H new ATOM 1566 N HIS A 110 7.737 14.646 -1.412 1.00 0.00 N ATOM 1567 CA HIS A 110 6.943 13.426 -1.379 1.00 0.00 C ATOM 1568 C HIS A 110 6.600 12.964 0.036 1.00 0.00 C ATOM 1569 O HIS A 110 5.732 12.104 0.165 1.00 0.00 O ATOM 1570 CB HIS A 110 7.648 12.311 -2.167 1.00 0.00 C ATOM 1571 CG HIS A 110 7.082 12.131 -3.553 1.00 0.00 C ATOM 1572 ND1 HIS A 110 7.758 12.307 -4.738 1.00 0.00 N ATOM 1573 CD2 HIS A 110 5.792 11.791 -3.858 1.00 0.00 C ATOM 1574 CE1 HIS A 110 6.883 12.096 -5.735 1.00 0.00 C ATOM 1575 NE2 HIS A 110 5.673 11.775 -5.249 1.00 0.00 N ATOM 0 HA HIS A 110 5.991 13.658 -1.856 1.00 0.00 H new ATOM 0 HB2 HIS A 110 8.711 12.540 -2.240 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.561 11.373 -1.619 1.00 0.00 H new ATOM 0 HD1 HIS A 110 8.743 12.553 -4.841 1.00 0.00 H new ATOM 0 HD2 HIS A 110 5.006 11.574 -3.149 1.00 0.00 H new ATOM 0 HE1 HIS A 110 7.121 12.174 -6.786 1.00 0.00 H new ATOM 1583 N SER A 111 7.261 13.518 1.064 1.00 0.00 N ATOM 1584 CA SER A 111 7.101 13.242 2.477 1.00 0.00 C ATOM 1585 C SER A 111 5.790 12.533 2.848 1.00 0.00 C ATOM 1586 O SER A 111 4.783 13.186 3.116 1.00 0.00 O ATOM 1587 CB SER A 111 7.267 14.579 3.191 1.00 0.00 C ATOM 1588 OG SER A 111 8.526 15.135 2.848 1.00 0.00 O ATOM 0 H SER A 111 7.977 14.227 0.902 1.00 0.00 H new ATOM 0 HA SER A 111 7.855 12.521 2.793 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.465 15.260 2.906 1.00 0.00 H new ATOM 0 HB3 SER A 111 7.199 14.440 4.270 1.00 0.00 H new ATOM 0 HG SER A 111 8.638 15.996 3.303 1.00 0.00 H new ATOM 1594 N ILE A 112 5.807 11.194 2.878 1.00 0.00 N ATOM 1595 CA ILE A 112 4.608 10.397 3.122 1.00 0.00 C ATOM 1596 C ILE A 112 4.131 10.492 4.571 1.00 0.00 C ATOM 1597 O ILE A 112 2.989 10.154 4.859 1.00 0.00 O ATOM 1598 CB ILE A 112 4.748 8.933 2.649 1.00 0.00 C ATOM 1599 CG1 ILE A 112 5.580 7.988 3.540 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.193 8.867 1.187 1.00 0.00 C ATOM 1601 CD1 ILE A 112 7.091 8.209 3.521 1.00 0.00 C ATOM 0 H ILE A 112 6.651 10.639 2.734 1.00 0.00 H new ATOM 0 HA ILE A 112 3.827 10.839 2.504 1.00 0.00 H new ATOM 0 HB ILE A 112 3.738 8.535 2.747 1.00 0.00 H new ATOM 0 HG12 ILE A 112 5.231 8.089 4.568 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.379 6.961 3.234 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.283 7.825 0.881 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.455 9.367 0.559 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.158 9.362 1.078 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.572 7.489 4.183 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.465 8.076 2.506 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.315 9.220 3.860 1.00 0.00 H new ATOM 1613 N ILE A 113 4.991 10.951 5.480 1.00 0.00 N ATOM 1614 CA ILE A 113 4.661 11.212 6.872 1.00 0.00 C ATOM 1615 C ILE A 113 3.405 12.079 6.881 1.00 0.00 C ATOM 1616 O ILE A 113 3.445 13.209 6.400 1.00 0.00 O ATOM 1617 CB ILE A 113 5.847 11.916 7.564 1.00 0.00 C ATOM 1618 CG1 ILE A 113 7.145 11.092 7.508 1.00 0.00 C ATOM 1619 CG2 ILE A 113 5.527 12.305 9.015 1.00 0.00 C ATOM 1620 CD1 ILE A 113 7.089 9.765 8.272 1.00 0.00 C ATOM 0 H ILE A 113 5.965 11.156 5.256 1.00 0.00 H new ATOM 0 HA ILE A 113 4.473 10.289 7.421 1.00 0.00 H new ATOM 0 HB ILE A 113 6.012 12.831 6.995 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.385 10.886 6.465 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.960 11.694 7.910 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.392 12.797 9.459 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.675 12.985 9.030 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.286 11.409 9.587 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.046 9.251 8.179 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.883 9.960 9.324 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.299 9.139 7.857 1.00 0.00 H new ATOM 1632 N GLY A 114 2.294 11.530 7.370 1.00 0.00 N ATOM 1633 CA GLY A 114 1.015 12.211 7.396 1.00 0.00 C ATOM 1634 C GLY A 114 -0.052 11.550 6.516 1.00 0.00 C ATOM 1635 O GLY A 114 -1.237 11.678 6.794 1.00 0.00 O ATOM 0 H GLY A 114 2.264 10.589 7.762 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.654 12.248 8.424 1.00 0.00 H new ATOM 0 HA3 GLY A 114 1.155 13.242 7.070 1.00 0.00 H new ATOM 1639 N ARG A 115 0.341 10.867 5.438 1.00 0.00 N ATOM 1640 CA ARG A 115 -0.588 10.355 4.432 1.00 0.00 C ATOM 1641 C ARG A 115 -1.495 9.241 4.967 1.00 0.00 C ATOM 1642 O ARG A 115 -1.117 8.536 5.908 1.00 0.00 O ATOM 1643 CB ARG A 115 0.208 9.781 3.258 1.00 0.00 C ATOM 1644 CG ARG A 115 0.948 10.817 2.409 1.00 0.00 C ATOM 1645 CD ARG A 115 -0.030 11.634 1.554 1.00 0.00 C ATOM 1646 NE ARG A 115 0.621 12.174 0.348 1.00 0.00 N ATOM 1647 CZ ARG A 115 1.503 13.184 0.315 1.00 0.00 C ATOM 1648 NH1 ARG A 115 1.881 13.775 1.453 1.00 0.00 N ATOM 1649 NH2 ARG A 115 1.999 13.591 -0.859 1.00 0.00 N ATOM 0 H ARG A 115 1.318 10.653 5.239 1.00 0.00 H new ATOM 0 HA ARG A 115 -1.217 11.193 4.131 