USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 770 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 101 ASN : amide:sc= -2.25! K(o=-4.4!,f=-0.077) USER MOD Set 1.2: A 103 GLN : amide:sc= -2.12! K(o=-4.4!,f=-0.59) USER MOD Set 2.1: A 59 SER OG : rot 100:sc= 0.359 USER MOD Set 2.2: A 71 THR OG1 : rot 180:sc= 0.331 USER MOD Set 3.1: A 50 ASN : amide:sc= 0.0111 K(o=0.0099,f=-1.2) USER MOD Set 3.2: A 52 ASN : amide:sc=-0.00116 K(o=0.0099,f=-1.3) USER MOD Set 4.1: A 34 LYS NZ :NH3+ 146:sc= -0.408 (180deg=0) USER MOD Set 4.2: A 89 SER OG : rot 180:sc= -0.429 USER MOD Set 5.1: A 24 LYS NZ :NH3+ 180:sc= 0.698 (180deg=-0.165) USER MOD Set 5.2: A 69 TYR OH : rot 180:sc= 0.732 USER MOD Single : A 1 ALA N :NH3+ 131:sc= 0.0481 (180deg=0) USER MOD Single : A 2 SER OG : rot 102:sc= 0.316 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 121:sc= -0.267 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 17:sc= 1.06 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= 0.00545 K(o=0.0054,f=-3.5!) USER MOD Single : A 16 TYR OH : rot 56:sc= 0.0599! USER MOD Single : A 19 SER OG : rot -83:sc= 1.01 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 35:sc= 0.112 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.82! X(o=-0.82!,f=-0.43) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 156:sc= 0.0183 (180deg=-0.318) USER MOD Single : A 37 THR OG1 : rot -150:sc= -2.27 USER MOD Single : A 40 TYR OH : rot 1:sc= 0.554 USER MOD Single : A 44 SER OG : rot -32:sc= 0.339 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 140:sc= -0.214 USER MOD Single : A 66 ASN : amide:sc= -0.024 X(o=-0.024,f=-0.14) USER MOD Single : A 67 TYR OH : rot -124:sc= -0.434 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -159:sc= -0.129 (180deg=-0.624) USER MOD Single : A 80 LYS NZ :NH3+ 178:sc= 1.02 (180deg=0.973) USER MOD Single : A 83 TYR OH : rot -84:sc= 0.105 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 96:sc= -0.703! USER MOD Single : A 91 LYS NZ :NH3+ -171:sc= -0.0114 (180deg=-0.157) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0429 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -1 K(o=-1,f=-5.8!) USER MOD Single : A 97 ASN : amide:sc= -1.86 K(o=-1.9,f=-6.4!) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 99 SER OG : rot -11:sc= 0.963 USER MOD Single : A 102 TYR OH : rot -124:sc= 1.25 USER MOD Single : A 105 SER OG : rot 180:sc= 0.0388 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0.0754 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -11.826 13.205 14.512 1.00 0.00 N ATOM 2 CA ALA A 1 -10.705 12.378 14.015 1.00 0.00 C ATOM 3 C ALA A 1 -10.017 13.067 12.849 1.00 0.00 C ATOM 4 O ALA A 1 -10.644 13.814 12.096 1.00 0.00 O ATOM 5 CB ALA A 1 -11.200 11.006 13.600 1.00 0.00 C ATOM 0 H1 ALA A 1 -12.678 12.616 14.604 1.00 0.00 H new ATOM 0 H2 ALA A 1 -11.579 13.603 15.440 1.00 0.00 H new ATOM 0 H3 ALA A 1 -12.011 13.978 13.842 1.00 0.00 H new ATOM 0 HA ALA A 1 -9.983 12.254 14.822 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -10.362 10.411 13.237 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -11.654 10.508 14.457 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -11.941 11.111 12.807 1.00 0.00 H new ATOM 13 N SER A 2 -8.732 12.807 12.704 1.00 0.00 N ATOM 14 CA SER A 2 -7.935 13.441 11.673 1.00 0.00 C ATOM 15 C SER A 2 -7.641 12.468 10.539 1.00 0.00 C ATOM 16 O SER A 2 -7.893 11.268 10.665 1.00 0.00 O ATOM 17 CB SER A 2 -6.633 13.969 12.277 1.00 0.00 C ATOM 18 OG SER A 2 -5.932 12.939 12.959 1.00 0.00 O ATOM 0 H SER A 2 -8.214 12.155 13.293 1.00 0.00 H new ATOM 0 HA SER A 2 -8.500 14.276 11.260 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.003 14.381 11.488 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.853 14.783 12.968 1.00 0.00 H new ATOM 0 HG SER A 2 -5.193 12.620 12.399 1.00 0.00 H new ATOM 24 N ILE A 3 -7.121 12.977 9.434 1.00 0.00 N ATOM 25 CA ILE A 3 -6.765 12.128 8.306 1.00 0.00 C ATOM 26 C ILE A 3 -5.504 11.308 8.622 1.00 0.00 C ATOM 27 O ILE A 3 -5.555 10.074 8.624 1.00 0.00 O ATOM 28 CB ILE A 3 -6.565 12.933 6.993 1.00 0.00 C ATOM 29 CG1 ILE A 3 -7.871 13.596 6.535 1.00 0.00 C ATOM 30 CG2 ILE A 3 -6.030 12.030 5.890 1.00 0.00 C ATOM 31 CD1 ILE A 3 -8.278 14.812 7.344 1.00 0.00 C ATOM 0 H ILE A 3 -6.936 13.970 9.293 1.00 0.00 H new ATOM 0 HA ILE A 3 -7.604 11.451 8.145 1.00 0.00 H new ATOM 0 HB ILE A 3 -5.838 13.719 7.198 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -7.768 13.889 5.490 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -8.673 12.859 6.582 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -5.896 12.611 4.977 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -5.072 11.610 6.197 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -6.738 11.222 5.705 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -9.211 15.215 6.950 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -8.418 14.525 8.386 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -7.498 15.571 7.278 1.00 0.00 H new ATOM 43 N PRO A 4 -4.357 11.965 8.915 1.00 0.00 N ATOM 44 CA PRO A 4 -3.120 11.269 9.241 1.00 0.00 C ATOM 45 C PRO A 4 -3.054 10.881 10.712 1.00 0.00 C ATOM 46 O PRO A 4 -3.558 11.599 11.584 1.00 0.00 O ATOM 47 CB PRO A 4 -2.020 12.289 8.916 1.00 0.00 C ATOM 48 CG PRO A 4 -2.717 13.563 8.539 1.00 0.00 C ATOM 49 CD PRO A 4 -4.155 13.418 8.955 1.00 0.00 C ATOM 0 HA PRO A 4 -3.026 10.337 8.684 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -1.368 12.443 9.776 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -1.391 11.934 8.099 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -2.256 14.416 9.036 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -2.642 13.741 7.466 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -4.331 13.824 9.951 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -4.828 13.939 8.274 1.00 0.00 H new ATOM 57 N SER A 5 -2.455 9.734 10.978 1.00 0.00 N ATOM 58 CA SER A 5 -2.261 9.262 12.324 1.00 0.00 C ATOM 59 C SER A 5 -0.800 8.885 12.548 1.00 0.00 C ATOM 60 O SER A 5 -0.151 9.389 13.465 1.00 0.00 O ATOM 61 CB SER A 5 -3.163 8.061 12.567 1.00 0.00 C ATOM 62 OG SER A 5 -4.531 8.415 12.439 1.00 0.00 O ATOM 0 H SER A 5 -2.091 9.107 10.260 1.00 0.00 H new ATOM 0 HA SER A 5 -2.518 10.054 13.027 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.921 7.271 11.856 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.980 7.660 13.564 1.00 0.00 H new ATOM 0 HG SER A 5 -5.089 7.626 12.598 1.00 0.00 H new ATOM 68 N SER A 6 -0.284 8.007 11.699 1.00 0.00 N ATOM 69 CA SER A 6 1.084 7.545 11.827 1.00 0.00 C ATOM 70 C SER A 6 1.982 8.162 10.756 1.00 0.00 C ATOM 71 O SER A 6 2.841 8.995 11.059 1.00 0.00 O ATOM 72 CB SER A 6 1.126 6.018 11.741 1.00 0.00 C ATOM 73 OG SER A 6 0.302 5.429 12.736 1.00 0.00 O ATOM 0 H SER A 6 -0.796 7.602 10.915 1.00 0.00 H new ATOM 0 HA SER A 6 1.462 7.862 12.799 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.795 5.697 10.753 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.152 5.672 11.862 1.00 0.00 H new ATOM 0 HG SER A 6 0.344 4.453 12.660 1.00 0.00 H new ATOM 79 N ALA A 7 1.772 7.774 9.505 1.00 0.00 N ATOM 80 CA ALA A 7 2.659 8.182 8.434 1.00 0.00 C ATOM 81 C ALA A 7 1.923 8.967 7.356 1.00 0.00 C ATOM 82 O ALA A 7 0.750 9.305 7.510 1.00 0.00 O ATOM 83 CB ALA A 7 3.331 6.964 7.827 1.00 0.00 C ATOM 0 H ALA A 7 0.997 7.179 9.212 1.00 0.00 H new ATOM 0 HA ALA A 7 3.415 8.841 8.861 1.00 0.00 H new ATOM 0 HB1 ALA A 7 3.996 7.278 7.023 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.908 6.447 8.594 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.572 6.291 7.428 1.00 0.00 H new ATOM 89 N SER A 8 2.627 9.251 6.268 1.00 0.00 N ATOM 90 CA SER A 8 2.058 9.956 5.128 1.00 0.00 C ATOM 91 C SER A 8 0.960 9.132 4.461 1.00 0.00 C ATOM 92 O SER A 8 0.045 9.680 3.842 1.00 0.00 O ATOM 93 CB SER A 8 3.165 10.242 4.118 1.00 0.00 C ATOM 94 OG SER A 8 4.294 10.810 4.758 1.00 0.00 O ATOM 0 H SER A 8 3.608 8.999 6.151 1.00 0.00 H new ATOM 0 HA SER A 8 1.616 10.888 5.480 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.452 9.319 3.615 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.796 10.922 3.350 1.00 0.00 H new ATOM 0 HG SER A 8 5.076 10.238 4.610 1.00 0.00 H new ATOM 100 N VAL A 9 1.048 7.818 4.598 1.00 0.00 N ATOM 101 CA VAL A 9 0.142 6.922 3.907 1.00 0.00 C ATOM 102 C VAL A 9 -0.648 6.054 4.873 1.00 0.00 C ATOM 103 O VAL A 9 -0.176 5.708 5.959 1.00 0.00 O ATOM 104 CB VAL A 9 0.912 6.030 2.906 1.00 0.00 C ATOM 105 CG1 VAL A 9 2.141 5.445 3.548 1.00 0.00 C ATOM 106 CG2 VAL A 9 0.039 4.912 2.344 1.00 0.00 C ATOM 0 H VAL A 9 1.740 7.350 5.183 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.567 7.544 3.361 1.00 0.00 H new ATOM 0 HB VAL A 9 1.210 6.671 2.076 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.667 4.821 2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.797 6.250 3.878 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.850 4.839 4.406 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.622 4.311 1.646 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -0.313 4.280 3.160 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -0.816 5.344 1.825 1.00 0.00 H new ATOM 116 N GLN A 10 -1.858 5.736 4.456 1.00 0.00 N ATOM 117 CA GLN A 10 -2.725 4.807 5.155 1.00 0.00 C ATOM 118 C GLN A 10 -3.508 4.007 4.122 1.00 0.00 C ATOM 119 O GLN A 10 -4.037 4.572 3.168 1.00 0.00 O ATOM 120 CB GLN A 10 -3.687 5.558 6.078 1.00 0.00 C ATOM 121 CG GLN A 10 -4.632 4.646 6.842 1.00 0.00 C ATOM 122 CD GLN A 10 -5.617 5.410 7.701 1.00 0.00 C ATOM 123 OE1 GLN A 10 -5.357 5.686 8.875 1.00 0.00 O ATOM 124 NE2 GLN A 10 -6.750 5.771 7.125 1.00 0.00 N ATOM 0 H GLN A 10 -2.273 6.122 3.608 1.00 0.00 H new ATOM 0 HA GLN A 10 -2.123 4.138 5.770 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -3.109 6.147 6.790 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -4.273 6.260 5.485 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -5.180 4.023 6.135 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -4.050 3.975 7.474 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -6.929 5.524 6.152 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -7.446 6.297 7.654 1.00 0.00 H new ATOM 133 N LEU A 11 -3.551 2.700 4.276 1.00 0.00 N ATOM 134 CA LEU A 11 -4.299 1.865 3.351 1.00 0.00 C ATOM 135 C LEU A 11 -5.790 2.085 3.533 1.00 0.00 C ATOM 136 O LEU A 11 -6.306 2.051 4.650 1.00 0.00 O ATOM 137 CB LEU A 11 -3.972 0.397 3.575 1.00 0.00 C ATOM 138 CG LEU A 11 -4.612 -0.574 2.583 1.00 0.00 C ATOM 139 CD1 LEU A 11 -4.029 -0.384 1.193 1.00 0.00 C ATOM 140 CD2 LEU A 11 -4.402 -1.995 3.059 1.00 0.00 C ATOM 0 H LEU A 11 -3.082 2.193 5.026 1.00 0.00 H new ATOM 0 HA LEU A 11 -4.015 2.141 2.336 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.890 0.272 3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.286 0.121 4.582 1.00 0.00 H new ATOM 0 HG LEU A 11 -5.681 -0.371 2.528 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -4.498 -1.085 0.503 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.215 0.636 0.857 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.955 -0.567 1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.859 -2.687 2.351 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.334 -2.201 3.130 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.862 -2.122 4.039 1.00 0.00 H new ATOM 152 N ASP A 12 -6.476 2.311 2.424 1.00 0.00 N ATOM 153 CA ASP A 12 -7.912 2.521 2.451 1.00 0.00 C ATOM 154 C ASP A 12 -8.623 1.197 2.630 1.00 0.00 C ATOM 155 O ASP A 12 -9.254 0.956 3.656 1.00 0.00 O ATOM 156 CB ASP A 12 -8.382 3.172 1.152 1.00 0.00 C ATOM 157 CG ASP A 12 -9.822 3.643 1.230 1.00 0.00 C ATOM 158 OD1 ASP A 12 -10.055 4.773 1.700 1.00 0.00 O ATOM 159 OD2 ASP A 12 -10.726 2.886 0.817 1.00 0.00 O ATOM 0 H ASP A 12 -6.060 2.353 1.494 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.147 3.181 3.286 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -7.737 4.020 0.919 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -8.279 2.459 0.334 1.00 