1.00 0.00 H new ATOM 0 HB2 ARG A 115 0.934 9.066 3.646 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -0.474 9.226 2.614 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.514 11.485 3.058 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.668 10.315 1.763 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -0.872 11.005 1.263 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -0.435 12.454 2.147 1.00 0.00 H new ATOM 0 HE ARG A 115 0.379 11.740 -0.543 1.00 0.00 H new ATOM 0 HH11 ARG A 115 1.499 13.458 2.344 1.00 0.00 H new ATOM 0 HH12 ARG A 115 2.552 14.543 1.430 1.00 0.00 H new ATOM 0 HH21 ARG A 115 1.706 13.134 -1.722 1.00 0.00 H new ATOM 0 HH22 ARG A 115 2.670 14.359 -0.891 1.00 0.00 H new ATOM 1663 N THR A 116 -2.644 9.031 4.302 1.00 0.00 N ATOM 1664 CA THR A 116 -3.557 7.938 4.589 1.00 0.00 C ATOM 1665 C THR A 116 -3.202 6.691 3.767 1.00 0.00 C ATOM 1666 O THR A 116 -3.371 6.677 2.547 1.00 0.00 O ATOM 1667 CB THR A 116 -5.001 8.365 4.310 1.00 0.00 C ATOM 1668 OG1 THR A 116 -5.280 9.512 5.076 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.997 7.273 4.715 1.00 0.00 C ATOM 0 H THR A 116 -2.959 9.632 3.540 1.00 0.00 H new ATOM 0 HA THR A 116 -3.461 7.685 5.645 1.00 0.00 H new ATOM 0 HB THR A 116 -5.103 8.555 3.242 1.00 0.00 H new ATOM 0 HG1 THR A 116 -6.201 9.801 4.909 1.00 0.00 H new ATOM 0 HG21 THR A 116 -7.012 7.610 4.503 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.791 6.364 4.149 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.898 7.067 5.781 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.763 5.621 4.427 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.528 4.323 3.808 1.00 0.00 C ATOM 1679 C LEU A 117 -3.747 3.425 3.996 1.00 0.00 C ATOM 1680 O LEU A 117 -4.424 3.516 5.021 1.00 0.00 O ATOM 1681 CB LEU A 117 -1.277 3.682 4.423 1.00 0.00 C ATOM 1682 CG LEU A 117 -0.226 3.404 3.341 1.00 0.00 C ATOM 1683 CD1 LEU A 117 1.166 3.542 3.928 1.00 0.00 C ATOM 1684 CD2 LEU A 117 -0.364 1.996 2.766 1.00 0.00 C ATOM 0 H LEU A 117 -2.557 5.635 5.426 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.365 4.453 2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.859 4.343 5.182 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.547 2.752 4.923 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.384 4.129 2.542 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.908 3.343 3.155 1.00 0.00 H new ATOM 0 HD12 LEU A 117 1.301 4.554 4.310 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.290 2.828 4.742 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.398 1.838 2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.237 1.263 3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.352 1.880 2.321 1.00 0.00 H new ATOM 1696 N VAL A 118 -4.030 2.576 2.998 1.00 0.00 N ATOM 1697 CA VAL A 118 -5.205 1.714 2.972 1.00 0.00 C ATOM 1698 C VAL A 118 -4.839 0.368 2.338 1.00 0.00 C ATOM 1699 O VAL A 118 -4.060 0.344 1.381 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.316 2.415 2.175 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.645 1.663 2.233 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.580 3.848 2.660 1.00 0.00 C ATOM 0 H VAL A 118 -3.435 2.472 2.176 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.562 1.527 3.985 1.00 0.00 H new ATOM 0 HB VAL A 118 -5.942 2.433 1.151 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.394 2.202 1.653 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.516 0.663 1.818 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.975 1.586 3.269 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.374 4.294 2.061 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.883 3.828 3.707 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.671 4.440 2.557 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.412 -0.730 2.860 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.298 -2.076 2.313 1.00 0.00 C ATOM 1714 C VAL A 119 -6.676 -2.588 1.858 1.00 0.00 C ATOM 1715 O VAL A 119 -7.700 -2.262 2.467 1.00 0.00 O ATOM 1716 CB VAL A 119 -4.633 -3.003 3.344 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.603 -3.500 4.418 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.027 -4.206 2.629 1.00 0.00 C ATOM 0 H VAL A 119 -5.985 -0.694 3.703 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.660 -2.062 1.429 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.864 -2.416 3.847 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.073 -4.149 5.115 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.015 -2.648 4.958 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.413 -4.057 3.947 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -3.555 -4.864 3.359 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.812 -4.750 2.104 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.280 -3.865 1.912 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.705 -3.382 0.782 1.00 0.00 N ATOM 1729 CA HIS A 120 -7.919 -3.774 0.079 1.00 