0.00 H new ATOM 164 N SER A 13 -8.459 0.332 1.637 1.00 0.00 N ATOM 165 CA SER A 13 -9.166 -0.951 1.564 1.00 0.00 C ATOM 166 C SER A 13 -8.748 -1.720 0.331 1.00 0.00 C ATOM 167 O SER A 13 -8.218 -1.158 -0.630 1.00 0.00 O ATOM 168 CB SER A 13 -10.694 -0.765 1.539 1.00 0.00 C ATOM 169 OG SER A 13 -11.207 -0.409 2.814 1.00 0.00 O ATOM 0 H SER A 13 -7.829 0.497 0.852 1.00 0.00 H new ATOM 0 HA SER A 13 -8.898 -1.510 2.461 1.00 0.00 H new ATOM 0 HB2 SER A 13 -10.953 0.008 0.815 1.00 0.00 H new ATOM 0 HB3 SER A 13 -11.166 -1.688 1.203 1.00 0.00 H new ATOM 0 HG SER A 13 -10.476 -0.088 3.383 1.00 0.00 H new ATOM 175 N TYR A 14 -8.989 -3.012 0.383 1.00 0.00 N ATOM 176 CA TYR A 14 -8.621 -3.922 -0.673 1.00 0.00 C ATOM 177 C TYR A 14 -9.489 -5.165 -0.568 1.00 0.00 C ATOM 178 O TYR A 14 -10.127 -5.396 0.458 1.00 0.00 O ATOM 179 CB TYR A 14 -7.138 -4.262 -0.557 1.00 0.00 C ATOM 180 CG TYR A 14 -6.779 -4.925 0.746 1.00 0.00 C ATOM 181 CD1 TYR A 14 -6.451 -4.192 1.872 1.00 0.00 C ATOM 182 CD2 TYR A 14 -6.772 -6.292 0.837 1.00 0.00 C ATOM 183 CE1 TYR A 14 -6.121 -4.821 3.059 1.00 0.00 C ATOM 184 CE2 TYR A 14 -6.446 -6.934 2.007 1.00 0.00 C ATOM 185 CZ TYR A 14 -6.120 -6.198 3.120 1.00 0.00 C ATOM 186 OH TYR A 14 -5.796 -6.837 4.294 1.00 0.00 O ATOM 0 H TYR A 14 -9.452 -3.463 1.172 1.00 0.00 H new ATOM 0 HA TYR A 14 -8.783 -3.466 -1.650 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.858 -4.919 -1.380 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -6.553 -3.348 -0.665 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -6.453 -3.113 1.824 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -7.029 -6.879 -0.032 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -5.866 -4.238 3.931 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -6.446 -8.013 2.051 1.00 0.00 H new ATOM 0 HH TYR A 14 -5.845 -7.807 4.163 1.00 0.00 H new ATOM 196 N ASN A 15 -9.530 -5.943 -1.625 1.00 0.00 N ATOM 197 CA ASN A 15 -10.375 -7.121 -1.672 1.00 0.00 C ATOM 198 C ASN A 15 -9.757 -8.155 -2.590 1.00 0.00 C ATOM 199 O ASN A 15 -8.861 -7.839 -3.377 1.00 0.00 O ATOM 200 CB ASN A 15 -11.778 -6.747 -2.168 1.00 0.00 C ATOM 201 CG ASN A 15 -12.752 -7.911 -2.163 1.00 0.00 C ATOM 202 OD1 ASN A 15 -12.682 -8.793 -1.311 1.00 0.00 O ATOM 203 ND2 ASN A 15 -13.654 -7.932 -3.129 1.00 0.00 N ATOM 0 H ASN A 15 -8.985 -5.782 -2.472 1.00 0.00 H new ATOM 0 HA ASN A 15 -10.460 -7.538 -0.669 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -12.175 -5.948 -1.542 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -11.703 -6.351 -3.181 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -14.324 -8.699 -3.185 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -13.680 -7.181 -3.818 1.00 0.00 H new ATOM 210 N TYR A 16 -10.244 -9.377 -2.492 1.00 0.00 N ATOM 211 CA TYR A 16 -9.700 -10.490 -3.247 1.00 0.00 C ATOM 212 C TYR A 16 -10.811 -11.374 -3.776 1.00 0.00 C ATOM 213 O TYR A 16 -11.782 -11.657 -3.071 1.00 0.00 O ATOM 214 CB TYR A 16 -8.774 -11.324 -2.368 1.00 0.00 C ATOM 215 CG TYR A 16 -7.586 -10.567 -1.861 1.00 0.00 C ATOM 216 CD1 TYR A 16 -6.474 -10.378 -2.656 1.00 0.00 C ATOM 217 CD2 TYR A 16 -7.585 -10.040 -0.582 1.00 0.00 C ATOM 218 CE1 TYR A 16 -5.383 -9.677 -2.191 1.00 0.00 C ATOM 219 CE2 TYR A 16 -6.503 -9.340 -0.108 1.00 0.00 C ATOM 220 CZ TYR A 16 -5.404 -9.159 -0.913 1.00 0.00 C ATOM 221 OH TYR A 16 -4.324 -8.459 -0.435 1.00 0.00 O ATOM 0 H TYR A 16 -11.027 -9.626 -1.888 1.00 0.00 H new ATOM 0 HA TYR A 16 -9.137 -10.082 -4.087 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -9.340 -11.706 -1.519 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -8.429 -12.188 -2.936 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -6.459 -10.785 -3.656 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -8.447 -10.181 0.053 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -4.518 -9.534 -2.822 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -6.516 -8.934 0.893 1.00 0.00 H new ATOM 0 HH TYR A 16 -4.121 -7.717 -1.042 1.00 0.00 H new ATOM 231 N ASP A 17 -10.660 -11.808 -5.012 1.00 0.00 N ATOM 232 CA ASP A 17 -11.583 -12.752 -5.618 1.00 0.00 C ATOM 233 C ASP A 17 -10.790 -13.805 -6.375 1.00 0.00 C ATOM 234 O ASP A 17 -9.964 -13.475 -7.228 1.00 0.00 O ATOM 235 CB ASP A 17 -12.591 -12.043 -6.536 1.00 0.00 C ATOM 236 CG ASP A 17 -11.948 -11.355 -7.726 1.00 0.00 C ATOM 237 OD1 ASP A 17 -11.270 -10.326 -7.531 1.00 0.00 O ATOM 238 OD2 ASP A 17 -12.126 -11.837 -8.864 1.00 0.00 O ATOM 0 H ASP A 17 -9.897 -11.518 -5.624 1.00 0.00 H new ATOM 0 HA ASP A 17 -12.163 -13.237 -4.833 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.317 -12.772 -6.897 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.143 -11.305 -5.954 1.00 0.00 H new ATOM 243 N GLY A 18 -11.024 -15.072 -6.042 1.00 0.00 N ATOM 244 CA GLY A 18 -10.143 -16.133 -6.500 1.00 0.00 C ATOM 245 C GLY A 18 -8.743 -15.891 -5.976 1.00 0.00 C ATOM 246 O GLY A 18 -8.442 -16.187 -4.821 1.00 0.00 O ATOM 0 H GLY A 18 -11.806 -15.382 -5.465 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -10.510 -17.099 -6.154 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.134 -16.167 -7.589 1.00 0.00 H new ATOM 250 N SER A 19 -7.892 -15.338 -6.820 1.00 0.00 N ATOM 251 CA SER A 19 -6.666 -14.732 -6.363 1.00 0.00 C ATOM 252 C SER A 19 -6.437 -13.453 -7.162 1.00 0.00 C ATOM 253 O SER A 19 -5.800 -13.464 -8.213 1.00 0.00 O ATOM 254 CB SER A 19 -5.500 -15.703 -6.545 1.00 0.00 C ATOM 255 OG SER A 19 -4.277 -15.134 -6.111 1.00 0.00 O ATOM 0 H SER A 19 -8.033 -15.299 -7.829 1.00 0.00 H new ATOM 0 HA SER A 19 -6.735 -14.492 -5.302 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.696 -16.617 -5.985 1.00 0.00 H new ATOM 0 HB3 SER A 19 -5.419 -15.984 -7.595 1.00 0.00 H new ATOM 0 HG SER A 19 -3.904 -14.577 -6.826 1.00 0.00 H new ATOM 261 N THR A 20 -6.997 -12.361 -6.672 1.00 0.00 N ATOM 262 CA THR A 20 -6.820 -11.059 -7.288 1.00 0.00 C ATOM 263 C THR A 20 -6.793 -9.969 -6.227 1.00 0.00 C ATOM 264 O THR A 20 -7.638 -9.953 -5.340 1.00 0.00 O ATOM 265 CB THR A 20 -7.935 -10.765 -8.316 1.00 0.00 C ATOM 266 OG1 THR A 20 -7.873 -11.715 -9.391 1.00 0.00 O ATOM 267 CG2 THR A 20 -7.809 -9.354 -8.873 1.00 0.00 C ATOM 0 H THR A 20 -7.585 -12.352 -5.839 1.00 0.00 H new ATOM 0 HA THR A 20 -5.866 -11.070 -7.815 1.00 0.00 H new ATOM 0 HB THR A 20 -8.895 -10.850 -7.807 1.00 0.00 H new ATOM 0 HG1 THR A 20 -8.584 -11.524 -10.038 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.607 -9.175 -9.594 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.887 -8.633 -8.059 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.843 -9.242 -9.365 1.00 0.00 H new ATOM 275 N PHE A 21 -5.833 -9.069 -6.321 1.00 0.00 N ATOM 276 CA PHE A 21 -5.783 -7.917 -5.441 1.00 0.00 C ATOM 277 C PHE A 21 -6.545 -6.795 -6.094 1.00 0.00 C ATOM 278 O PHE A 21 -6.300 -6.455 -7.245 1.00 0.00 O ATOM 279 CB PHE A 21 -4.339 -7.475 -5.190 1.00 0.00 C ATOM 280 CG PHE A 21 -4.195 -6.409 -4.133 1.00 0.00 C ATOM 281 CD1 PHE A 21 -4.582 -5.099 -4.373 1.00 0.00 C ATOM 282 CD2 PHE A 21 -3.674 -6.727 -2.898 1.00 0.00 C ATOM 283 CE1 PHE A 21 -4.448 -4.132 -3.394 1.00 0.00 C ATOM 284 CE2 PHE A 21 -3.536 -5.767 -1.912 1.00 0.00 C ATOM 285 CZ PHE A 21 -3.924 -4.467 -2.161 1.00 0.00 C ATOM 0 H PHE A 21 -5.074 -9.114 -7.001 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.224 -8.180 -4.480 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.750 -8.344 -4.896 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -3.916 -7.105 -6.124 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -4.993 -4.831 -5.335 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -3.368 -7.743 -2.696 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.753 -3.115 -3.593 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -3.125 -6.035 -0.950 1.00 0.00 H new ATOM 0 HZ PHE A 21 -3.818 -3.714 -1.394 1.00 0.00 H new ATOM 295 N SER A 22 -7.483 -6.243 -5.381 1.00 0.00 N ATOM 296 CA SER A 22 -8.195 -5.090 -5.894 1.00 0.00 C ATOM 297 C SER A 22 -8.543 -4.136 -4.771 1.00 0.00 C ATOM 298 O SER A 22 -9.135 -4.535 -3.777 1.00 0.00 O ATOM 299 CB SER A 22 -9.441 -5.537 -6.656 1.00 0.00 C ATOM 300 OG SER A 22 -10.283 -6.343 -5.844 1.00 0.00 O ATOM 0 H SER A 22 -7.776 -6.560 -4.457 1.00 0.00 H new ATOM 0 HA SER A 22 -7.549 -4.556 -6.590 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.993 -4.662 -6.999 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.146 -6.096 -7.544 1.00 0.00 H new ATOM 0 HG SER A 22 -10.249 -6.023 -4.918 1.00 0.00 H new ATOM 306 N GLY A 23 -8.156 -2.882 -4.921 1.00 0.00 N ATOM 307 CA GLY A 23 -8.396 -1.916 -3.875 1.00 0.00 C ATOM 308 C GLY A 23 -7.752 -0.586 -4.164 1.00 0.00 C ATOM 309 O GLY A 23 -7.524 -0.236 -5.325 1.00 0.00 O ATOM 0 H GLY A 23 -7.681 -2.516 -5.746 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.470 -1.777 -3.751 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.014 -2.304 -2.931 1.00 0.00 H new ATOM 313 N LYS A 24 -7.454 0.155 -3.108 1.00 0.00 N ATOM 314 CA LYS A 24 -6.871 1.474 -3.249 1.00 0.00 C ATOM 315 C LYS A 24 -6.220 1.928 -1.943 1.00 0.00 C ATOM 316 O LYS A 24 -6.445 1.343 -0.879 1.00 0.00 O ATOM 317 CB LYS A 24 -7.923 2.489 -3.712 1.00 0.00 C ATOM 318 CG LYS A 24 -9.122 2.632 -2.779 1.00 0.00 C ATOM 319 CD LYS A 24 -10.166 1.548 -3.005 1.00 0.00 C ATOM 320 CE LYS A 24 -11.299 1.651 -2.000 1.00 0.00 C ATOM 321 NZ LYS A 24 -11.987 2.969 -2.069 1.00 0.00 N ATOM 0 H LYS A 24 -7.608 -0.138 -2.143 1.00 0.00 H new ATOM 0 HA LYS A 24 -6.094 1.417 -4.011 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -7.446 3.463 -3.821 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -8.281 2.197 -4.699 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -8.780 2.594 -1.745 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.580 3.610 -2.927 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.566 1.631 -4.016 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -9.697 0.567 -2.927 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -12.021 0.855 -2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -10.907 1.499 -0.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -12.754 2.998 -1.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.305 3.728 -1.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.384 3.104 -3.021 1.00 0.00 H new ATOM 335 N ILE A 25 -5.419 2.977 -2.042 1.00 0.00 N ATOM 336 CA ILE A 25 -4.596 3.453 -0.946 1.00 0.00 C ATOM 337 C ILE A 25 -4.833 4.948 -0.719 1.00 0.00 C ATOM 338 O ILE A 25 -5.248 5.667 -1.631 1.00 0.00 O ATOM 339 CB ILE A 25 -3.106 3.193 -1.255 1.00 0.00 C ATOM 340 CG1 ILE A 25 -2.917 1.738 -1.705 1.00 0.00 C ATOM 341 CG2 ILE A 25 -2.237 3.487 -0.039 1.00 0.00 C ATOM 342 CD1 ILE A 25 -1.506 1.398 -2.124 1.00 0.00 C ATOM 0 H ILE A 25 -5.322 3.527 -2.896 1.00 0.00 H new ATOM 0 HA ILE A 25 -4.869 2.913 -0.039 1.00 0.00 H new ATOM 0 HB ILE A 25 -2.797 3.861 -2.059 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.212 1.076 -0.890 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.590 1.537 -2.538 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.192 3.296 -0.284 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -2.357 4.531 0.250 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -2.539 2.845 0.788 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -1.459 0.352 -2.427 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -1.212 2.032 -2.961 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -0.828 1.564 -1.287 1.00 0.00 H new ATOM 354 N TYR A 26 -4.558 5.399 0.495 1.00 0.00 N ATOM 355 CA TYR A 26 -4.876 6.752 0.922 1.00 0.00 C ATOM 356 C TYR A 26 -3.618 7.430 1.490 1.00 0.00 C ATOM 357 O TYR A 26 -3.275 7.243 2.655 1.00 0.00 O ATOM 358 CB TYR A 26 -5.965 6.636 1.991 1.00 0.00 C ATOM 359 CG TYR A 26 -6.723 7.898 2.292 1.00 0.00 C ATOM 360 CD1 TYR A 26 -6.098 8.971 2.890 1.00 0.00 C ATOM 361 CD2 TYR A 26 -8.081 7.992 2.015 1.00 0.00 C ATOM 362 CE1 TYR A 26 -6.802 10.118 3.205 1.00 0.00 C ATOM 363 CE2 TYR A 26 -8.791 9.133 2.319 1.00 0.00 C ATOM 364 CZ TYR A 26 -8.146 10.194 