0.00 C ATOM 1730 C HIS A 120 -8.172 -5.279 0.086 1.00 0.00 C ATOM 1731 O HIS A 120 -7.287 -6.081 0.388 1.00 0.00 O ATOM 1732 CB HIS A 120 -7.828 -3.282 -1.359 1.00 0.00 C ATOM 1733 CG HIS A 120 -7.968 -1.804 -1.472 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.139 -1.123 -1.592 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -6.912 -0.968 -1.611 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.841 0.151 -1.853 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.496 0.266 -1.889 1.00 0.00 N ATOM 0 H HIS A 120 -5.860 -3.777 0.370 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.758 -3.320 0.606 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -6.870 -3.585 -1.782 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.605 -3.763 -1.953 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.076 -1.515 -1.499 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -5.861 -1.203 -1.526 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.551 0.950 -2.008 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.403 -5.664 -0.260 1.00 0.00 N ATOM 1746 CA GLU A 121 -9.837 -7.042 -0.144 1.00 0.00 C ATOM 1747 C GLU A 121 -9.222 -7.896 -1.237 1.00 0.00 C ATOM 1748 O GLU A 121 -8.580 -8.898 -0.942 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.365 -7.154 -0.205 1.00 0.00 C ATOM 1750 CG GLU A 121 -11.786 -8.541 0.306 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.295 -8.685 0.426 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -13.991 -7.695 0.111 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -13.714 -9.797 0.810 1.00 0.00 O ATOM 0 H GLU A 121 -10.114 -5.030 -0.624 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.500 -7.406 0.827 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -11.824 -6.374 0.402 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.713 -7.008 -1.228 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.404 -9.305 -0.371 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -11.329 -8.720 1.279 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.444 -7.523 -2.491 1.00 0.00 N ATOM 1761 CA LYS A 122 -8.947 -8.282 -3.622 1.00 0.00 C ATOM 1762 C LYS A 122 -7.568 -7.769 -4.027 1.00 0.00 C ATOM 1763 O LYS A 122 -7.045 -6.793 -3.478 1.00 0.00 O ATOM 1764 CB LYS A 122 -9.974 -8.252 -4.770 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.280 -8.980 -4.418 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.106 -10.506 -4.467 1.00 0.00 C ATOM 1767 CE LYS A 122 -12.349 -11.223 -3.921 1.00 0.00 C ATOM 1768 NZ LYS A 122 -12.027 -12.581 -3.432 1.00 0.00 N ATOM 0 H LYS A 122 -9.972 -6.689 -2.748 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.821 -9.329 -3.347 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.198 -7.216 -5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.535 -8.710 -5.656 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.607 -8.682 -3.422 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.064 -8.680 -5.113 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.923 -10.821 -5.494 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.231 -10.794 -3.884 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -12.780 -10.637 -3.109 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -13.105 -11.288 -4.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.891 -13.034 -3.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.639 -13.148 -4.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -11.324 -12.517 -2.668 1.00 0.00 H new ATOM 1782 N ALA A 123 -6.982 -8.463 -5.000 1.00 0.00 N ATOM 1783 CA ALA A 123 -5.747 -8.043 -5.616 1.00 0.00 C ATOM 1784 C ALA A 123 -5.983 -6.718 -6.327 1.00 0.00 C ATOM 1785 O ALA A 123 -7.075 -6.457 -6.822 1.00 0.00 O ATOM 1786 CB ALA A 123 -5.296 -9.095 -6.632 1.00 0.00 C ATOM 0 H ALA A 123 -7.359 -9.333 -5.377 1.00 0.00 H new ATOM 0 HA ALA A 123 -4.974 -7.926 -4.856 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.363 -8.776 -7.096 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.142 -10.048 -6.125 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.062 -9.212 -7.399 1.00 0.00 H new ATOM 1792 N ASP A 124 -4.940 -5.901 -6.396 1.00 0.00 N ATOM 1793 CA ASP A 124 -4.874 -4.823 -7.354 1.00 0.00 C ATOM 1794 C ASP A 124 -4.782 -5.414 -8.769 1.00 0.00 C ATOM 1795 O ASP A 124 -3.870 -6.199 -9.025 1.00 0.00 O ATOM 1796 CB ASP A 124 -3.633 -3.999 -7.015 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.657 -2.689 -7.749 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -3.958 -2.676 -8.957 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.476 -1.654 -7.082 1.00 0.00 O ATOM 0 H ASP A 124 -4.123 -5.972 -5.789 1.00 0.00 H new ATOM 0 HA ASP A 124 -5.760 -4.189 -7.316 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -3.590 -3.820 -5.941 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.735 -4.556 -7.282 1.00 0.00 H new ATOM 1804 N ASP A 125 -5.692 -5.027 -9.671 1.00 0.00 N ATOM 1805 CA ASP A 125 -5.700 -5.376 -11.094 1.00 0.00 C ATOM 1806 C ASP A 125 -4.547 -4.713 -11.874 1.00 0.00 C ATOM 1807 O ASP A 125 -4.539 -4.768 -13.107 1.00 0.00 O ATOM 1808 CB ASP A 125 -7.047 -4.954 -11.736 1.00 0.00 C ATOM 1809 CG ASP A 125 -8.245 -5.860 -11.454 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -8.056 -6.913 -10.813 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -9.344 -5.480 -11.923 1.00 0.00 O ATOM 0 H ASP A 125 -6.481 -4.433 -9.414 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.567 -6.456 -11.153 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -7.290 -3.949 -11.392 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -6.908 -4.896 -12.816 1.00 0.00 H new ATOM 1816 N LEU A 126 -3.612 -4.010 -11.216 1.00 0.00 N ATOM 1817 CA LEU A 126 -2.576 -3.222 -11.876 1.00 0.00 C ATOM 1818 C LEU A 126 -3.238 -2.257 -12.866 1.00 0.00 C ATOM 1819 O LEU A 126 -2.708 -1.943 -13.925 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.513 -4.160 -12.481 1.00 0.00 C ATOM 1821 CG LEU A 126 -0.419 -4.609 -11.488 1.00 0.00 C ATOM 1822 CD1 LEU A 126 0.716 -3.603 -11.507 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -0.843 -4.756 -10.019 1.00 0.00 C ATOM 0 H LEU A 126 -3.559 -3.977 -10.198 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.031 -2.596 -11.169 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.011 -5.044 -12.879 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.038 -3.656 -13.323 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.145 -5.605 -11.837 1.00 0.00 H new ATOM 0 HD11 LEU A 126 1.491 -3.916 -10.807 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.135 -3.546 -12.512 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.338 -2.623 -11.216 1.00 0.00 H new ATOM 0 HD21 LEU A 126 0.012 -5.076 -9.424 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.206 -3.798 -9.647 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.637 -5.499 -9.942 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.436 -1.785 -12.501 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.272 -0.877 -13.271 1.00 0.00 C ATOM 1837 C GLY A 127 -5.585 -1.301 -14.703 1.00 0.00 C ATOM 1838 O GLY A 127 -6.200 -0.525 -15.437 1.00 0.00 O ATOM 0 H GLY A 127 -4.864 -2.044 -11.612 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.214 -0.744 -12.739 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -4.783 0.097 -13.301 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.228 -2.523 -15.107 1.00 0.00 N ATOM 1843 CA LYS A 128 -5.354 -2.959 -16.491 1.00 0.00 C ATOM 1844 C LYS A 128 -6.628 -3.791 -16.683 1.00 0.00 C ATOM 1845 O LYS A 128 -6.757 -4.501 -17.676 1.00 0.00 O ATOM 1846 CB LYS A 128 -4.075 -3.700 -16.911 1.00 0.00 C ATOM 1847 CG LYS A 128 -2.808 -2.820 -16.815 1.00 0.00 C ATOM 1848 CD LYS A 128 -2.126 -2.544 -18.166 1.00 0.00 C ATOM 1849 CE LYS A 128 -2.661 -1.280 -18.862 1.00 0.00 C ATOM 1850 NZ LYS A 128 -2.059 -0.039 -18.315 1.00 0.00 N ATOM 0 H LYS A 128 -4.845 -3.233 -14.482 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.459 -2.095 -17.148 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -3.948 -4.580 -16.281 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -4.187 -4.055 -17.935 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.074 -1.869 -16.355 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -2.092 -3.305 -16.152 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -1.052 -2.439 -18.010 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -2.271 -3.402 -18.822 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -2.454 -1.341 -19.930 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -3.744 -1.236 -18.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -2.449 0.786 -18.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -2.277 0.035 -17.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -1.028 -0.067 -18.446 1.00 0.00 H new ATOM 1864 N GLY A 129 -7.601 -3.655 -15.773 1.00 0.00 N ATOM 1865 CA GLY A 129 -8.922 -4.251 -15.926 1.00 0.00 C ATOM 1866 C GLY A 129 -9.736 -3.559 -17.025 1.00 0.00 C ATOM 1867 O GLY A 129 -10.770 -4.074 -17.442 1.00 0.00 O ATOM 0 H GLY A 129 -7.487 -3.125 -14.909 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -8.818 -5.310 -16.163 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -9.461 -4.188 -14.981 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.275 -2.399 -17.512 1.00 0.00 N ATOM 1872 CA GLY A 130 -9.877 -1.717 -18.648 1.00 0.00 C ATOM 1873 C GLY A 130 -11.272 -1.204 -18.309 1.00 0.00 C ATOM 1874 O GLY A 130 -12.188 -1.297 -19.122 1.00 0.00 O ATOM 0 H GLY A 130 -8.469 -1.911 -17.121 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -9.244 -0.883 -18.952 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -9.934 -2.399 -19.496 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.431 -0.659 -17.103 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.707 -0.209 -16.584 1.00 0.00 C ATOM 1880 C ASN A 131 -12.384 0.839 -15.538 1.00 0.00 