2.917 1.00 0.00 C ATOM 365 OH TYR A 26 -8.856 11.325 3.242 1.00 0.00 O ATOM 0 H TYR A 26 -4.106 4.834 1.214 1.00 0.00 H new ATOM 0 HA TYR A 26 -5.226 7.361 0.088 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.677 5.873 1.676 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -5.506 6.282 2.914 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -5.043 8.915 3.116 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.588 7.157 1.554 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -6.300 10.951 3.675 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -9.845 9.195 2.090 1.00 0.00 H new ATOM 0 HH TYR A 26 -9.791 11.214 2.969 1.00 0.00 H new ATOM 375 N VAL A 27 -2.923 8.206 0.667 1.00 0.00 N ATOM 376 CA VAL A 27 -1.623 8.755 1.058 1.00 0.00 C ATOM 377 C VAL A 27 -1.356 10.128 0.435 1.00 0.00 C ATOM 378 O VAL A 27 -1.741 10.388 -0.703 1.00 0.00 O ATOM 379 CB VAL A 27 -0.474 7.760 0.725 1.00 0.00 C ATOM 380 CG1 VAL A 27 -0.798 6.920 -0.495 1.00 0.00 C ATOM 381 CG2 VAL A 27 0.859 8.473 0.536 1.00 0.00 C ATOM 0 H VAL A 27 -3.231 8.470 -0.269 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.653 8.898 2.138 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.381 7.095 1.584 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.028 6.237 -0.696 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.706 6.346 -0.311 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.948 7.572 -1.356 1.00 0.00 H new ATOM 0 HG21 VAL A 27 1.633 7.741 0.305 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.777 9.186 -0.284 1.00 0.00 H new ATOM 0 HG23 VAL A 27 1.122 9.002 1.452 1.00 0.00 H new ATOM 391 N LYS A 28 -0.706 11.000 1.204 1.00 0.00 N ATOM 392 CA LYS A 28 -0.319 12.322 0.729 1.00 0.00 C ATOM 393 C LYS A 28 1.014 12.252 -0.007 1.00 0.00 C ATOM 394 O LYS A 28 1.871 11.426 0.310 1.00 0.00 O ATOM 395 CB LYS A 28 -0.187 13.305 1.899 1.00 0.00 C ATOM 396 CG LYS A 28 0.866 12.906 2.923 1.00 0.00 C ATOM 397 CD LYS A 28 1.254 14.067 3.825 1.00 0.00 C ATOM 398 CE LYS A 28 0.041 14.719 4.468 1.00 0.00 C ATOM 399 NZ LYS A 28 0.423 15.762 5.456 1.00 0.00 N ATOM 0 H LYS A 28 -0.435 10.809 2.169 1.00 0.00 H new ATOM 0 HA LYS A 28 -1.097 12.672 0.051 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.058 14.292 1.506 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -1.152 13.391 2.399 1.00 0.00 H new ATOM 0 HG2 LYS A 28 0.487 12.085 3.532 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.752 12.537 2.407 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.929 13.711 4.603 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.800 14.810 3.244 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -0.583 15.165 3.694 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -0.561 13.956 4.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.435 16.180 5.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 0.997 15.333 6.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 0.975 16.504 4.981 1.00 0.00 H new ATOM 413 N ASN A 29 1.179 13.114 -0.988 1.00 0.00 N ATOM 414 CA ASN A 29 2.431 13.200 -1.727 1.00 0.00 C ATOM 415 C ASN A 29 3.397 14.140 -1.010 1.00 0.00 C ATOM 416 O ASN A 29 3.020 15.231 -0.571 1.00 0.00 O ATOM 417 CB ASN A 29 2.179 13.680 -3.167 1.00 0.00 C ATOM 418 CG ASN A 29 2.066 15.178 -3.299 1.00 0.00 C ATOM 419 OD1 ASN A 29 3.051 15.867 -3.560 1.00 0.00 O ATOM 420 ND2 ASN A 29 0.877 15.693 -3.116 1.00 0.00 N ATOM 0 H ASN A 29 0.461 13.770 -1.297 1.00 0.00 H new ATOM 0 HA ASN A 29 2.878 12.207 -1.774 1.00 0.00 H new ATOM 0 HB2 ASN A 29 2.991 13.329 -3.804 1.00 0.00 H new ATOM 0 HB3 ASN A 29 1.262 13.222 -3.537 1.00 0.00 H new ATOM 0 HD21 ASN A 29 0.741 16.701 -3.188 1.00 0.00 H new ATOM 0 HD22 ASN A 29 0.086 15.086 -2.901 1.00 0.00 H new ATOM 427 N ILE A 30 4.633 13.685 -0.854 1.00 0.00 N ATOM 428 CA ILE A 30 5.676 14.490 -0.235 1.00 0.00 C ATOM 429 C ILE A 30 6.250 15.479 -1.237 1.00 0.00 C ATOM 430 O ILE A 30 6.281 16.684 -0.998 1.00 0.00 O ATOM 431 CB ILE A 30 6.825 13.612 0.307 1.00 0.00 C ATOM 432 CG1 ILE A 30 6.286 12.529 1.245 1.00 0.00 C ATOM 433 CG2 ILE A 30 7.866 14.466 1.014 1.00 0.00 C ATOM 434 CD1 ILE A 30 5.444 13.053 2.391 1.00 0.00 C ATOM 0 H ILE A 30 4.938 12.758 -1.150 1.00 0.00 H new ATOM 0 HA ILE A 30 5.217 15.024 0.597 1.00 0.00 H new ATOM 0 HB ILE A 30 7.304 13.120 -0.539 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.689 11.827 0.663 1.00 0.00 H new ATOM 0 HG13 ILE A 30 7.127 11.969 1.655 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.667 13.828 1.388 1.00 0.00 H new ATOM 0 HG22 ILE A 30 8.278 15.192 0.313 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.400 14.991 1.848 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.104 12.218 3.004 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.041 13.732 3.000 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.580 13.586 1.994 1.00 0.00 H new ATOM 446 N ALA A 31 6.712 14.951 -2.357 1.00 0.00 N ATOM 447 CA ALA A 31 7.303 15.768 -3.403 1.00 0.00 C ATOM 448 C ALA A 31 6.336 15.948 -4.569 1.00 0.00 C ATOM 449 O ALA A 31 5.656 16.965 -4.668 1.00 0.00 O ATOM 450 CB ALA A 31 8.608 15.152 -3.866 1.00 0.00 C ATOM 0 H ALA A 31 6.689 13.953 -2.566 1.00 0.00 H new ATOM 0 HA ALA A 31 7.512 16.757 -2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.044 15.771 -4.650 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.299 15.090 -3.026 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.420 14.152 -4.256 1.00 0.00 H new ATOM 456 N TYR A 32 6.273 14.949 -5.442 1.00 0.00 N ATOM 457 CA TYR A 32 5.359 14.972 -6.574 1.00 0.00 C ATOM 458 C TYR A 32 5.122 13.559 -7.090 1.00 0.00 C ATOM 459 O TYR A 32 4.069 12.971 -6.854 1.00 0.00 O ATOM 460 CB TYR A 32 5.908 15.860 -7.696 1.00 0.00 C ATOM 461 CG TYR A 32 5.017 15.926 -8.919 1.00 0.00 C ATOM 462 CD1 TYR A 32 3.644 16.092 -8.795 1.00 0.00 C ATOM 463 CD2 TYR A 32 5.553 15.826 -10.198 1.00 0.00 C ATOM 464 CE1 TYR A 32 2.826 16.154 -9.911 1.00 0.00 C ATOM 465 CE2 TYR A 32 4.744 15.887 -11.317 1.00 0.00 C ATOM 466 CZ TYR A 32 3.383 16.052 -11.172 1.00 0.00 C ATOM 467 OH TYR A 32 2.578 16.106 -12.290 1.00 0.00 O ATOM 0 H TYR A 32 6.849 14.109 -5.385 1.00 0.00 H new ATOM 0 HA TYR A 32 4.409 15.389 -6.239 1.00 0.00 H new ATOM 0 HB2 TYR A 32 6.053 16.869 -7.309 1.00 0.00 H new ATOM 0 HB3 TYR A 32 6.889 15.488 -7.993 1.00 0.00 H new ATOM 0 HD1 TYR A 32 3.206 16.174 -7.811 1.00 0.00 H new ATOM 0 HD2 TYR A 32 6.619 15.699 -10.319 1.00 0.00 H new ATOM 0 HE1 TYR A 32 1.760 16.281 -9.797 1.00 0.00 H new ATOM 0 HE2 TYR A 32 5.177 15.806 -12.303 1.00 0.00 H new ATOM 0 HH TYR A 32 3.130 16.020 -13.095 1.00 0.00 H new ATOM 477 N SER A 33 6.122 13.004 -7.757 1.00 0.00 N ATOM 478 CA SER A 33 6.003 11.687 -8.356 1.00 0.00 C ATOM 479 C SER A 33 6.575 10.633 -7.412 1.00 0.00 C ATOM 480 O SER A 33 7.579 9.986 -7.708 1.00 0.00 O ATOM 481 CB SER A 33 6.723 11.661 -9.710 1.00 0.00 C ATOM 482 OG SER A 33 6.398 10.494 -10.451 1.00 0.00 O ATOM 0 H SER A 33 7.029 13.449 -7.897 1.00 0.00 H new ATOM 0 HA SER A 33 4.950 11.460 -8.525 1.00 0.00 H new ATOM 0 HB2 SER A 33 6.450 12.546 -10.285 1.00 0.00 H new ATOM 0 HB3 SER A 33 7.800 11.704 -9.551 1.00 0.00 H new ATOM 0 HG SER A 33 6.872 10.509 -11.309 1.00 0.00 H new ATOM 488 N LYS A 34 5.954 10.510 -6.244 1.00 0.00 N ATOM 489 CA LYS A 34 6.326 9.494 -5.269 1.00 0.00 C ATOM 490 C LYS A 34 5.690 8.185 -5.680 1.00 0.00 C ATOM 491 O LYS A 34 4.690 8.185 -6.398 1.00 0.00 O ATOM 492 CB LYS A 34 5.856 9.915 -3.881 1.00 0.00 C ATOM 493 CG LYS A 34 6.481 11.221 -3.407 1.00 0.00 C ATOM 494 CD LYS A 34 7.990 11.235 -3.626 1.00 0.00 C ATOM 495 CE LYS A 34 8.378 11.796 -4.988 1.00 0.00 C ATOM 496 NZ LYS A 34 9.807 11.565 -5.313 1.00 0.00 N ATOM 0 H LYS A 34 5.183 11.109 -5.948 1.00 0.00 H new ATOM 0 HA LYS A 34 7.409 9.375 -5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.771 10.020 -3.888 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.095 9.126 -3.168 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.028 12.056 -3.941 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.265 11.365 -2.348 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.462 11.830 -2.844 1.00 0.00 H new ATOM 0 HD3 LYS A 34 8.377 10.220 -3.531 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.756 11.338 -5.757 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.173 12.866 -5.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.910 11.410 -6.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 10.366 12.396 -5.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.149 10.728 -4.800 1.00 0.00 H new ATOM 510 N LYS A 35 6.239 7.076 -5.238 1.00 0.00 N ATOM 511 CA LYS A 35 5.725 5.798 -5.682 1.00 0.00 C ATOM 512 C LYS A 35 5.341 4.929 -4.511 1.00 0.00 C ATOM 513 O LYS A 35 6.006 4.908 -3.473 1.00 0.00 O ATOM 514 CB LYS A 35 6.690 5.065 -6.625 1.00 0.00 C ATOM 515 CG LYS A 35 8.145 5.033 -6.185 1.00 0.00 C ATOM 516 CD LYS A 35 8.955 4.158 -7.131 1.00 0.00 C ATOM 517 CE LYS A 35 10.453 4.394 -7.009 1.00 0.00 C ATOM 518 NZ LYS A 35 10.966 4.102 -5.651 1.00 0.00 N ATOM 0 H LYS A 35 7.023 7.030 -4.587 1.00 0.00 H new ATOM 0 HA LYS A 35 4.826 6.008 -6.261 1.00 0.00 H new ATOM 0 HB2 LYS A 35 6.343 4.039 -6.744 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.637 5.535 -7.607 1.00 0.00 H new ATOM 0 HG2 LYS A 35 8.552 6.044 -6.173 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.218 4.648 -5.168 1.00 0.00 H new ATOM 0 HD2 LYS A 35 8.738 3.110 -6.925 1.00 0.00 H new ATOM 0 HD3 LYS A 35 8.643 4.353 -8.157 1.00 0.00 H new ATOM 0 HE2 LYS A 35 10.976 3.769 -7.733 1.00 0.00 H new ATOM 0 HE3 LYS A 35 10.676 5.430 -7.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 11.981 3.879 -5.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 10.825 4.932 -5.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 10.453 3.289 -5.254 1.00 0.00 H new ATOM 532 N VAL A 36 4.249 4.225 -4.695 1.00 0.00 N ATOM 533 CA VAL A 36 3.679 3.410 -3.657 1.00 0.00 C ATOM 534 C VAL A 36 3.730 1.951 -4.064 1.00 0.00 C ATOM 535 O VAL A 36 3.121 1.536 -5.054 1.00 0.00 O ATOM 536 CB VAL A 36 2.241 3.859 -3.355 1.00 0.00 C ATOM 537 CG1 VAL A 36 1.518 2.853 -2.512 1.00 0.00 C ATOM 538 CG2 VAL A 36 2.268 5.187 -2.632 1.00 0.00 C ATOM 0 H VAL A 36 3.731 4.204 -5.574 1.00 0.00 H new ATOM 0 HA VAL A 36 4.261 3.529 -2.743 1.00 0.00 H new ATOM 0 HB VAL A 36 1.712 3.955 -4.303 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.504 3.203 -2.318 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.478 1.899 -3.038 1.00 0.00 H new ATOM 0 HG13 VAL A 36 2.045 2.725 -1.567 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.248 5.505 -2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.819 5.081 -1.697 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.757 5.933 -3.259 1.00 0.00 H new ATOM 548 N THR A 37 4.476 1.185 -3.301 1.00 0.00 N ATOM 549 CA THR A 37 4.793 -0.174 -3.673 1.00 0.00 C ATOM 550 C THR A 37 4.172 -1.181 -2.720 1.00 0.00 C ATOM 551 O THR A 37 4.438 -1.177 -1.517 1.00 0.00 O ATOM 552 CB THR A 37 6.318 -0.367 -3.736 1.00 0.00 C ATOM 553 OG1 THR A 37 6.947 0.293 -2.632 1.00 0.00 O ATOM 554 CG2 THR A 37 6.863 0.184 -5.041 1.00 0.00 C ATOM 0 H THR A 37 4.877 1.484 -2.412 1.00 0.00 H new ATOM 0 HA THR A 37 4.368 -0.353 -4.661 1.00 0.00 H new ATOM 0 HB THR A 37 6.535 -1.434 -3.682 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.845 0.584 -2.894 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.943 0.041 -5.073 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.402 -0.341 -5.878 1.00 0.00 H new ATOM 0 HG23 THR A 37 6.635 1.248 -5.110 1.00 0.00 H new ATOM 562 N VAL A 38 3.324 -2.030 -3.269 1.00 0.00 N ATOM 563 CA VAL A 38 2.719 -3.100 -2.498 1.00 0.00 C ATOM 564 C VAL A 38 3.645 -4.281 -2.449 1.00 0.00 C ATOM 565 O VAL A 38 3.901 -4.916 -3.465 1.00 0.00 O ATOM 566 CB VAL A 38 1.384 -3.582 -3.088 1.00 0.00 C ATOM 567 CG1 VAL A 38 0.822 -4.771 -2.308 1.00 0.00 C ATOM 568 CG2 VAL A 38 0.370 -2.483 -3.075 1.00 0.00 C ATOM 0 H VAL A 38 3.038 -1.999 -4.248 1.00 0.00 H new ATOM 0 HA VAL A 38 2.533 -2.692 -1.505 1.00 0.00 H new ATOM 0 HB VAL A 38 1.585 -3.890 -4.114 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.122 -5.085 -2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.532 -5.597 -2.343 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.655 -4.480 -1.271 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -0.567 -2.847 -3.497 1.00 0.00 H new ATOM 0 HG22 VAL A 38 0.202 -2.155 -2.049 1.00 0.00 H new ATOM 0 HG23 VAL A 38 0.734 -1.645 -3.669 1.00 0.00 H new ATOM 578 N VAL A 39 4.136 -4.579 -1.280 1.00 0.00 N ATOM 579 CA VAL A 39 4.910 -5.790 -1.110 1.00 0.00 C ATOM 580 C VAL A 39 4.091 -6.776 -0.338 1.00 0.00 C ATOM 581 O VAL A 39 3.850 -6.596 0.856 1.00 0.00 O ATOM 582 CB VAL A 39 6.281 -5.592 -0.419 1.00 0.00 C ATOM 583 CG1 VAL A 39 7.336 -5.227 -1.449 1.00 0.00 C ATOM 584 CG2 VAL A 39 6.210 -4.516 0.651 1.00 0.00 C ATOM 0 H VAL A 39 4.021 -4.015 -0.438 1.00 0.00 H new ATOM 0 HA VAL A 39 5.143 -6.152 -2.111 1.00 0.00 H new ATOM 0 HB VAL A 39 6.553 -6.532 0.062 1.00 0.00 H new ATOM 0 HG11 VAL A 39 8.297 -5.090 -0.953 1.00 0.00 H new ATOM 0 HG12 VAL A 39 7.418 -6.027 -2.185 1.00 0.00 H new ATOM 0 HG13 VAL A 39 7.051 -4.302 -1.950 1.00 0.00 H new ATOM 0 HG21 VAL A 39 7.189 -4.401 1.117 1.00 0.00 H new ATOM 0 HG22 VAL A 39 5.911 -3.571 0.197 1.00 0.00 H new ATOM 0 HG23 VAL A 39 5.479 -4.803 1.407 1.00 0.00 H new ATOM 594 N TYR A 40 3.611 -7.793 -1.020 1.00 0.00 N ATOM 595 CA TYR A 40 2.860 -8.810 -0.342 1.00 0.00 C ATOM 596 C TYR A 40 3.645 -10.064 -0.278 1.00 0.00 C ATOM 597 O TYR A 40 4.330 -10.466 -1.222 1.00 0.00 O ATOM 598 CB TYR A 40 1.497 -9.087 -0.971 1.00 0.00 C ATOM 599 CG TYR A 40 1.496 -10.069 -2.131 1.00 0.00 C ATOM 600 CD1 TYR A 40 1.450 -11.449 -1.939 1.00 0.00 C ATOM 601 CD2 TYR A 40 1.503 -9.602 -3.412 1.00 0.00 C ATOM 602 CE1 TYR A 40 1.421 -12.317 -3.018 1.00 0.00 C ATOM 603 CE2 TYR A 40 1.467 -10.449 -4.494 1.00 0.00 C ATOM 604 CZ TYR A 40 1.427 -11.808 -4.297 1.00 0.00 C ATOM 605 OH TYR A 40 1.386 -12.654 -5.382 1.00 0.00 O ATOM 0 H TYR A 40 3.727 -7.931 -2.024 1.00 0.00 H new ATOM 0 HA TYR A 40 2.668 -8.429 0.661 1.00 0.00 H new ATOM 0 HB2 TYR A 40 0.830 -9.466 -0.197 1.00 0.00 H new ATOM 0 HB3 TYR A 40 1.078 -8.142 -1.318 1.00 0.00 H new ATOM 0 HD1 TYR A 40 1.437 -11.847 -0.935 1.00 0.00 H new ATOM 0 HD2 TYR A 40 1.538 -8.536 -3.581 1.00 0.00 H new ATOM 0 HE1 TYR A 40 1.394 -13.385 -2.857 1.00 0.00 H new ATOM 0 HE2 TYR A 40 1.470 -10.047 -5.496 1.00 0.00 H new ATOM 0 HH TYR A 40 1.347 -13.583 -5.071 1.00 0.00 H new ATOM 615 N ALA A 41 3.567 -10.644 0.866 1.00 0.00 N ATOM 616 CA ALA A 41 4.222 -11.855 1.126 1.00 0.00 C ATOM 617 C ALA A 41 3.287 -12.965 0.753 1.00 0.00 C ATOM 618 O ALA A 41 2.207 -13.126 1.336 1.00 0.00 O ATOM 619 CB ALA A 41 4.625 -11.881 2.565 1.00 0.00 C ATOM 0 H ALA A 41 3.035 -10.276 1.655 1.00 0.00 H new ATOM 0 HA ALA A 41 5.134 -11.973 0.540 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.137 -12.819 2.783 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.295 -11.046 2.770 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.738 -11.797 3.193 1.00 0.00 H new ATOM 625 N ASP A 42 3.689 -13.625 -0.311 1.00 0.00 N ATOM 626 CA ASP A 42 2.953 -14.733 -0.923 1.00 0.00 C ATOM 627 C ASP A 42 2.343 -15.676 0.132 1.00 0.00 C ATOM 628 O ASP A 42 2.740 -15.679 1.301 1.00 0.00 O ATOM 629 CB ASP A 42 3.891 -15.525 -1.838 1.00 0.00 C ATOM 630 CG ASP A 42 3.174 -16.430 -2.824 1.00 0.00 C ATOM 631 OD1 ASP A 42 2.852 -17.574 -2.446 1.00 0.00 O ATOM 632 OD2 ASP A 42 2.965 -16.015 -3.984 1.00 0.00 O ATOM 0 H ASP A 42 4.560 -13.407 -0.795 1.00 0.00 H new ATOM 0 HA ASP A 42 2.132 -14.308 -1.500 1.00 0.00 H new ATOM 0 HB2 ASP A 42 4.517 -14.826 -2.392 1.00 0.00 H new ATOM 0 HB3 ASP A 42 4.556 -16.130 -1.223 1.00 0.00 H new ATOM 637 N GLY A 43 1.453 -16.539 -0.330 1.00 0.00 N ATOM 638 CA GLY A 43 0.534 -17.261 0.544 1.00 0.00 C ATOM 639 C GLY A 43 1.191 -18.278 1.460 1.00 0.00 C ATOM 640 O GLY A 43 0.508 -18.960 2.221 1.00 0.00 O ATOM 0 H GLY A 43 1.345 -16.761 -1.320 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -0.007 -16.538 1.155 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.205 -17.773 -0.073 1.00 0.00 H new ATOM 644 N SER A 44 2.504 -18.380 1.400 1.00 0.00 N ATOM 645 CA SER A 44 3.233 -19.299 2.255 1.00 0.00 C ATOM 646 C SER A 44 3.578 -18.647 3.590 1.00 0.00 C ATOM 647 O SER A 44 4.016 -19.323 4.523 1.00 0.00 O ATOM 648 CB SER A 44 4.517 -19.733 1.569 1.00 0.00 C ATOM 649 OG SER A 44 5.200 -20.715 2.330 1.00 0.00 O ATOM 0 H SER A 44 3.090 -17.837 0.767 1.00 0.00 H new ATOM 0 HA SER A 44 2.597 -20.165 2.440 1.00 0.00 H new ATOM 0 HB2 SER A 44 4.287 -20.130 0.580 1.00 0.00 H new ATOM 0 HB3 SER A 44 5.164 -18.868 1.422 1.00 0.00 H new ATOM 0 HG SER A 44 5.042 -20.558 3.284 1.00 0.00 H new ATOM 655 N ASP A 45 3.406 -17.325 3.642 1.00 0.00 N ATOM 656 CA ASP A 45 3.693 -16.515 4.840 1.00 0.00 C ATOM 657 C ASP A 45 5.190 -16.360 5.023 1.00 0.00 C ATOM 658 O ASP A 45 5.709 -16.555 6.122 1.00 0.00 O ATOM 659 CB ASP A 45 3.105 -17.128 6.126 1.00 0.00 C ATOM 660 CG ASP A 45 1.602 -17.020 6.230 1.00 0.00 C ATOM 661 OD1 ASP A 45 0.901 -17.911 5.699 1.00 0.00 O ATOM 662 OD2 ASP A 45 1.113 -16.061 6.869 1.00 0.00 O ATOM 0 H ASP A 45 3.062 -16.778 2.853 1.00 0.00 H new ATOM 0 HA ASP A 45 3.221 -15.546 4.677 1.00 0.00 H new ATOM 0 HB2 ASP A 45 3.387 -18.180 6.176 1.00 0.00 H new ATOM 0 HB3 ASP A 45 3.554 -16.636 6.989 1.00 0.00 H new ATOM 667 N ASN A 46 5.893 -15.988 3.963 1.00 0.00 N ATOM 668 CA ASN A 46 7.348 -16.004 4.006 1.00 0.00 C ATOM 669 C ASN A 46 7.909 -15.030 3.002 1.00 0.00 C ATOM 670 O ASN A 46 7.453 -14.988 1.859 1.00 0.00 O ATOM 671 CB ASN A 46 7.864 -17.420 3.716 1.00 0.00 C ATOM 672 CG ASN A 46 9.380 -17.515 3.662 1.00 0.00 C ATOM 673 OD1 ASN A 46 10.040 -17.690 4.686 1.00 0.00 O ATOM 674 ND2 ASN A 46 9.941 -17.439 2.463 1.00 0.00 N ATOM 0 H ASN A 46 5.490 -15.677 3.079 1.00 0.00 H new ATOM 0 HA ASN A 46 7.676 -15.705 5.002 1.00 0.00 H new ATOM 0 HB2 ASN A 46 7.493 -18.098 4.485 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.453 -17.760 2.766 1.00 0.00 H new ATOM 0 HD21 ASN A 46 10.953 -17.526 2.367 1.00 0.00 H new ATOM 0 HD22 ASN A 46 9.361 -17.293 1.637 1.00 0.00 H new ATOM 681 N TRP A 47 8.886 -14.236 3.407 1.00 0.00 N ATOM 682 CA TRP A 47 9.481 -13.326 2.486 1.00 0.00 C ATOM 683 C TRP A 47 10.853 -13.774 2.026 1.00 0.00 C ATOM 684 O TRP A 47 11.877 -13.393 2.596 1.00 0.00 O ATOM 685 CB TRP A 47 9.529 -11.913 3.000 1.00 0.00 C ATOM 686 CG TRP A 47 8.748 -11.126 2.046 1.00 0.00 C ATOM 687 CD1 TRP A 47 8.908 -11.163 0.703 1.00 0.00 C ATOM 688 CD2 TRP A 47 7.651 -10.284 2.309 1.00 0.00 C ATOM 689 NE1 TRP A 47 7.962 -10.391 0.100 1.00 0.00 N ATOM 690 CE2 TRP A 47 7.179 -9.841 1.074 1.00 0.00 C ATOM 691 CE3 TRP A 47 7.009 -9.853 3.461 1.00 0.00 C ATOM 692 CZ2 TRP A 47 6.097 -9.012 0.977 1.00 0.00 C ATOM 693 CZ3 TRP A 47 5.946 -9.030 3.341 1.00 0.00 C ATOM 694 CH2 TRP A 47 5.491 -8.620 2.116 1.00 0.00 C ATOM 0 H TRP A 47 9.268 -14.213 4.353 1.00 0.00 H new ATOM 0 HA TRP A 47 8.822 -13.332 1.618 1.00 0.00 H new ATOM 0 HB2 TRP A 47 9.108 -11.845 4.003 1.00 0.00 H new ATOM 0 HB3 TRP A 47 10.556 -11.551 3.060 1.00 0.00 H new ATOM 0 HD1 TRP A 47 9.673 -11.722 0.185 1.00 0.00 H new ATOM 0 HE1 TRP A 47 7.857 -10.248 -0.904 1.00 0.00 H new ATOM 0 HE3 TRP A 47 7.353 -10.170 4.434 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 5.737 -8.680 0.014 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 5.442 -8.687 4.232 1.00 0.00 H new ATOM 0 HH2 TRP A 47 4.630 -7.970 2.061 1.00 0.00 H new ATOM 705 N ASN A 48 10.863 -14.606 1.000 1.00 0.00 N ATOM 706 CA ASN A 48 12.084 -14.906 0.280 1.00 0.00 C ATOM 707 C ASN A 48 12.447 -13.672 -0.525 1.00 0.00 C ATOM 708 O ASN A 48 11.552 -12.954 -0.969 1.00 0.00 O ATOM 709 CB ASN A 48 11.872 -16.112 -0.644 1.00 0.00 C ATOM 710 CG ASN A 48 13.160 -16.599 -1.281 1.00 0.00 C ATOM 711 OD1 ASN A 48 13.874 -17.418 -0.705 1.00 0.00 O ATOM 712 ND2 ASN A 48 13.453 -16.127 -2.481 1.00 0.00 N ATOM 0 H ASN A 48 10.035 -15.087 0.647 1.00 0.00 H new ATOM 0 HA ASN A 48 12.889 -15.160 0.970 1.00 0.00 H new ATOM 0 HB2 ASN A 48 11.424 -16.926 -0.074 1.00 0.00 H new ATOM 0 HB3 ASN A 48 11.164 -15.843 -1.428 1.00 0.00 H new ATOM 0 HD21 ASN A 48 14.296 -16.442 -2.961 1.00 0.00 H new ATOM 0 HD22 ASN A 48 12.836 -15.448 -2.927 1.00 0.00 H new ATOM 719 N ASN A 49 13.736 -13.399 -0.681 1.00 0.00 N ATOM 720 CA ASN A 49 14.179 -12.193 -1.377 1.00 0.00 C ATOM 721 C ASN A 49 13.701 -12.198 -2.822 1.00 0.00 C ATOM 722 O ASN A 49 14.370 -12.720 -3.716 1.00 0.00 O ATOM 723 CB ASN A 49 15.700 -12.054 -1.329 1.00 0.00 C ATOM 724 CG ASN A 49 16.168 -10.708 -1.855 1.00 0.00 C ATOM 725 OD1 ASN A 49 16.422 -10.545 -3.049 1.00 0.00 O ATOM 726 ND2 ASN A 49 16.283 -9.733 -0.967 1.00 0.00 N ATOM 0 H ASN A 49 14.492 -13.992 -0.338 1.00 0.00 H new ATOM 0 HA ASN A 49 13.740 -11.337 -0.864 1.00 0.00 H new ATOM 0 HB2 ASN A 49 16.043 -12.180 -0.302 1.00 0.00 H new ATOM 0 HB3 ASN A 49 16.155 -12.851 -1.917 1.00 0.00 H new ATOM 0 HD21 ASN A 49 16.592 -8.807 -1.263 1.00 0.00 H new ATOM 0 HD22 ASN A 49 16.063 -9.908 0.014 1.00 0.00 H new ATOM 733 N ASN A 50 12.527 -11.626 -3.032 1.00 0.00 N ATOM 734 CA ASN A 50 11.902 -11.583 -4.338 1.00 0.00 C ATOM 735 C ASN A 50 11.005 -10.358 -4.420 1.00 0.00 C ATOM 736 O ASN A 50 10.407 -9.953 -3.422 1.00 0.00 O ATOM 737 CB ASN A 50 11.083 -12.857 -4.578 1.00 0.00 C ATOM 738 CG ASN A 50 10.510 -12.938 -5.982 1.00 0.00 C ATOM 739 OD1 ASN A 50 11.096 -12.430 -6.939 1.00 0.00 O ATOM 740 ND2 ASN A 50 9.363 -13.587 -6.117 1.00 0.00 N ATOM 0 H ASN A 50 11.981 -11.177 -2.297 1.00 0.00 H new ATOM 0 HA ASN A 50 12.672 -11.522 -5.107 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.714 -13.727 -4.398 1.00 0.00 H new ATOM 0 HB3 ASN A 50 10.268 -12.900 -3.856 1.00 0.00 H new ATOM 0 HD21 ASN A 50 8.935 -13.680 -7.038 1.00 0.00 H new ATOM 0 HD22 ASN A 50 8.908 -13.994 -5.300 1.00 0.00 H new ATOM 747 N GLY A 51 10.905 -9.791 -5.606 1.00 0.00 N ATOM 748 CA GLY A 51 10.154 -8.578 -5.802 1.00 0.00 C ATOM 749 C GLY A 51 8.685 -8.852 -5.999 1.00 0.00 C ATOM 750 O GLY A 51 8.119 -8.525 -7.044 1.00 0.00 O ATOM 0 H GLY A 51 11.340 -10.159 -6.452 1.00 0.00 H new ATOM 0 HA2 GLY A 51 10.289 -7.924 -4.940 1.00 0.00 H new ATOM 0 HA3 GLY A 51 10.544 -8.046 -6.670 1.00 0.00 H new ATOM 754 N ASN A 52 8.079 -9.481 -5.000 1.00 0.00 N ATOM 755 CA ASN A 52 6.631 -9.687 -4.967 1.00 0.00 C ATOM 756 C ASN A 52 5.926 -8.362 -4.706 1.00 0.00 C ATOM 757 O ASN A 52 5.170 -8.216 -3.742 1.00 0.00 O ATOM 758 CB ASN A 52 6.238 -10.701 -3.882 1.00 0.00 C ATOM 759 CG ASN A 52 6.628 -12.127 -4.225 1.00 0.00 C ATOM 760 OD1 ASN A 52 6.674 -12.511 -5.392 1.00 0.00 O ATOM 761 ND2 ASN A 52 6.902 -12.927 -3.203 1.00 0.00 N ATOM 0 H ASN A 52 8.572 -9.862 -4.192 1.00 0.00 H new ATOM 0 HA ASN A 52 6.324 -10.084 -5.935 1.00 0.00 H new ATOM 0 HB2 ASN A 52 6.711 -10.418 -2.942 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.161 -10.654 -3.724 1.00 0.00 H new ATOM 0 HD21 ASN A 52 7.162 -13.899 -3.371 1.00 0.00 H new ATOM 0 HD22 ASN A 52 6.853 -12.570 -2.249 1.00 0.00 H new ATOM 768 N ILE A 53 6.196 -7.394 -5.566 1.00 0.00 N ATOM 769 CA ILE A 53 5.659 -6.064 -5.418 1.00 0.00 C ATOM 770 C ILE A 53 4.745 -5.730 -6.580 1.00 0.00 C ATOM 771 O ILE A 53 5.003 -6.102 -7.727 1.00 0.00 O ATOM 772 CB ILE A 53 6.789 -5.005 -5.291 1.00 0.00 C ATOM 773 CG1 ILE A 53 6.237 -3.573 -5.158 1.00 0.00 C ATOM 774 CG2 ILE A 53 7.747 -5.091 -6.470 1.00 0.00 C ATOM 775 CD1 ILE A 53 6.054 -2.841 -6.477 1.00 0.00 C ATOM 0 H ILE A 53 6.794 -7.514 -6.384 1.00 0.00 H new ATOM 0 HA ILE A 53 5.078 -6.040 -4.496 1.00 0.00 H new ATOM 0 HB ILE A 53 7.332 -5.233 -4.374 1.00 0.00 H new ATOM 0 HG12 ILE A 53 5.277 -3.614 -4.644 1.00 0.00 H new ATOM 0 HG13 ILE A 53 6.912 -2.995 -4.527 1.00 0.00 H new ATOM 0 HG21 ILE A 53 8.529 -4.340 -6.359 1.00 0.00 H new ATOM 0 HG22 ILE A 53 8.198 -6.083 -6.501 1.00 0.00 H new ATOM 0 HG23 ILE A 53 7.201 -4.912 -7.396 1.00 0.00 