C ATOM 1881 O ASN A 131 -11.536 0.556 -14.697 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.493 -1.435 -16.078 1.00 0.00 C ATOM 1883 CG ASN A 131 -14.341 -1.145 -14.851 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -15.564 -1.181 -14.874 1.00 0.00 O ATOM 1885 ND2 ASN A 131 -13.661 -0.844 -13.756 1.00 0.00 N ATOM 0 H ASN A 131 -10.657 -0.519 -16.453 1.00 0.00 H new ATOM 0 HA ASN A 131 -13.360 0.255 -17.323 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.138 -1.799 -16.878 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.791 -2.236 -15.844 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.157 -0.631 -12.890 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -12.641 -0.825 -13.778 1.00 0.00 H new ATOM 1892 N GLU A 132 -13.044 1.999 -15.558 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.756 3.132 -14.691 1.00 0.00 C ATOM 1894 C GLU A 132 -12.478 2.699 -13.257 1.00 0.00 C ATOM 1895 O GLU A 132 -11.470 3.108 -12.697 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.883 4.175 -14.732 1.00 0.00 C ATOM 1897 CG GLU A 132 -14.201 4.669 -16.151 1.00 0.00 C ATOM 1898 CD GLU A 132 -15.266 3.814 -16.821 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -14.871 2.760 -17.367 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -16.447 4.201 -16.724 1.00 0.00 O ATOM 0 H GLU A 132 -13.817 2.176 -16.200 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.849 3.597 -15.077 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.784 3.744 -14.294 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.603 5.027 -14.112 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -14.540 5.704 -16.108 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.292 4.656 -16.753 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.342 1.860 -12.672 1.00 0.00 N ATOM 1908 CA GLN A 133 -13.137 1.321 -11.332 1.00 0.00 C ATOM 1909 C GLN A 133 -11.724 0.717 -11.200 1.00 0.00 C ATOM 1910 O GLN A 133 -10.878 1.344 -10.586 1.00 0.00 O ATOM 1911 CB GLN A 133 -14.285 0.377 -10.919 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.734 0.596 -9.473 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.594 0.559 -8.486 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.419 1.487 -7.701 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -12.794 -0.488 -8.559 1.00 0.00 N ATOM 0 H GLN A 133 -14.201 1.539 -13.119 1.00 0.00 H new ATOM 0 HA GLN A 133 -13.177 2.134 -10.607 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -15.133 0.529 -11.586 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.963 -0.657 -11.043 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -15.240 1.558 -9.398 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.463 -0.169 -9.206 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -12.987 -1.231 -9.230 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -11.983 -0.554 -7.944 1.00 0.00 H new ATOM 1924 N SER A 134 -11.424 -0.450 -11.783 1.00 0.00 N ATOM 1925 CA SER A 134 -10.092 -1.035 -11.888 1.00 0.00 C ATOM 1926 C SER A 134 -9.017 0.007 -12.191 1.00 0.00 C ATOM 1927 O SER A 134 -8.034 0.117 -11.470 1.00 0.00 O ATOM 1928 CB SER A 134 -10.076 -2.200 -12.897 1.00 0.00 C ATOM 1929 OG SER A 134 -10.139 -1.767 -14.244 1.00 0.00 O ATOM 0 H SER A 134 -12.140 -1.035 -12.213 1.00 0.00 H new ATOM 0 HA SER A 134 -9.843 -1.445 -10.909 1.00 0.00 H new ATOM 0 HB2 SER A 134 -9.169 -2.787 -12.752 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.919 -2.861 -12.694 1.00 0.00 H new ATOM 0 HG SER A 134 -10.697 -0.964 -14.304 1.00 0.00 H new ATOM 1935 N THR A 135 -9.218 0.815 -13.221 1.00 0.00 N ATOM 1936 CA THR A 135 -8.227 1.747 -13.720 1.00 0.00 C ATOM 1937 C THR A 135 -8.125 2.995 -12.827 1.00 0.00 C ATOM 1938 O THR A 135 -7.288 3.866 -13.071 1.00 0.00 O ATOM 1939 CB THR A 135 -8.548 1.997 -15.201 1.00 0.00 C ATOM 1940 OG1 THR A 135 -8.681 0.740 -15.849 1.00 0.00 O ATOM 1941 CG2 THR A 135 -7.458 2.773 -15.933 1.00 0.00 C ATOM 0 H THR A 135 -10.095 0.839 -13.742 1.00 0.00 H new ATOM 0 HA THR A 135 -7.216 1.342 -13.672 1.00 0.00 H new ATOM 0 HB THR A 135 -9.462 2.590 -15.232 1.00 0.00 H new ATOM 0 HG1 THR A 135 -7.854 0.226 -15.738 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.749 2.915 -16.974 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.322 3.745 -15.459 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.523 2.215 -15.890 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.906 3.044 -11.742 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.833 3.998 -10.656 1.00 0.00 C ATOM 1951 C LYS A 136 -8.378 3.306 -9.362 1.00 0.00 C ATOM 1952 O LYS A 136 -7.679 3.956 -8.586 1.00 0.00 O ATOM 1953 CB LYS A 136 -10.226 4.619 -10.481 1.00 0.00 C ATOM 1954 CG LYS A 136 -10.338 5.631 -9.336 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.785 6.128 -9.193 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.724 5.059 -8.595 1.00 0.00 C ATOM 1957 NZ LYS A 136 -14.121 5.534 -8.513 1.00 0.00 N ATOM 0 H LYS A 136 -9.655 2.366 -11.600 1.00 0.00 H new ATOM 0 HA LYS A 136 -8.103 4.775 -10.883 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.509 5.111 -11.412 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.947 3.819 -10.312 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -10.012 5.171 -8.403 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.675 6.475 -9.524 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.800 7.015 -8.559 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -12.160 6.429 -10.171 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.683 4.157 -9.206 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.375 4.786 -7.