H new ATOM 0 HD11 ILE A 53 5.662 -1.842 -6.287 1.00 0.00 H new ATOM 0 HD12 ILE A 53 7.015 -2.763 -6.986 1.00 0.00 H new ATOM 0 HD13 ILE A 53 5.354 -3.392 -7.105 1.00 0.00 H new ATOM 787 N ILE A 54 3.668 -5.049 -6.262 1.00 0.00 N ATOM 788 CA ILE A 54 2.769 -4.532 -7.267 1.00 0.00 C ATOM 789 C ILE A 54 2.677 -3.016 -7.097 1.00 0.00 C ATOM 790 O ILE A 54 2.516 -2.514 -5.982 1.00 0.00 O ATOM 791 CB ILE A 54 1.372 -5.201 -7.184 1.00 0.00 C ATOM 792 CG1 ILE A 54 0.589 -4.960 -8.471 1.00 0.00 C ATOM 793 CG2 ILE A 54 0.581 -4.731 -5.979 1.00 0.00 C ATOM 794 CD1 ILE A 54 1.110 -5.773 -9.634 1.00 0.00 C ATOM 0 H ILE A 54 3.391 -4.839 -5.303 1.00 0.00 H new ATOM 0 HA ILE A 54 3.159 -4.765 -8.258 1.00 0.00 H new ATOM 0 HB ILE A 54 1.532 -6.272 -7.062 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.460 -5.204 -8.304 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.633 -3.901 -8.725 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.389 -5.227 -5.965 1.00 0.00 H new ATOM 0 HG22 ILE A 54 1.127 -4.975 -5.068 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.436 -3.652 -6.037 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.515 -5.561 -10.522 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.151 -5.511 -9.824 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.041 -6.834 -9.396 1.00 0.00 H new ATOM 806 N ALA A 55 2.848 -2.283 -8.183 1.00 0.00 N ATOM 807 CA ALA A 55 2.909 -0.835 -8.100 1.00 0.00 C ATOM 808 C ALA A 55 1.512 -0.226 -8.138 1.00 0.00 C ATOM 809 O ALA A 55 0.710 -0.542 -9.019 1.00 0.00 O ATOM 810 CB ALA A 55 3.772 -0.272 -9.218 1.00 0.00 C ATOM 0 H ALA A 55 2.946 -2.662 -9.125 1.00 0.00 H new ATOM 0 HA ALA A 55 3.365 -0.569 -7.146 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.806 0.815 -9.139 1.00 0.00 H new ATOM 0 HB2 ALA A 55 4.782 -0.673 -9.135 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.348 -0.553 -10.182 1.00 0.00 H new ATOM 816 N ALA A 56 1.226 0.635 -7.173 1.00 0.00 N ATOM 817 CA ALA A 56 -0.056 1.321 -7.113 1.00 0.00 C ATOM 818 C ALA A 56 -0.073 2.480 -8.102 1.00 0.00 C ATOM 819 O ALA A 56 0.985 2.973 -8.505 1.00 0.00 O ATOM 820 CB ALA A 56 -0.318 1.820 -5.699 1.00 0.00 C ATOM 0 H ALA A 56 1.868 0.876 -6.418 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.847 0.621 -7.384 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -1.280 2.332 -5.666 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -0.333 0.974 -5.012 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.471 2.512 -5.405 1.00 0.00 H new ATOM 826 N SER A 57 -1.259 2.919 -8.493 1.00 0.00 N ATOM 827 CA SER A 57 -1.374 4.009 -9.438 1.00 0.00 C ATOM 828 C SER A 57 -2.192 5.125 -8.816 1.00 0.00 C ATOM 829 O SER A 57 -3.329 4.918 -8.408 1.00 0.00 O ATOM 830 CB SER A 57 -2.043 3.526 -10.722 1.00 0.00 C ATOM 831 OG SER A 57 -1.706 4.352 -11.825 1.00 0.00 O ATOM 0 H SER A 57 -2.148 2.537 -8.171 1.00 0.00 H new ATOM 0 HA SER A 57 -0.379 4.379 -9.684 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.739 2.500 -10.928 1.00 0.00 H new ATOM 0 HB3 SER A 57 -3.125 3.518 -10.589 1.00 0.00 H new ATOM 0 HG SER A 57 -2.148 4.016 -12.632 1.00 0.00 H new ATOM 837 N PHE A 58 -1.618 6.299 -8.724 1.00 0.00 N ATOM 838 CA PHE A 58 -2.310 7.398 -8.119 1.00 0.00 C ATOM 839 C PHE A 58 -3.250 8.066 -9.101 1.00 0.00 C ATOM 840 O PHE A 58 -2.938 8.240 -10.280 1.00 0.00 O ATOM 841 CB PHE A 58 -1.348 8.408 -7.503 1.00 0.00 C ATOM 842 CG PHE A 58 -0.382 9.004 -8.474 1.00 0.00 C ATOM 843 CD1 PHE A 58 -0.794 10.006 -9.317 1.00 0.00 C ATOM 844 CD2 PHE A 58 0.928 8.558 -8.550 1.00 0.00 C ATOM 845 CE1 PHE A 58 0.064 10.561 -10.219 1.00 0.00 C ATOM 846 CE2 PHE A 58 1.806 9.116 -9.459 1.00 0.00 C ATOM 847 CZ PHE A 58 1.371 10.122 -10.299 1.00 0.00 C ATOM 0 H PHE A 58 -0.679 6.513 -9.060 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.911 6.988 -7.307 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -1.926 9.210 -7.044 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -0.789 7.920 -6.704 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -1.813 10.360 -9.265 1.00 0.00 H new ATOM 0 HD2 PHE A 58 1.265 7.769 -7.894 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -0.280 11.348 -10.874 1.00 0.00 H new ATOM 0 HE2 PHE A 58 2.827 8.767 -9.512 1.00 0.00 H new ATOM 0 HZ PHE A 58 2.049 10.563 -11.015 1.00 0.00 H new ATOM 857 N SER A 59 -4.419 8.398 -8.604 1.00 0.00 N ATOM 858 CA SER A 59 -5.372 9.180 -9.355 1.00 0.00 C ATOM 859 C SER A 59 -5.216 10.626 -8.922 1.00 0.00 C ATOM 860 O SER A 59 -5.227 11.546 -9.738 1.00 0.00 O ATOM 861 CB SER A 59 -6.799 8.679 -9.109 1.00 0.00 C ATOM 862 OG SER A 59 -6.948 7.330 -9.534 1.00 0.00 O ATOM 0 H SER A 59 -4.735 8.134 -7.671 1.00 0.00 H new ATOM 0 HA SER A 59 -5.186 9.087 -10.425 1.00 0.00 H new ATOM 0 HB2 SER A 59 -7.038 8.758 -8.048 1.00 0.00 H new ATOM 0 HB3 SER A 59 -7.507 9.312 -9.643 1.00 0.00 H new ATOM 0 HG SER A 59 -6.886 6.734 -8.759 1.00 0.00 H new ATOM 868 N GLY A 60 -5.045 10.810 -7.618 1.00 0.00 N ATOM 869 CA GLY A 60 -4.674 12.105 -7.100 1.00 0.00 C ATOM 870 C GLY A 60 -5.697 12.693 -6.155 1.00 0.00 C ATOM 871 O GLY A 60 -5.625 12.467 -4.953 1.00 0.00 O ATOM 0 H GLY A 60 -5.158 10.082 -6.913 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -3.719 12.020 -6.582 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -4.524 12.791 -7.933 1.00 0.00 H new ATOM 875 N PRO A 61 -6.687 13.412 -6.693 1.00 0.00 N ATOM 876 CA PRO A 61 -7.603 14.268 -5.923 1.00 0.00 C ATOM 877 C PRO A 61 -8.312 13.601 -4.750 1.00 0.00 C ATOM 878 O PRO A 61 -9.055 12.625 -4.904 1.00 0.00 O ATOM 879 CB PRO A 61 -8.649 14.685 -6.952 1.00 0.00 C ATOM 880 CG PRO A 61 -8.496 13.699 -8.054 1.00 0.00 C ATOM 881 CD PRO A 61 -7.031 13.442 -8.118 1.00 0.00 C ATOM 0 HA PRO A 61 -7.033 15.073 -5.460 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.654 14.658 -6.531 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -8.478 15.703 -7.303 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -9.052 12.784 -7.849 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -8.872 14.095 -8.997 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -6.799 12.501 -8.618 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -6.498 14.227 -8.654 1.00 0.00 H new ATOM 889 N ILE A 62 -8.056 14.148 -3.580 1.00 0.00 N ATOM 890 CA ILE A 62 -8.888 13.927 -2.410 1.00 0.00 C ATOM 891 C ILE A 62 -9.345 15.284 -1.887 1.00 0.00 C ATOM 892 O ILE A 62 -8.658 15.924 -1.088 1.00 0.00 O ATOM 893 CB ILE A 62 -8.160 13.144 -1.292 1.00 0.00 C ATOM 894 CG1 ILE A 62 -7.852 11.722 -1.759 1.00 0.00 C ATOM 895 CG2 ILE A 62 -9.005 13.103 -0.031 1.00 0.00 C ATOM 896 CD1 ILE A 62 -7.312 10.832 -0.666 1.00 0.00 C ATOM 0 H ILE A 62 -7.260 14.763 -3.410 1.00 0.00 H new ATOM 0 HA ILE A 62 -9.739 13.314 -2.708 1.00 0.00 H new ATOM 0 HB ILE A 62 -7.224 13.656 -1.068 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.761 11.276 -2.164 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.128 11.764 -2.573 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -8.476 12.548 0.744 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -9.192 14.120 0.315 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -9.954 12.612 -0.245 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.116 9.838 -1.069 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.386 11.255 -0.277 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.044 10.759 0.139 1.00 0.00 H new ATOM 908 N SER A 63 -10.486 15.736 -2.375 1.00 0.00 N ATOM 909 CA SER A 63 -10.985 17.061 -2.050 1.00 0.00 C ATOM 910 C SER A 63 -11.465 17.119 -0.606 1.00 0.00 C ATOM 911 O SER A 63 -12.392 16.404 -0.217 1.00 0.00 O ATOM 912 CB SER A 63 -12.115 17.439 -3.005 1.00 0.00 C ATOM 913 OG SER A 63 -11.692 17.327 -4.355 1.00 0.00 O ATOM 0 H SER A 63 -11.088 15.202 -3.002 1.00 0.00 H new ATOM 0 HA SER A 63 -10.171 17.777 -2.163 1.00 0.00 H new ATOM 0 HB2 SER A 63 -12.974 16.791 -2.833 1.00 0.00 H new ATOM 0 HB3 SER A 63 -12.441 18.460 -2.805 1.00 0.00 H new ATOM 0 HG SER A 63 -12.431 17.572 -4.951 1.00 0.00 H new ATOM 919 N GLY A 64 -10.816 17.964 0.179 1.00 0.00 N ATOM 920 CA GLY A 64 -11.164 18.100 1.577 1.00 0.00 C ATOM 921 C GLY A 64 -9.954 17.969 2.477 1.00 0.00 C ATOM 922 O GLY A 64 -10.013 18.298 3.665 1.00 0.00 O ATOM 0 H GLY A 64 -10.049 18.562 -0.130 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -11.635 19.069 1.741 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -11.898 17.340 1.844 1.00 0.00 H new ATOM 926 N SER A 65 -8.858 17.476 1.913 1.00 0.00 N ATOM 927 CA SER A 65 -7.613 17.302 2.651 1.00 0.00 C ATOM 928 C SER A 65 -6.435 17.315 1.684 1.00 0.00 C ATOM 929 O SER A 65 -6.621 17.207 0.472 1.00 0.00 O ATOM 930 CB SER A 65 -7.628 15.976 3.414 1.00 0.00 C ATOM 931 OG SER A 65 -8.813 15.843 4.179 1.00 0.00 O ATOM 0 H SER A 65 -8.807 17.187 0.936 1.00 0.00 H new ATOM 0 HA SER A 65 -7.512 18.121 3.363 1.00 0.00 H new ATOM 0 HB2 SER A 65 -7.550 15.147 2.711 1.00 0.00 H new ATOM 0 HB3 SER A 65 -6.759 15.920 4.070 1.00 0.00 H new ATOM 0 HG SER A 65 -9.135 14.919 4.125 1.00 0.00 H new ATOM 937 N ASN A 66 -5.227 17.434 2.214 1.00 0.00 N ATOM 938 CA ASN A 66 -4.036 17.402 1.378 1.00 0.00 C ATOM 939 C ASN A 66 -3.520 15.975 1.287 1.00 0.00 C ATOM 940 O ASN A 66 -2.457 15.637 1.807 1.00 0.00 O ATOM 941 CB ASN A 66 -2.953 18.346 1.915 1.00 0.00 C ATOM 942 CG ASN A 66 -1.772 18.479 0.965 1.00 0.00 C ATOM 943 OD1 ASN A 66 -0.770 17.774 1.088 1.00 0.00 O ATOM 944 ND2 ASN A 66 -1.882 19.388 0.007 1.00 0.00 N ATOM 0 H ASN A 66 -5.046 17.553 3.211 1.00 0.00 H new ATOM 0 HA ASN A 66 -4.299 17.750 0.379 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -3.388 19.330 2.089 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -2.600 17.978 2.879 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -1.121 19.521 -0.659 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -2.727 19.954 -0.064 1.00 0.00 H new ATOM 951 N TYR A 67 -4.315 15.132 0.650 1.00 0.00 N ATOM 952 CA TYR A 67 -3.972 13.735 0.444 1.00 0.00 C ATOM 953 C TYR A 67 -4.311 13.330 -0.971 1.00 0.00 C ATOM 954 O TYR A 67 -5.200 13.908 -1.597 1.00 0.00 O ATOM 955 CB TYR A 67 -4.728 12.830 1.420 1.00 0.00 C ATOM 956 CG TYR A 67 -3.912 12.388 2.611 1.00 0.00 C ATOM 957 CD1 TYR A 67 -3.377 13.314 3.478 1.00 0.00 C ATOM 958 CD2 TYR A 67 -3.700 11.045 2.875 1.00 0.00 C ATOM 959 CE1 TYR A 67 -2.648 12.923 4.582 1.00 0.00 C ATOM 960 CE2 TYR A 67 -2.971 10.638 3.973 1.00 0.00 C ATOM 961 CZ TYR A 67 -2.445 11.583 4.823 1.00 0.00 C ATOM 962 OH TYR A 67 -1.718 11.184 5.917 1.00 0.00 O ATOM 0 H TYR A 67 -5.219 15.398 0.260 1.00 0.00 H new ATOM 0 HA TYR A 67 -2.902 13.621 0.621 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -5.613 13.357 1.775 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -5.076 11.947 0.884 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -3.531 14.366 3.290 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -4.113 10.302 2.209 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -2.239 13.664 5.253 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.815 9.587 4.164 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.975 10.615 5.626 1.00 0.00 H new ATOM 972 N GLU A 68 -3.601 12.346 -1.467 1.00 0.00 N ATOM 973 CA GLU A 68 -3.858 11.825 -2.793 1.00 0.00 C ATOM 974 C GLU A 68 -4.535 10.467 -2.693 1.00 0.00 C ATOM 975 O GLU A 68 -4.642 9.897 -1.604 1.00 0.00 O ATOM 976 CB GLU A 68 -2.559 11.727 -3.604 1.00 0.00 C ATOM 977 CG GLU A 68 -2.117 13.030 -4.247 1.00 0.00 C ATOM 978 CD GLU A 68 -1.826 14.133 -3.249 1.00 0.00 C ATOM 979 OE1 GLU A 68 -0.987 13.926 -2.352 1.00 0.00 O ATOM 980 OE2 GLU A 68 -2.409 15.229 -3.384 1.00 0.00 O ATOM 0 H GLU A 68 -2.837 11.886 -0.972 1.00 0.00 H new ATOM 0 HA GLU A 68 -4.524 12.512 -3.315 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.763 11.371 -2.950 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.689 10.977 -4.384 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.223 12.846 -4.843 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.894 13.368 -4.933 1.00 0.00 H new ATOM 987 N TYR A 69 -4.929 9.914 -3.833 1.00 0.00 N ATOM 988 CA TYR A 69 -5.834 8.789 -3.847 1.00 0.00 C ATOM 989 C TYR A 69 -5.342 7.808 -4.869 1.00 0.00 C ATOM 990 O TYR A 69 -5.281 8.107 -6.063 1.00 0.00 O ATOM 991 CB TYR A 69 -7.266 9.214 -4.165 1.00 0.00 C ATOM 992 CG TYR A 69 -8.293 8.242 -3.631 1.00 0.00 C ATOM 993 CD1 TYR A 69 -8.151 7.710 -2.357 1.00 0.00 C ATOM 994 CD2 TYR A 69 -9.400 7.864 -4.381 1.00 0.00 C ATOM 995 CE1 TYR A 69 -9.080 6.831 -1.840 1.00 0.00 C ATOM 996 CE2 TYR A 69 -10.337 6.979 -3.871 1.00 0.00 C ATOM 997 CZ TYR A 69 -10.169 6.466 -2.598 1.00 0.00 C ATOM 998 OH TYR A 69 -11.097 5.593 -2.075 1.00 0.00 O ATOM 0 H TYR A 69 -4.632 10.231 -4.756 1.00 0.00 H new ATOM 0 HA TYR A 69 -5.853 8.335 -2.856 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -7.451 10.201 -3.741 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.383 9.304 -5.245 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.296 7.990 -1.759 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -9.532 8.265 -5.375 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.953 6.431 -0.845 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -11.193 6.692 -4.464 1.00 0.00 H new ATOM 0 HH TYR A 69 -11.806 5.436 -2.733 1.00 0.00 H new ATOM 1008 N TRP A 70 -4.968 6.656 -4.389 1.00 0.00 N ATOM 1009 CA TRP A 70 -4.186 5.741 -5.162 1.00 0.00 C ATOM 1010 C TRP A 70 -4.979 4.474 -5.407 1.00 0.00 C ATOM 1011 O TRP A 70 -5.396 3.820 -4.470 1.00 0.00 O ATOM 1012 CB TRP A 70 -2.909 5.461 -4.381 1.00 0.00 C ATOM 1013 CG TRP A 70 -2.191 6.713 -3.916 1.00 0.00 C ATOM 1014 CD1 TRP A 70 -2.640 7.701 -3.109 1.00 0.00 C ATOM 1015 CD2 TRP A 70 -0.864 7.062 -4.214 1.00 0.00 C ATOM 1016 NE1 TRP A 70 -1.650 8.637 -2.929 1.00 0.00 N ATOM 1017 CE2 TRP A 70 -0.551 8.250 -3.586 1.00 0.00 C ATOM 1018 CE3 TRP A 70 0.055 6.454 -4.955 1.00 0.00 C ATOM 1019 CZ2 TRP A 70 0.700 8.847 -3.686 1.00 0.00 C ATOM 1020 CZ3 TRP A 70 1.312 6.998 -5.083 1.00 0.00 C ATOM 1021 CH2 TRP A 70 1.632 8.198 -4.435 1.00 0.00 C ATOM 0 H TRP A 70 -5.198 6.327 -3.451 1.00 0.00 H new ATOM 0 HA TRP A 70 -3.933 6.157 -6.137 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -3.152 4.849 -3.513 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -2.233 4.876 -5.005 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -3.627 7.747 -2.672 1.00 0.00 H new ATOM 0 HE1 TRP A 70 -1.739 9.492 -2.381 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -0.185 5.529 -5.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 0.922 9.782 -3.193 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 2.055 6.498 -5.686 1.00 0.00 H new ATOM 0 HH2 TRP A 70 2.625 8.611 -4.531 1.00 0.00 H new ATOM 1032 N THR A 71 -5.186 4.131 -6.656 1.00 0.00 N ATOM 1033 CA THR A 71 -6.080 3.046 -7.009 1.00 0.00 C ATOM 1034 C THR A 71 -5.393 2.074 -7.946 1.00 0.00 C ATOM 1035 O THR A 71 -4.523 2.472 -8.728 1.00 0.00 O ATOM 1036 CB THR A 71 -7.351 3.596 -7.683 1.00 0.00 C ATOM 1037 OG1 THR A 71 -7.005 4.674 -8.563 1.00 0.00 O ATOM 1038 CG2 THR A 71 -8.355 4.079 -6.649 1.00 0.00 C ATOM 0 H THR A 71 -4.745 4.590 -7.453 1.00 0.00 H new ATOM 0 HA THR A 71 -6.356 2.523 -6.093 1.00 0.00 H new ATOM 0 HB THR A 71 -7.811 2.789 -8.254 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.816 5.020 -8.991 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.242 4.462 -7.154 1.00 0.00 H new ATOM 0 HG22 THR A 71 -8.636 3.250 -6.000 1.00 0.00 H new ATOM 0 HG23 THR A 71 -7.908 4.872 -6.050 1.00 0.00 H new ATOM 1046 N PHE A 72 -5.744 0.796 -7.849 1.00 0.00 N ATOM 1047 CA PHE A 72 -5.225 -0.177 -8.789 1.00 0.00 C ATOM 1048 C PHE A 72 -5.845 -1.554 -8.593 1.00 0.00 C ATOM 1049 O PHE A 72 -6.402 -1.865 -7.536 1.00 0.00 O ATOM 1050 CB PHE A 72 -3.696 -0.284 -8.680 1.00 0.00 C ATOM 1051 CG PHE A 72 -3.217 -1.024 -7.462 1.00 0.00 C ATOM 1052 CD1 PHE A 72 -3.516 -0.570 -6.185 1.00 0.00 C ATOM 1053 CD2 PHE A 72 -2.469 -2.178 -7.600 1.00 0.00 C ATOM 1054 CE1 PHE A 72 -3.076 -1.258 -5.071 1.00 0.00 C ATOM 1055 CE2 PHE A 72 -2.028 -2.865 -6.491 1.00 0.00 C ATOM 1056 CZ PHE A 72 -2.330 -2.406 -5.227 1.00 0.00 C ATOM 0 H PHE A 72 -6.374 0.420 -7.141 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.494 0.178 -9.784 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.313 -0.784 -9.570 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -3.272 0.720 -8.672 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -4.099 0.331 -6.061 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -2.228 -2.544 -8.587 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -3.316 -0.898 -4.082 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.444 -3.766 -6.612 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.982 -2.946 -4.359 1.00 0.00 H new ATOM 1066 N SER A 73 -5.753 -2.362 -9.635 1.00 0.00 N ATOM 1067 CA SER A 73 -6.078 -3.771 -9.554 1.00 0.00 C ATOM 1068 C SER A 73 -4.808 -4.577 -9.807 1.00 0.00 C ATOM 1069 O SER A 73 -3.940 -4.147 -10.572 1.00 0.00 O ATOM 1070 CB SER A 73 -7.162 -4.129 -10.570 1.00 0.00 C ATOM 1071 OG SER A 73 -8.311 -3.314 -10.394 1.00 0.00 O ATOM 0 H SER A 73 -5.451 -2.057 -10.560 1.00 0.00 H new ATOM 0 HA SER A 73 -6.467 -4.006 -8.563 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.774 -4.004 -11.581 1.00 0.00 H new ATOM 0 HB3 SER A 73 -7.436 -5.178 -10.461 1.00 0.00 H new ATOM 0 HG SER A 73 -8.991 -3.560 -11.056 1.00 0.00 H new ATOM 1077 N ALA A 74 -4.686 -5.721 -9.155 1.00 0.00 N ATOM 1078 CA ALA A 74 -3.463 -6.505 -9.227 1.00 0.00 C ATOM 1079 C ALA A 74 -3.737 -7.999 -9.349 1.00 0.00 C ATOM 1080 O ALA A 74 -4.488 -8.569 -8.559 1.00 0.00 O ATOM 1081 CB ALA A 74 -2.615 -6.244 -7.993 1.00 0.00 C ATOM 0 H ALA A 74 -5.417 -6.127 -8.571 1.00 0.00 H new ATOM 0 HA ALA A 74 -2.931 -6.195 -10.126 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -1.699 -6.833 -8.050 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -2.363 -5.185 -7.942 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.174 -6.527 -7.101 1.00 0.00 H new ATOM 1087 N SER A 75 -3.120 -8.634 -10.328 1.00 0.00 N ATOM 1088 CA SER A 75 -3.174 -10.080 -10.439 1.00 0.00 C ATOM 1089 C SER A 75 -2.139 -10.695 -9.501 1.00 0.00 C ATOM 1090 O SER A 75 -0.945 -10.713 -9.798 1.00 0.00 O ATOM 1091 CB SER A 75 -2.918 -10.521 -11.887 1.00 0.00 C ATOM 1092 OG SER A 75 -3.017 -11.931 -12.026 1.00 0.00 O ATOM 0 H SER A 75 -2.576 -8.172 -11.057 1.00 0.00 H new ATOM 0 HA SER A 75 -4.168 -10.425 -10.155 1.00 0.00 H new ATOM 0 HB2 SER A 75 -3.637 -10.038 -12.548 1.00 0.00 H new ATOM 0 HB3 SER A 75 -1.927 -10.192 -12.199 1.00 0.00 H new ATOM 0 HG SER A 75 -2.850 -12.180 -12.959 1.00 0.00 H new ATOM 1098 N VAL A 76 -2.598 -11.173 -8.353 1.00 0.00 N ATOM 1099 CA VAL A 76 -1.703 -11.768 -7.372 1.00 0.00 C ATOM 1100 C VAL A 76 -1.729 -13.286 -7.499 1.00 0.00 C ATOM 1101 O VAL A 76 -2.730 -13.861 -7.927 1.00 0.00 O ATOM 1102 CB VAL A 76 -2.060 -11.336 -5.925 1.00 0.00 C ATOM 1103 CG1 VAL A 76 -2.031 -9.824 -5.802 1.00 0.00 C ATOM 1104 CG2 VAL A 76 -3.418 -11.860 -5.501 1.00 0.00 C ATOM 0 H VAL A 76 -3.580 -11.161 -8.079 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.695 -11.407 -7.577 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.310 -11.768 -5.262 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.284 -9.537 -4.781 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.033 -9.458 -6.045 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.755 -9.389 -6.491 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.631 -11.536 -4.482 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.184 -11.472 -6.173 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.417 -12.949 -5.543 1.00 0.00 H new ATOM 1114 N LYS A 77 -0.630 -13.932 -7.136 1.00 0.00 N ATOM 1115 CA LYS A 77 -0.478 -15.368 -7.356 1.00 0.00 C ATOM 1116 C LYS A 77 -0.774 -16.151 -6.082 1.00 0.00 C ATOM 1117 O LYS A 77 -0.504 -17.351 -5.996 1.00 0.00 O ATOM 1118 CB LYS A 77 0.941 -15.703 -7.842 1.00 0.00 C ATOM 1119 CG LYS A 77 1.321 -15.097 -9.190 1.00 0.00 C ATOM 1120 CD LYS A 77 1.643 -13.615 -9.081 1.00 0.00 C ATOM 1121 CE LYS A 77 2.236 -13.075 -10.371 1.00 0.00 C ATOM 1122 NZ LYS A 77 3.492 -13.782 -10.742 1.00 0.00 N ATOM 0 H LYS A 77 0.171 -13.487 -6.688 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.195 -15.656 -8.125 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.655 -15.362 -7.093 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.040 -16.787 -7.907 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.184 -15.626 -9.594 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.501 -15.239 -9.894 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.736 -13.062 -8.838 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.344 -13.454 -8.262 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.509 -13.179 -11.176 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.438 -12.010 -10.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.046 -13.187 -11.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 4.049 -13.972 -9.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.259 -14.681 -11.210 1.00 0.00 H new ATOM 1136 N GLY A 78 -1.330 -15.468 -5.100 1.00 0.00 N ATOM 1137 CA GLY A 78 -1.590 -16.087 -3.819 1.00 0.00 C ATOM 1138 C GLY A 78 -0.952 -15.302 -2.702 1.00 0.00 C ATOM 1139 O GLY A 78 0.254 -15.368 -2.500 1.00 0.00 O ATOM 0 H GLY A 78 -1.609 -14.489 -5.166 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -2.665 -16.153 -3.654 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.204 -17.107 -3.818 1.00 0.00 H new ATOM 1143 N ILE A 79 -1.756 -14.539 -1.990 1.00 0.00 N ATOM 1144 CA ILE A 79 -1.256 -13.642 -0.974 1.00 0.00 C ATOM 1145 C ILE A 79 -1.749 -14.052 0.405 1.00 0.00 C ATOM 1146 O ILE A 79 -2.768 -14.729 0.531 1.00 0.00 O ATOM 1147 CB ILE A 79 -1.701 -12.214 -1.305 1.00 0.00 C ATOM 1148 CG1 ILE A 79 -1.284 -11.209 -0.247 1.00 0.00 C ATOM 1149 CG2 ILE A 79 -3.197 -12.152 -1.501 1.00 0.00 C ATOM 1150 CD1 ILE A 79 -1.592 -9.797 -0.666 1.00 0.00 C ATOM 0 H ILE A 79 -2.770 -14.525 -2.100 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.167 -13.689 -0.960 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.197 -11.943 -2.233 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.798 -11.431 0.688 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -0.216 -11.306 -0.054 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.491 -11.129 -1.735 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -3.484 -12.809 -2.322 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.697 -12.473 -0.587 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.278 -9.108 0.118 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.057 -9.566 -1.587 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.664 -9.693 -0.833 1.00 0.00 H new ATOM 1162 N LYS A 80 -1.017 -13.650 1.430 1.00 0.00 N ATOM 1163 CA LYS A 80 -1.349 -14.031 2.789 1.00 0.00 C ATOM 1164 C LYS A 80 -1.153 -12.876 3.763 1.00 0.00 C ATOM 1165 O LYS A 80 -1.999 -12.614 4.619 1.00 0.00 O ATOM 1166 CB LYS A 80 -0.479 -15.198 3.224 1.00 0.00 C ATOM 1167 CG LYS A 80 -0.900 -15.764 4.559 1.00 0.00 C ATOM 1168 CD LYS A 80 -2.227 -16.500 4.463 1.00 0.00 C ATOM 1169 CE LYS A 80 -2.079 -17.825 3.737 1.00 0.00 C ATOM 1170 NZ LYS A 80 -1.276 -18.796 4.522 1.00 0.00 N ATOM 0 H LYS A 80 -0.189 -13.060 1.345 1.00 0.00 H new ATOM 0 HA LYS A 80 -2.401 -14.317 2.802 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -0.525 -15.983 2.469 1.00 0.00 H new ATOM 0 HB3 LYS A 80 0.559 -14.872 3.282 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.131 -16.445 4.924 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.983 -14.957 5.287 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.620 -16.675 5.464 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -2.953 -15.877 3.940 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -3.066 -18.244 3.540 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.605 -17.659 2.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -1.225 -19.699 4.