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.719 4.786 -8.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -14.165 6.380 -7.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -14.464 5.771 -9.466 1.00 0.00 H new ATOM 1971 N THR A 137 -8.779 2.052 -9.074 1.00 0.00 N ATOM 1972 CA THR A 137 -8.487 1.483 -7.738 1.00 0.00 C ATOM 1973 C THR A 137 -7.674 0.199 -7.758 1.00 0.00 C ATOM 1974 O THR A 137 -7.134 -0.213 -6.731 1.00 0.00 O ATOM 1975 CB THR A 137 -9.748 1.258 -6.901 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.419 0.083 -7.306 1.00 0.00 O ATOM 1977 CG2 THR A 137 -10.670 2.476 -6.936 1.00 0.00 C ATOM 0 H THR A 137 -9.283 1.436 -9.712 1.00 0.00 H new ATOM 0 HA THR A 137 -7.871 2.252 -7.272 1.00 0.00 H new ATOM 0 HB THR A 137 -9.440 1.122 -5.864 1.00 0.00 H new ATOM 0 HG1 THR A 137 -10.901 -0.298 -6.543 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.555 2.280 -6.331 1.00 0.00 H new ATOM 0 HG22 THR A 137 -10.143 3.343 -6.538 1.00 0.00 H new ATOM 0 HG23 THR A 137 -10.971 2.675 -7.965 1.00 0.00 H new ATOM 1985 N GLY A 138 -7.689 -0.480 -8.895 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.210 -1.826 -9.057 1.00 0.00 C ATOM 1987 C GLY A 138 -8.337 -2.792 -8.759 1.00 0.00 C ATOM 1988 O GLY A 138 -8.072 -3.978 -8.629 1.00 0.00 O ATOM 0 H GLY A 138 -8.053 -0.083 -9.761 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -6.845 -1.976 -10.073 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.370 -2.010 -8.387 1.00 0.00 H new ATOM 1992 N ASN A 139 -9.593 -2.322 -8.635 1.00 0.00 N ATOM 1993 CA ASN A 139 -10.715 -3.231 -8.489 1.00 0.00 C ATOM 1994 C ASN A 139 -10.591 -4.098 -7.241 1.00 0.00 C ATOM 1995 O ASN A 139 -11.281 -5.101 -7.090 1.00 0.00 O ATOM 1996 CB ASN A 139 -10.885 -4.059 -9.770 1.00 0.00 C ATOM 1997 CG ASN A 139 -12.228 -3.884 -10.462 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -12.996 -2.967 -10.163 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -12.472 -4.731 -11.454 1.00 0.00 N ATOM 0 H ASN A 139 -9.841 -1.333 -8.634 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.622 -2.643 -8.347 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -10.093 -3.790 -10.469 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -10.751 -5.113 -9.526 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -13.325 -4.638 -12.006 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -11.807 -5.475 -11.665 1.00 0.00 H new ATOM 2006 N ALA A 140 -9.770 -3.641 -6.292 1.00 0.00 N ATOM 2007 CA ALA A 140 -9.395 -4.397 -5.118 1.00 0.00 C ATOM 2008 C ALA A 140 -10.539 -4.456 -4.091 1.00 0.00 C ATOM 2009 O ALA A 140 -10.349 -4.917 -2.966 1.00 0.00 O ATOM 2010 CB ALA A 140 -8.107 -3.782 -4.572 1.00 0.00 C ATOM 0 H ALA A 140 -9.344 -2.715 -6.329 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.207 -5.441 -5.369 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -7.792 -4.328 -3.683 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -7.326 -3.841 -5.330 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.283 -2.738 -4.314 1.00 0.00 H new ATOM 2016 N GLY A 141 -11.738 -4.001 -4.457 1.00 0.00 N ATOM 2017 CA GLY A 141 -12.914 -4.079 -3.618 1.00 0.00 C ATOM 2018 C GLY A 141 -12.871 -2.992 -2.554 1.00 0.00 C ATOM 2019 O GLY A 141 -12.350 -1.891 -2.780 1.00 0.00 O ATOM 0 H GLY A 141 -11.912 -3.562 -5.361 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -13.812 -3.968 -4.226 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -12.968 -5.060 -3.145 1.00 0.00 H new ATOM 2023 N SER A 142 -13.451 -3.286 -1.391 1.00 0.00 N ATOM 2024 CA SER A 142 -13.531 -2.319 -0.311 1.00 0.00 C ATOM 2025 C SER A 142 -12.159 -2.075 0.315 1.00 0.00 C ATOM 2026 O SER A 142 -11.121 -2.460 -0.226 1.00 0.00 O ATOM 2027 CB SER A 142 -14.601 -2.723 0.711 1.00 0.00 C ATOM 2028 OG SER A 142 -14.904 -1.601 1.522 1.00 0.00 O ATOM 0 H SER A 142 -13.872 -4.190 -1.178 1.00 0.00 H new ATOM 0 HA SER A 142 -13.849 -1.362 -0.724 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.498 -3.073 0.200 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.243 -3.548 1.327 1.00 0.00 H new ATOM 0 HG SER A 142 -15.589 -1.847 2.178 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.172 -1.341 1.420 1.00 0.00 N ATOM 2035 CA ARG A 143 -11.017 -1.031 2.231 1.00 0.00 C ATOM 2036 C ARG