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -0.316 -18.422 4.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.724 -18.948 5.448 1.00 0.00 H new ATOM 1184 N GLU A 81 -0.029 -12.204 3.634 1.00 0.00 N ATOM 1185 CA GLU A 81 0.326 -11.121 4.539 1.00 0.00 C ATOM 1186 C GLU A 81 1.131 -10.081 3.785 1.00 0.00 C ATOM 1187 O GLU A 81 1.716 -10.401 2.754 1.00 0.00 O ATOM 1188 CB GLU A 81 1.144 -11.653 5.714 1.00 0.00 C ATOM 1189 CG GLU A 81 2.540 -12.114 5.328 1.00 0.00 C ATOM 1190 CD GLU A 81 3.504 -12.115 6.496 1.00 0.00 C ATOM 1191 OE1 GLU A 81 4.046 -11.039 6.822 1.00 0.00 O ATOM 1192 OE2 GLU A 81 3.739 -13.190 7.088 1.00 0.00 O ATOM 0 H GLU A 81 0.662 -12.387 2.907 1.00 0.00 H new ATOM 0 HA GLU A 81 -0.587 -10.670 4.927 1.00 0.00 H new ATOM 0 HB2 GLU A 81 1.225 -10.873 6.471 1.00 0.00 H new ATOM 0 HB3 GLU A 81 0.609 -12.486 6.170 1.00 0.00 H new ATOM 0 HG2 GLU A 81 2.483 -13.119 4.910 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.928 -11.464 4.544 1.00 0.00 H new ATOM 1199 N PHE A 82 1.152 -8.839 4.262 1.00 0.00 N ATOM 1200 CA PHE A 82 1.911 -7.808 3.564 1.00 0.00 C ATOM 1201 C PHE A 82 1.990 -6.507 4.342 1.00 0.00 C ATOM 1202 O PHE A 82 1.437 -6.373 5.438 1.00 0.00 O ATOM 1203 CB PHE A 82 1.279 -7.523 2.196 1.00 0.00 C ATOM 1204 CG PHE A 82 -0.131 -6.991 2.256 1.00 0.00 C ATOM 1205 CD1 PHE A 82 -1.212 -7.857 2.284 1.00 0.00 C ATOM 1206 CD2 PHE A 82 -0.374 -5.626 2.272 1.00 0.00 C ATOM 1207 CE1 PHE A 82 -2.504 -7.372 2.332 1.00 0.00 C ATOM 1208 CE2 PHE A 82 -1.665 -5.136 2.317 1.00 0.00 C ATOM 1209 CZ PHE A 82 -2.730 -6.011 2.346 1.00 0.00 C ATOM 0 H PHE A 82 0.667 -8.529 5.104 1.00 0.00 H new ATOM 0 HA PHE A 82 2.924 -8.194 3.450 1.00 0.00 H new ATOM 0 HB2 PHE A 82 1.903 -6.804 1.665 1.00 0.00 H new ATOM 0 HB3 PHE A 82 1.282 -8.442 1.610 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.042 -8.923 2.268 1.00 0.00 H new ATOM 0 HD2 PHE A 82 0.457 -4.937 2.249 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.338 -8.058 2.359 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -1.839 -4.070 2.329 1.00 0.00 H new ATOM 0 HZ PHE A 82 -3.741 -5.631 2.380 1.00 0.00 H new ATOM 1219 N TYR A 83 2.689 -5.562 3.731 1.00 0.00 N ATOM 1220 CA TYR A 83 2.697 -4.171 4.143 1.00 0.00 C ATOM 1221 C TYR A 83 2.941 -3.302 2.911 1.00 0.00 C ATOM 1222 O TYR A 83 3.572 -3.744 1.946 1.00 0.00 O ATOM 1223 CB TYR A 83 3.739 -3.894 5.242 1.00 0.00 C ATOM 1224 CG TYR A 83 5.000 -4.735 5.169 1.00 0.00 C ATOM 1225 CD1 TYR A 83 5.783 -4.765 4.026 1.00 0.00 C ATOM 1226 CD2 TYR A 83 5.408 -5.493 6.261 1.00 0.00 C ATOM 1227 CE1 TYR A 83 6.935 -5.527 3.967 1.00 0.00 C ATOM 1228 CE2 TYR A 83 6.559 -6.257 6.211 1.00 0.00 C ATOM 1229 CZ TYR A 83 7.319 -6.272 5.063 1.00 0.00 C ATOM 1230 OH TYR A 83 8.466 -7.036 5.007 1.00 0.00 O ATOM 0 H TYR A 83 3.278 -5.747 2.919 1.00 0.00 H new ATOM 0 HA TYR A 83 1.730 -3.927 4.582 1.00 0.00 H new ATOM 0 HB2 TYR A 83 4.021 -2.842 5.195 1.00 0.00 H new ATOM 0 HB3 TYR A 83 3.270 -4.056 6.213 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.488 -4.183 3.166 1.00 0.00 H new ATOM 0 HD2 TYR A 83 4.815 -5.485 7.164 1.00 0.00 H new ATOM 0 HE1 TYR A 83 7.532 -5.539 3.067 1.00 0.00 H new ATOM 0 HE2 TYR A 83 6.861 -6.840 7.069 1.00 0.00 H new ATOM 0 HH TYR A 83 8.264 -7.898 4.588 1.00 0.00 H new ATOM 1240 N ILE A 84 2.406 -2.092 2.909 1.00 0.00 N ATOM 1241 CA ILE A 84 2.548 -1.220 1.755 1.00 0.00 C ATOM 1242 C ILE A 84 3.608 -0.164 2.016 1.00 0.00 C ATOM 1243 O ILE A 84 3.597 0.491 3.054 1.00 0.00 O ATOM 1244 CB ILE A 84 1.218 -0.532 1.387 1.00 0.00 C ATOM 1245 CG1 ILE A 84 0.076 -1.551 1.331 1.00 0.00 C ATOM 1246 CG2 ILE A 84 1.352 0.176 0.049 1.00 0.00 C ATOM 1247 CD1 ILE A 84 0.347 -2.718 0.415 1.00 0.00 C ATOM 0 H ILE A 84 1.875 -1.695 3.684 1.00 0.00 H new ATOM 0 HA ILE A 84 2.851 -1.845 0.915 1.00 0.00 H new ATOM 0 HB ILE A 84 0.985 0.202 2.158 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.113 -1.927 2.337 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.833 -1.047 1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 84 0.408 0.659 -0.203 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.139 0.928 0.112 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.605 -0.550 -0.723 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -0.506 -3.396 0.428 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.506 -2.354 -0.600 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.237 -3.248 0.754 1.00 0.00 H new ATOM 1259 N LYS A 85 4.526 -0.002 1.080 1.00 0.00 N ATOM 1260 CA LYS A 85 5.615 0.912 1.260 1.00 0.00 C ATOM 1261 C LYS A 85 5.319 2.242 0.614 1.00 0.00 C ATOM 1262 O LYS A 85 4.644 2.330 -0.412 1.00 0.00 O ATOM 1263 CB LYS A 85 6.890 0.344 0.663 1.00 0.00 C ATOM 1264 CG LYS A 85 7.262 -1.024 1.190 1.00 0.00 C ATOM 1265 CD LYS A 85 8.649 -1.393 0.725 1.00 0.00 C ATOM 1266 CE LYS A 85 8.704 -1.604 -0.781 1.00 0.00 C ATOM 1267 NZ LYS A 85 10.067 -1.969 -1.244 1.00 0.00 N ATOM 0 H LYS A 85 4.530 -0.498 0.189 1.00 0.00 H new ATOM 0 HA LYS A 85 5.747 1.059 2.332 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.777 0.286 -0.420 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.710 1.034 0.862 1.00 0.00 H new ATOM 0 HG2 LYS A 85 7.221 -1.027 2.279 1.00 0.00 H new ATOM 0 HG3 LYS A 85 6.543 -1.765 0.842 1.00 0.00 H new ATOM 0 HD2 LYS A 85 9.348 -0.606 1.007 1.00 0.00 H new ATOM 0 HD3 LYS A 85 8.972 -2.303 1.231 1.00 0.00 H new ATOM 0 HE2 LYS A 85 8.003 -2.390 -1.062 1.00 0.00 H new ATOM 0 HE3 LYS A 85 8.382 -0.694 -1.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 10.059 -2.103 -2.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 10.732 -1.208 -0.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 10.366 -2.852 -0.782 1.00 0.00 H new ATOM 1281 N TYR A 86 5.845 3.264 1.228 1.00 0.00 N ATOM 1282 CA TYR A 86 5.793 4.600 0.670 1.00 0.00 C ATOM 1283 C TYR A 86 7.194 4.980 0.242 1.00 0.00 C ATOM 1284 O TYR A 86 8.024 5.344 1.076 1.00 0.00 O ATOM 1285 CB TYR A 86 5.254 5.609 1.687 1.00 0.00 C ATOM 1286 CG TYR A 86 5.025 6.985 1.100 1.00 0.00 C ATOM 1287 CD1 TYR A 86 4.461 7.129 -0.155 1.00 0.00 C ATOM 1288 CD2 TYR A 86 5.360 8.132 1.801 1.00 0.00 C ATOM 1289 CE1 TYR A 86 4.238 8.371 -0.699 1.00 0.00 C ATOM 1290 CE2 TYR A 86 5.140 9.385 1.262 1.00 0.00 C ATOM 1291 CZ TYR A 86 4.577 9.498 0.010 1.00 0.00 C ATOM 1292 OH TYR A 86 4.356 10.744 -0.537 1.00 0.00 O ATOM 0 H TYR A 86 6.322 3.203 2.127 1.00 0.00 H new ATOM 0 HA TYR A 86 5.115 4.613 -0.183 1.00 0.00 H new ATOM 0 HB2 TYR A 86 4.316 5.236 2.097 1.00 0.00 H new ATOM 0 HB3 TYR A 86 5.956 5.688 2.517 1.00 0.00 H new ATOM 0 HD1 TYR A 86 4.191 6.248 -0.718 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.800 8.045 2.784 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.798 8.461 -1.681 1.00 0.00 H new ATOM 0 HE2 TYR A 86 5.408 10.271 1.819 1.00 0.00 H new ATOM 0 HH TYR A 86 3.502 11.098 -0.211 1.00 0.00 H new ATOM 1302 N GLU A 87 7.461 4.885 -1.046 1.00 0.00 N ATOM 1303 CA GLU A 87 8.815 5.002 -1.528 1.00 0.00 C ATOM 1304 C GLU A 87 9.044 6.365 -2.162 1.00 0.00 C ATOM 1305 O GLU A 87 8.548 6.672 -3.248 1.00 0.00 O ATOM 1306 CB GLU A 87 9.112 3.870 -2.502 1.00 0.00 C ATOM 1307 CG GLU A 87 10.580 3.528 -2.603 1.00 0.00 C ATOM 1308 CD GLU A 87 10.808 2.135 -3.141 1.00 0.00 C ATOM 1309 OE1 GLU A 87 10.459 1.884 -4.311 1.00 0.00 O ATOM 1310 OE2 GLU A 87 11.348 1.291 -2.399 1.00 0.00 O ATOM 0 H GLU A 87 6.760 4.728 -1.770 1.00 0.00 H new ATOM 0 HA GLU A 87 9.505 4.919 -0.688 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.561 2.982 -2.193 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.743 4.146 -3.490 1.00 0.00 H new ATOM 0 HG2 GLU A 87 11.076 4.251 -3.251 1.00 0.00 H new ATOM 0 HG3 GLU A 87 11.040 3.615 -1.618 1.00 0.00 H new ATOM 1317 N VAL A 88 9.797 7.174 -1.448 1.00 0.00 N ATOM 1318 CA VAL A 88 10.094 8.535 -1.839 1.00 0.00 C ATOM 1319 C VAL A 88 11.573 8.616 -2.216 1.00 0.00 C ATOM 1320 O VAL A 88 12.352 7.732 -1.856 1.00 0.00 O ATOM 1321 CB VAL A 88 9.793 9.478 -0.652 1.00 0.00 C ATOM 1322 CG1 VAL A 88 9.831 10.940 -1.042 1.00 0.00 C ATOM 1323 CG2 VAL A 88 8.461 9.119 -0.009 1.00 0.00 C ATOM 0 H VAL A 88 10.227 6.900 -0.565 1.00 0.00 H new ATOM 0 HA VAL A 88 9.483 8.834 -2.691 1.00 0.00 H new ATOM 0 HB VAL A 88 10.588 9.333 0.080 1.00 0.00 H new ATOM 0 HG11 VAL A 88 9.612 11.555 -0.169 1.00 0.00 H new ATOM 0 HG12 VAL A 88 10.821 11.189 -1.423 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.087 11.130 -1.815 1.00 0.00 H new ATOM 0 HG21 VAL A 88 8.266 9.793 0.825 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.664 9.213 -0.746 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.498 8.093 0.356 1.00 0.00 H new ATOM 1333 N SER A 89 11.964 9.662 -2.936 1.00 0.00 N ATOM 1334 CA SER A 89 13.335 9.788 -3.419 1.00 0.00 C ATOM 1335 C SER A 89 14.307 10.064 -2.272 1.00 0.00 C ATOM 1336 O SER A 89 15.522 9.946 -2.434 1.00 0.00 O ATOM 1337 CB SER A 89 13.421 10.899 -4.457 1.00 0.00 C ATOM 1338 OG SER A 89 12.426 10.736 -5.456 1.00 0.00 O ATOM 0 H SER A 89 11.352 10.435 -3.198 1.00 0.00 H new ATOM 0 HA SER A 89 13.619 8.841 -3.878 1.00 0.00 H new ATOM 0 HB2 SER A 89 13.299 11.867 -3.971 1.00 0.00 H new ATOM 0 HB3 SER A 89 14.409 10.896 -4.918 1.00 0.00 H new ATOM 0 HG SER A 89 12.498 11.461 -6.111 1.00 0.00 H new ATOM 1344 N GLY A 90 13.770 10.446 -1.122 1.00 0.00 N ATOM 1345 CA GLY A 90 14.605 10.682 0.033 1.00 0.00 C ATOM 1346 C GLY A 90 14.044 10.077 1.305 1.00 0.00 C ATOM 1347 O GLY A 90 14.680 10.141 2.355 1.00 0.00 O ATOM 0 H GLY A 90 12.773 10.596 -0.970 1.00 0.00 H new ATOM 0 HA2 GLY A 90 15.597 10.269 -0.152 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.728 11.756 0.172 1.00 0.00 H new ATOM 1351 N LYS A 91 12.857 9.489 1.223 1.00 0.00 N ATOM 1352 CA LYS A 91 12.213 8.937 2.402 1.00 0.00 C ATOM 1353 C LYS A 91 11.488 7.641 2.083 1.00 0.00 C ATOM 1354 O LYS A 91 11.212 7.337 0.926 1.00 0.00 O ATOM 1355 CB LYS A 91 11.227 9.954 2.972 1.00 0.00 C ATOM 1356 CG LYS A 91 11.624 10.483 4.321 1.00 0.00 C ATOM 1357 CD LYS A 91 11.509 9.428 5.413 1.00 0.00 C ATOM 1358 CE LYS A 91 11.836 9.999 6.787 1.00 0.00 C ATOM 1359 NZ LYS A 91 13.210 10.564 6.847 1.00 0.00 N ATOM 0 H LYS A 91 12.326 9.384 0.358 1.00 0.00 H new ATOM 0 HA LYS A 91 12.986 8.718 3.139 1.00 0.00 H new ATOM 0 HB2 LYS A 91 11.135 10.788 2.276 1.00 0.00 H new ATOM 0 HB3 LYS A 91 10.243 9.491 3.047 1.00 0.00 H new ATOM 0 HG2 LYS A 91 12.650 10.848 4.278 1.00 0.00 H new ATOM 0 HG3 LYS A 91 10.993 11.335 4.574 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.498 9.020 5.420 1.00 0.00 H new ATOM 0 HD3 LYS A 91 12.184 8.601 5.193 1.00 0.00 H new ATOM 0 HE2 LYS A 91 11.114 10.776 7.037 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.734 9.216 7.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 13.445 10.801 7.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 13.889 9.863 6.