A 143 -11.117 -1.903 3.480 1.00 0.00 C ATOM 2037 O ARG A 143 -11.967 -1.651 4.329 1.00 0.00 O ATOM 2038 CB ARG A 143 -11.035 0.459 2.598 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.869 1.415 1.403 1.00 0.00 C ATOM 2040 CD ARG A 143 -12.159 1.798 0.657 1.00 0.00 C ATOM 2041 NE ARG A 143 -12.348 1.034 -0.589 1.00 0.00 N ATOM 2042 CZ ARG A 143 -13.180 1.388 -1.584 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -13.925 2.493 -1.470 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -13.264 0.642 -2.692 1.00 0.00 N ATOM 0 H ARG A 143 -13.031 -0.930 1.786 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.084 -1.228 1.703 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.976 0.685 3.099 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -10.237 0.653 3.315 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -10.394 2.329 1.759 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -10.184 0.957 0.690 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -13.014 1.633 1.312 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -12.136 2.863 0.425 1.00 0.00 H new ATOM 0 HE ARG A 143 -11.809 0.176 -0.705 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -13.862 3.066 -0.629 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -14.556 2.762 -2.224 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -12.695 -0.200 -2.785 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -13.897 0.915 -3.444 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.280 -2.939 3.584 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.270 -3.791 4.773 1.00 0.00 C ATOM 2060 C LEU A 144 -9.819 -2.970 5.976 1.00 0.00 C ATOM 2061 O LEU A 144 -10.398 -3.092 7.051 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.339 -5.003 4.605 1.00 0.00 C ATOM 2063 CG LEU A 144 -9.932 -6.250 3.921 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -10.626 -7.156 4.942 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -10.964 -5.884 2.858 1.00 0.00 C ATOM 0 H LEU A 144 -9.607 -3.205 2.866 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.282 -4.167 4.924 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.468 -4.684 4.033 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.982 -5.296 5.592 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.093 -6.766 3.454 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.036 -8.029 4.434 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.904 -7.478 5.692 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.433 -6.606 5.427 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.355 -6.794 2.402 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -11.781 -5.329 3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.494 -5.267 2.092 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.768 -2.164 5.803 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.206 -1.362 6.873 1.00 0.00 C ATOM 2079 C ALA A 145 -7.492 -0.149 6.294 1.00 0.00 C ATOM 2080 O ALA A 145 -7.110 -0.149 5.121 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.265 -2.214 7.729 1.00 0.00 C ATOM 0 H ALA A 145 -8.287 -2.055 4.910 1.00 0.00 H new ATOM 0 HA ALA A 145 -9.008 -1.002 7.517 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.848 -1.603 8.530 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.820 -3.048 8.160 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.456 -2.599 7.108 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.340 0.880 7.129 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.798 2.181 6.796 1.00 0.00 C ATOM 2089 C CYS A 146 -6.057 2.711 8.018 1.00 0.00 C ATOM 2090 O CYS A 146 -6.311 2.269 9.138 1.00 0.00 O ATOM 2091 CB CYS A 146 -7.923 3.111 6.323 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.313 3.357 7.453 1.00 0.00 S ATOM 0 H CYS A 146 -7.610 0.815 8.110 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.089 2.118 5.971 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.487 4.086 6.104 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.315 2.719 5.384 1.00 0.00 H new ATOM 0 HG CYS A 146 -10.174 4.166 6.912 1.00 0.00 H new ATOM 2097 N GLY A 147 -5.083 3.595 7.808 1.00 0.00 N ATOM 2098 CA GLY A 147 -4.273 4.147 8.883 1.00 0.00 C ATOM 2099 C GLY A 147 -3.415 5.291 8.358 1.00 0.00 C ATOM 2100 O GLY A 147 -3.241 5.421 7.149 1.00 0.00 O ATOM 0 H GLY A 147 -4.836 3.947 6.883 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.917 4.504 9.687 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.637 3.369 9.306 1.00 0.00 H new ATOM 2104 N VAL A 148 -2.897 6.125 9.262 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.140 7.323 8.927 1.00 0.00 C ATOM 2106 C VAL A 148 -0.655 7.070 9.207 1.00 0.00 C ATOM 2107 O VAL A 148 -0.320 6.449 10.217 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.702 8.517 9.721 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -1.964 9.808 9.357 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -4.193 8.721 9.406 1.00 0.00 C ATOM 0 