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 13.258 11.423 6.263 1.00 0.00 H new ATOM 1373 N THR A 92 11.220 6.863 3.113 1.00 0.00 N ATOM 1374 CA THR A 92 10.403 5.673 2.986 1.00 0.00 C ATOM 1375 C THR A 92 9.647 5.423 4.282 1.00 0.00 C ATOM 1376 O THR A 92 10.159 5.683 5.373 1.00 0.00 O ATOM 1377 CB THR A 92 11.239 4.426 2.640 1.00 0.00 C ATOM 1378 OG1 THR A 92 12.173 4.735 1.596 1.00 0.00 O ATOM 1379 CG2 THR A 92 10.348 3.274 2.190 1.00 0.00 C ATOM 0 H THR A 92 11.561 7.037 4.058 1.00 0.00 H new ATOM 0 HA THR A 92 9.705 5.848 2.167 1.00 0.00 H new ATOM 0 HB THR A 92 11.775 4.123 3.539 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.701 3.938 1.383 1.00 0.00 H new ATOM 0 HG21 THR A 92 10.965 2.408 1.952 1.00 0.00 H new ATOM 0 HG22 THR A 92 9.654 3.017 2.990 1.00 0.00 H new ATOM 0 HG23 THR A 92 9.786 3.573 1.305 1.00 0.00 H new ATOM 1387 N TYR A 93 8.426 4.944 4.151 1.00 0.00 N ATOM 1388 CA TYR A 93 7.612 4.568 5.298 1.00 0.00 C ATOM 1389 C TYR A 93 6.910 3.264 4.988 1.00 0.00 C ATOM 1390 O TYR A 93 7.155 2.651 3.945 1.00 0.00 O ATOM 1391 CB TYR A 93 6.555 5.630 5.639 1.00 0.00 C ATOM 1392 CG TYR A 93 7.068 7.042 5.678 1.00 0.00 C ATOM 1393 CD1 TYR A 93 7.560 7.606 6.847 1.00 0.00 C ATOM 1394 CD2 TYR A 93 7.040 7.806 4.538 1.00 0.00 C ATOM 1395 CE1 TYR A 93 8.014 8.911 6.864 1.00 0.00 C ATOM 1396 CE2 TYR A 93 7.490 9.110 4.538 1.00 0.00 C ATOM 1397 CZ TYR A 93 7.977 9.659 5.704 1.00 0.00 C ATOM 1398 OH TYR A 93 8.428 10.958 5.711 1.00 0.00 O ATOM 0 H TYR A 93 7.968 4.803 3.251 1.00 0.00 H new ATOM 0 HA TYR A 93 8.274 4.470 6.159 1.00 0.00 H new ATOM 0 HB2 TYR A 93 5.751 5.571 4.905 1.00 0.00 H new ATOM 0 HB3 TYR A 93 6.119 5.390 6.609 1.00 0.00 H new ATOM 0 HD1 TYR A 93 7.588 7.019 7.753 1.00 0.00 H new ATOM 0 HD2 TYR A 93 6.658 7.378 3.623 1.00 0.00 H new ATOM 0 HE1 TYR A 93 8.395 9.343 7.778 1.00 0.00 H new ATOM 0 HE2 TYR A 93 7.461 9.696 3.631 1.00 0.00 H new ATOM 0 HH TYR A 93 8.334 11.342 4.814 1.00 0.00 H new ATOM 1408 N TYR A 94 6.009 2.872 5.863 1.00 0.00 N ATOM 1409 CA TYR A 94 5.320 1.595 5.739 1.00 0.00 C ATOM 1410 C TYR A 94 3.906 1.688 6.295 1.00 0.00 C ATOM 1411 O TYR A 94 3.704 2.126 7.430 1.00 0.00 O ATOM 1412 CB TYR A 94 6.061 0.477 6.490 1.00 0.00 C ATOM 1413 CG TYR A 94 7.468 0.197 6.007 1.00 0.00 C ATOM 1414 CD1 TYR A 94 7.700 -0.431 4.791 1.00 0.00 C ATOM 1415 CD2 TYR A 94 8.564 0.545 6.782 1.00 0.00 C ATOM 1416 CE1 TYR A 94 8.986 -0.701 4.360 1.00 0.00 C ATOM 1417 CE2 TYR A 94 9.853 0.283 6.358 1.00 0.00 C ATOM 1418 CZ TYR A 94 10.059 -0.340 5.148 1.00 0.00 C ATOM 1419 OH TYR A 94 11.343 -0.608 4.726 1.00 0.00 O ATOM 0 H TYR A 94 5.731 3.421 6.676 1.00 0.00 H new ATOM 0 HA TYR A 94 5.290 1.356 4.676 1.00 0.00 H new ATOM 0 HB2 TYR A 94 6.102 0.738 7.548 1.00 0.00 H new ATOM 0 HB3 TYR A 94 5.478 -0.440 6.410 1.00 0.00 H new ATOM 0 HD1 TYR A 94 6.862 -0.714 4.171 1.00 0.00 H new ATOM 0 HD2 TYR A 94 8.407 1.030 7.734 1.00 0.00 H new ATOM 0 HE1 TYR A 94 9.149 -1.192 3.412 1.00 0.00 H new ATOM 0 HE2 TYR A 94 10.695 0.566 6.973 1.00 0.00 H new ATOM 0 HH TYR A 94 11.981 -0.288 5.397 1.00 0.00 H new ATOM 1429 N ASP A 95 2.940 1.291 5.488 1.00 0.00 N ATOM 1430 CA ASP A 95 1.594 1.049 5.974 1.00 0.00 C ATOM 1431 C ASP A 95 1.502 -0.428 6.314 1.00 0.00 C ATOM 1432 O ASP A 95 1.268 -1.275 5.449 1.00 0.00 O ATOM 1433 CB ASP A 95 0.543 1.443 4.933 1.00 0.00 C ATOM 1434 CG ASP A 95 -0.869 1.252 5.450 1.00 0.00 C ATOM 1435 OD1 ASP A 95 -1.393 2.164 6.122 1.00 0.00 O ATOM 1436 OD2 ASP A 95 -1.459 0.192 5.186 1.00 0.00 O ATOM 0 H ASP A 95 3.063 1.129 4.489 1.00 0.00 H new ATOM 0 HA ASP A 95 1.393 1.660 6.854 1.00 0.00 H new ATOM 0 HB2 ASP A 95 0.687 2.486 4.649 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.683 0.845 4.032 1.00 0.00 H new ATOM 1441 N ASN A 96 1.747 -0.731 7.572 1.00 0.00 N ATOM 1442 CA ASN A 96 2.029 -2.094 7.995 1.00 0.00 C ATOM 1443 C ASN A 96 1.140 -2.523 9.153 1.00 0.00 C ATOM 1444 O ASN A 96 1.614 -3.154 10.094 1.00 0.00 O ATOM 1445 CB ASN A 96 3.511 -2.191 8.392 1.00 0.00 C ATOM 1446 CG ASN A 96 3.906 -1.201 9.484 1.00 0.00 C ATOM 1447 OD1 ASN A 96 3.208 -0.216 9.740 1.00 0.00 O ATOM 1448 ND2 ASN A 96 5.047 -1.430 10.110 1.00 0.00 N ATOM 0 H ASN A 96 1.757 -0.047 8.329 1.00 0.00 H new ATOM 0 HA ASN A 96 1.817 -2.768 7.165 1.00 0.00 H new ATOM 0 HB2 ASN A 96 3.723 -3.204 8.734 1.00 0.00 H new ATOM 0 HB3 ASN A 96 4.129 -2.016 7.511 1.00 0.00 H new ATOM 0 HD21 ASN A 96 5.374 -0.783 10.828 1.00 0.00 H new ATOM 0 HD22 ASN A 96 5.601 -2.254 9.875 1.00 0.00 H new ATOM 1455 N ASN A 97 -0.144 -2.156 9.070 1.00 0.00 N ATOM 1456 CA ASN A 97 -1.175 -2.507 10.064 1.00 0.00 C ATOM 1457 C ASN A 97 -0.997 -1.736 11.375 1.00 0.00 C ATOM 1458 O ASN A 97 -1.977 -1.370 12.024 1.00 0.00 O ATOM 1459 CB ASN A 97 -1.259 -4.043 10.279 1.00 0.00 C ATOM 1460 CG ASN A 97 -0.643 -4.600 11.567 1.00 0.00 C ATOM 1461 OD1 ASN A 97 0.325 -4.087 12.123 1.00 0.00 O ATOM 1462 ND2 ASN A 97 -1.199 -5.702 12.025 1.00 0.00 N ATOM 0 H ASN A 97 -0.506 -1.597 8.298 1.00 0.00 H new ATOM 0 HA ASN A 97 -2.137 -2.194 9.659 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -2.310 -4.332 10.254 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -0.774 -4.530 9.433 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -0.827 -6.151 12.862 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -2.002 -6.106 11.543 1.00 0.00 H new ATOM 1469 N ASN A 98 0.253 -1.470 11.721 1.00 0.00 N ATOM 1470 CA ASN A 98 0.626 -0.760 12.930 1.00 0.00 C ATOM 1471 C ASN A 98 2.130 -0.854 13.056 1.00 0.00 C ATOM 1472 O ASN A 98 2.837 0.154 13.058 1.00 0.00 O ATOM 1473 CB ASN A 98 -0.036 -1.366 14.175 1.00 0.00 C ATOM 1474 CG ASN A 98 0.380 -0.664 15.454 1.00 0.00 C ATOM 1475 OD1 ASN A 98 1.339 -1.068 16.117 1.00 0.00 O ATOM 1476 ND2 ASN A 98 -0.338 0.387 15.816 1.00 0.00 N ATOM 0 H ASN A 98 1.054 -1.749 11.154 1.00 0.00 H new ATOM 0 HA ASN A 98 0.291 0.275 12.863 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -1.119 -1.311 14.070 1.00 0.00 H new ATOM 0 HB3 ASN A 98 0.224 -2.422 14.243 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -0.106 0.894 16.670 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -1.124 0.690 15.241 1.00 0.00 H new ATOM 1483 N SER A 99 2.607 -2.088 13.132 1.00 0.00 N ATOM 1484 CA SER A 99 4.031 -2.373 13.146 1.00 0.00 C ATOM 1485 C SER A 99 4.292 -3.826 12.752 1.00 0.00 C ATOM 1486 O SER A 99 5.304 -4.405 13.146 1.00 0.00 O ATOM 1487 CB SER A 99 4.630 -2.106 14.534 1.00 0.00 C ATOM 1488 OG SER A 99 4.491 -0.746 14.919 1.00 0.00 O ATOM 0 H SER A 99 2.017 -2.918 13.186 1.00 0.00 H new ATOM 0 HA SER A 99 4.508 -1.712 12.422 1.00 0.00 H new ATOM 0 HB2 SER A 99 4.139 -2.743 15.270 1.00 0.00 H new ATOM 0 HB3 SER A 99 5.686 -2.376 14.532 1.00 0.00 H new ATOM 0 HG SER A 99 4.202 -0.216 14.147 1.00 0.00 H new ATOM 1494 N ALA A 100 3.392 -4.413 11.967 1.00 0.00 N ATOM 1495 CA ALA A 100 3.502 -5.831 11.648 1.00 0.00 C ATOM 1496 C ALA A 100 3.175 -6.140 10.186 1.00 0.00 C ATOM 1497 O ALA A 100 4.045 -6.078 9.318 1.00 0.00 O ATOM 1498 CB ALA A 100 2.608 -6.646 12.573 1.00 0.00 C ATOM 0 H ALA A 100 2.593 -3.938 11.547 1.00 0.00 H new ATOM 0 HA ALA A 100 4.544 -6.111 11.802 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.697 -7.704 12.326 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.914 -6.487 13.607 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.572 -6.331 12.448 1.00 0.00 H new ATOM 1504 N ASN A 101 1.912 -6.455 9.919 1.00 0.00 N ATOM 1505 CA ASN A 101 1.502 -7.003 8.624 1.00 0.00 C ATOM 1506 C ASN A 101 -0.011 -7.139 8.542 1.00 0.00 C ATOM 1507 O ASN A 101 -0.678 -7.333 9.556 1.00 0.00 O ATOM 1508 CB ASN A 101 2.160 -8.378 8.389 1.00 0.00 C ATOM 1509 CG ASN A 101 2.075 -9.337 9.580 1.00 0.00 C ATOM 1510 OD1 ASN A 101 2.964 -10.163 9.779 1.00 0.00 O ATOM 1511 ND2 ASN A 101 1.020 -9.246 10.376 1.00 0.00 N ATOM 0 H ASN A 101 1.148 -6.340 10.585 1.00 0.00 H new ATOM 0 HA ASN A 101 1.831 -6.310 7.850 1.00 0.00 H new ATOM 0 HB2 ASN A 101 1.689 -8.849 7.526 1.00 0.00 H new ATOM 0 HB3 ASN A 101 3.209 -8.226 8.136 1.00 0.00 H new ATOM 0 HD21 ASN A 101 0.930 -9.871 11.177 1.00 0.00 H new ATOM 0 HD22 ASN A 101 0.297 -8.551 10.187 1.00 0.00 H new ATOM 1518 N TYR A 102 -0.548 -7.029 7.337 1.00 0.00 N ATOM 1519 CA TYR A 102 -1.970 -7.245 7.112 1.00 0.00 C ATOM 1520 C TYR A 102 -2.240 -8.709 6.819 1.00 0.00 C ATOM 1521 O TYR A 102 -1.454 -9.361 6.129 1.00 0.00 O ATOM 1522 CB TYR A 102 -2.480 -6.389 5.952 1.00 0.00 C ATOM 1523 CG TYR A 102 -2.549 -4.920 6.270 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -3.640 -4.392 6.946 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -1.527 -4.061 5.899 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -3.712 -3.048 7.241 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -1.588 -2.715 6.192 1.00 0.00 C ATOM 1528 CZ TYR A 102 -2.684 -2.213 6.863 1.00 0.00 C ATOM 1529 OH TYR A 102 -2.750 -0.873 7.161 1.00 0.00 O ATOM 0 H TYR A 102 -0.020 -6.791 6.498 1.00 0.00 H new ATOM 0 HA TYR A 102 -2.499 -6.953 8.019 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -1.829 -6.535 5.090 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -3.472 -6.737 5.664 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -4.446 -5.045 7.246 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -0.669 -4.452 5.372 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -4.569 -2.652 7.765 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.783 -2.058 5.898 1.00 0.00 H new ATOM 0 HH TYR A 102 -2.662 -0.350 6.337 1.00 0.00 H new ATOM 1539 N GLN A 103 -3.339 -9.216 7.355 1.00 0.00 N ATOM 1540 CA GLN A 103 -3.742 -10.599 7.139 1.00 0.00 C ATOM 1541 C GLN A 103 -4.773 -10.670 6.020 1.00 0.00 C ATOM 1542 O GLN A 103 -5.837 -10.055 6.109 1.00 0.00 O ATOM 1543 CB GLN A 103 -4.337 -11.197 8.419 1.00 0.00 C ATOM 1544 CG GLN A 103 -3.322 -11.717 9.428 1.00 0.00 C ATOM 1545 CD GLN A 103 -2.207 -10.743 9.713 1.00 0.00 C ATOM 1546 OE1 GLN A 103 -2.316 -9.878 10.583 1.00 0.00 O ATOM 1547 NE2 GLN A 103 -1.118 -10.892 8.986 1.00 0.00 N ATOM 0 H GLN A 103 -3.975 -8.684 7.949 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.859 -11.174 6.860 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -4.950 -10.438 8.904 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -5.002 -12.015 8.143 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -3.836 -11.953 10.360 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -2.895 -12.648 9.055 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -1.075 -11.624 8.277 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -0.319 -10.276 9.133 1.00 0.00 H new ATOM 1556 N VAL A 104 -4.450 -11.404 4.971 1.00 0.00 N ATOM 1557 CA VAL A 104 -5.350 -11.551 3.839 1.00 0.00 C ATOM 1558 C VAL A 104 -6.382 -12.641 4.093 1.00 0.00 C ATOM 1559 O VAL A 104 -6.038 -13.779 4.421 1.00 0.00 O ATOM 1560 CB VAL A 104 -4.573 -11.876 2.553 1.00 0.00 C ATOM 1561 CG1 VAL A 104 -5.528 -12.093 1.389 1.00 0.00 C ATOM 1562 CG2 VAL A 104 -3.589 -10.761 2.246 1.00 0.00 C ATOM 0 H VAL A 104 -3.569 -11.909 4.878 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.865 -10.599 3.713 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.015 -12.800 2.704 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.958 -12.322 0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -6.196 -12.924 1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.115 -11.189 1.227 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -3.043 -10.999 1.333 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.131 -9.825 2.111 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -2.887 -10.658 3.073 1.00 0.00 H new ATOM 1572 N SER A 105 -7.647 -12.281 3.940 1.00 0.00 N ATOM 1573 CA SER A 105 -8.744 -13.214 4.110 1.00 0.00 C ATOM 1574 C SER A 105 -9.048 -13.944 2.799 1.00 0.00 C ATOM 1575 O SER A 105 -10.098 -13.744 2.188 1.00 0.00 O ATOM 1576 CB SER A 105 -9.973 -12.456 4.616 1.00 0.00 C ATOM 1577 OG SER A 105 -10.119 -11.216 3.939 1.00 0.00 O ATOM 0 H SER A 105 -7.939 -11.335 3.695 1.00 0.00 H new ATOM 0 HA SER A 105 -8.464 -13.970 4.844 1.00 0.00 H new ATOM 0 HB2 SER A 105 -10.866 -13.063 4.468 1.00 0.00 H new ATOM 0 HB3 SER A 105 -9.881 -12.281 5.688 1.00 0.00 H new ATOM 0 HG SER A 105 -10.912 -10.750 4.278 1.00 0.00 H new ATOM 1583 N THR A 106 -8.112 -14.778 2.367 1.00 0.00 N ATOM 1584 CA THR A 106 -8.274 -15.559 1.153 1.00 0.00 C ATOM 1585 C THR A 106 -9.033 -16.856 1.430 1.00 0.00 C ATOM 1586 O THR A 106 -10.263 -16.885 1.220 1.00 0.00 O ATOM 1587 CB THR A 106 -6.902 -15.875 0.524 1.00 0.00 C ATOM 1588 OG1 THR A 106 -5.910 -15.992 1.561 1.00 0.00 O ATOM 1589 CG2 THR A 106 -6.488 -14.794 -0.469 1.00 0.00 C ATOM 1590 OXT THR A 106 -8.403 -17.840 1.881 1.00 0.00 O ATOM 0 H THR A 106 -7.225 -14.930 2.846 1.00 0.00 H new ATOM 0 HA THR A 106 -8.856 -14.963 0.450 1.00 0.00 H new ATOM 0 HB THR A 106 -6.982 -16.818 -0.016 1.00 0.00 H new ATOM 0 HG1 THR A 106 -5.039 -16.195 1.159 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.517 -15.045 -0.896 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.229 -14.729 -1.266 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.422 -13.835 0.044 1.00 0.00 H new TER 1598 THR A 106