H VAL A 148 -2.997 5.979 10.267 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.236 7.565 7.869 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.566 8.295 10.780 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -2.378 10.638 9.930 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -0.905 9.699 9.589 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -2.083 10.007 8.292 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -4.573 9.569 9.976 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -4.316 8.916 8.341 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -4.748 7.823 9.678 1.00 0.00 H new ATOM 2120 N ILE A 149 0.236 7.508 8.312 1.00 0.00 N ATOM 2121 CA ILE A 149 1.676 7.301 8.466 1.00 0.00 C ATOM 2122 C ILE A 149 2.251 8.325 9.447 1.00 0.00 C ATOM 2123 O ILE A 149 1.976 9.516 9.303 1.00 0.00 O ATOM 2124 CB ILE A 149 2.395 7.423 7.110 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.780 6.503 6.044 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.886 7.093 7.289 1.00 0.00 C ATOM 2127 CD1 ILE A 149 2.295 6.806 4.635 1.00 0.00 C ATOM 0 H ILE A 149 -0.021 8.014 7.464 1.00 0.00 H new ATOM 0 HA ILE A 149 1.836 6.296 8.856 1.00 0.00 H new ATOM 0 HB ILE A 149 2.277 8.449 6.761 1.00 0.00 H new ATOM 0 HG12 ILE A 149 2.003 5.465 6.293 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.695 6.609 6.061 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.395 7.179 6.329 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.330 7.790 8.000 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.991 6.075 7.665 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.827 6.126 3.923 1.00 0.00 H new ATOM 0 HD12 ILE A 149 2.049 7.834 4.371 1.00 0.00 H new ATOM 0 HD13 ILE A 149 3.377 6.673 4.607 1.00 0.00 H new ATOM 2139 N GLY A 150 3.097 7.891 10.387 1.00 0.00 N ATOM 2140 CA GLY A 150 3.784 8.765 11.321 1.00 0.00 C ATOM 2141 C GLY A 150 5.199 8.254 11.580 1.00 0.00 C ATOM 2142 O GLY A 150 5.620 7.240 11.025 1.00 0.00 O ATOM 0 H GLY A 150 3.322 6.904 10.516 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.823 9.778 10.920 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.230 8.814 12.259 1.00 0.00 H new ATOM 2146 N ILE A 151 5.940 8.974 12.422 1.00 0.00 N ATOM 2147 CA ILE A 151 7.254 8.595 12.903 1.00 0.00 C ATOM 2148 C ILE A 151 7.108 7.376 13.817 1.00 0.00 C ATOM 2149 O ILE A 151 6.125 7.256 14.546 1.00 0.00 O ATOM 2150 CB ILE A 151 7.880 9.790 13.645 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.802 11.077 12.797 1.00 0.00 C ATOM 2152 CG2 ILE A 151 9.348 9.509 14.000 1.00 0.00 C ATOM 2153 CD1 ILE A 151 6.744 12.063 13.304 1.00 0.00 C ATOM 0 H ILE A 151 5.624 9.868 12.797 1.00 0.00 H new ATOM 0 HA ILE A 151 7.912 8.328 12.076 1.00 0.00 H new ATOM 0 HB ILE A 151 7.309 9.933 14.562 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.776 11.566 12.797 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.579 10.812 11.764 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.767 10.369 14.523 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.405 8.630 14.642 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.915 9.329 13.087 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.737 12.948 12.668 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.763 11.589 13.278 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.979 12.354 14.328 1.00 0.00 H new ATOM 2165 N ALA A 152 8.087 6.476 13.769 1.00 0.00 N ATOM 2166 CA ALA A 152 8.173 5.311 14.638 1.00 0.00 C ATOM 2167 C ALA A 152 9.002 5.625 15.869 1.00 0.00 C ATOM 2168 O ALA A 152 9.929 6.432 15.806 1.00 0.00 O ATOM 2169 CB ALA A 152 8.771 4.126 13.875 1.00 0.00 C ATOM 0 H ALA A 152 8.861 6.541 13.107 1.00 0.00 H new ATOM 0 HA ALA A 152 7.167 5.044 14.963 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.830 3.261 14.535 1.00 0.00 H new ATOM 0 HB2 ALA A 152 8.139 3.887 13.020 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.771 4.385 13.526 1.00 0.00 H new ATOM 2175 N GLN A 153 8.650 4.972 16.976 1.00 0.00 N ATOM 2176 CA GLN A 153 9.524 4.914 18.125 1.00 0.00 C ATOM 2177 C GLN A 153 10.742 4.047 17.769 1.00 0.00 C ATOM 2178 O GLN A 153 11.778 4.204 18.447 1.00 0.00 O ATOM 2179 CB GLN A 153 8.758 4.357 19.336 1.00 0.00 C ATOM 2180 CG GLN A 153 7.690 5.324 19.876 1.00 0.00 C ATOM 2181 CD GLN A 153 8.261 6.456 20.734 1.00 0.00 C ATOM 2182 OE1 GLN A 153 9.467 6.597 20.902 1.00 0.00 O ATOM 2183 NE2 GLN A 153 7.389 7.277 21.314 1.00 0.00 N ATOM 2184 OXT GLN A 153 10.621 3.240 16.817 1.00 0.00 O ATOM 0 H GLN A 153 7.764 4.479 17.092 1.00 0.00 H new ATOM 0 HA GLN A 153 9.873 5.911 18.394 1.00 0.00 H new ATOM 0 HB2 GLN A 153 8.280 3.419 19.055 1.00 0.00 H new ATOM 0 HB3 GLN A 153 9.467 4.128 20.132 1.00 0.00 H new ATOM 0 HG2 GLN A 153 7.146 5.756 19.036 1.00 0.00 H new ATOM 0 HG3 GLN A 153 6.968 4.761 20.467 1.00 0.00 H new ATOM 0 HE21 GLN A 153 6.388 7.147 21.164 1.00 0.00 H new ATOM 0 HE22 GLN A 153 7.721 8.037 21.908 1.00 0.00 H new