USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 934 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 40 LYS NZ :NH3+ 163:sc= -0.201 (180deg=0) USER MOD Set 1.2: A 54 HIS : no HD1:sc= -0.797 K(o=-1,f=-2.3) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 45:sc= 0.416 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.0377 K(o=-0.038,f=-1.4) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.0632 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.315 X(o=-0.32,f=-0.024) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ -155:sc= -2.96 (180deg=-4.63!) USER MOD Single : A 45 HIS : no HD1:sc= -0.325 X(o=-0.33,f=-0.0019) USER MOD Single : A 47 SER OG : rot 91:sc= -0.725 USER MOD Single : A 48 HIS : no HD1:sc= -3.88! C(o=-3.9!,f=-1.5!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0132) USER MOD Single : A 68 ASN : amide:sc= -5.47! C(o=-5.5!,f=-2.5!) USER MOD Single : A 69 ASN : amide:sc= -1.36 X(o=-1.4,f=-1.7!) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.0585 X(o=-0.058,f=-0.5) USER MOD Single : A 75 HIS : no HD1:sc= -0.88 X(o=-0.88,f=-1.1) USER MOD Single : A 78 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0389) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0.11) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.0053) USER MOD Single : A 89 SER OG : rot 179:sc= 0.107 USER MOD Single : A 90 THR OG1 : rot -74:sc= 0.619 USER MOD Single : A 91 ASN : amide:sc= -2.62 K(o=-2.6,f=-0.58) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 111 THR OG1 : rot 34:sc= 0.57 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.626 -0.067 -8.362 1.00 0.00 N ATOM 2 CA GLY A 1 17.147 1.278 -8.623 1.00 0.00 C ATOM 3 C GLY A 1 18.229 2.324 -8.446 1.00 0.00 C ATOM 4 O GLY A 1 19.054 2.530 -9.336 1.00 0.00 O ATOM 0 H1 GLY A 1 16.849 -0.745 -8.497 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.400 -0.293 -9.019 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.973 -0.128 -7.383 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.758 1.331 -9.640 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.317 1.501 -7.952 1.00 0.00 H new ATOM 8 N SER A 2 18.227 2.987 -7.293 1.00 0.00 N ATOM 9 CA SER A 2 19.213 4.021 -7.005 1.00 0.00 C ATOM 10 C SER A 2 19.248 5.064 -8.117 1.00 0.00 C ATOM 11 O SER A 2 20.318 5.509 -8.533 1.00 0.00 O ATOM 12 CB SER A 2 20.600 3.399 -6.830 1.00 0.00 C ATOM 13 OG SER A 2 20.603 2.446 -5.781 1.00 0.00 O ATOM 0 H SER A 2 17.554 2.826 -6.544 1.00 0.00 H new ATOM 0 HA SER A 2 18.924 4.514 -6.077 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.908 2.921 -7.760 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.329 4.181 -6.617 1.00 0.00 H new ATOM 0 HG SER A 2 21.500 2.062 -5.691 1.00 0.00 H new ATOM 19 N SER A 3 18.069 5.450 -8.595 1.00 0.00 N ATOM 20 CA SER A 3 17.963 6.438 -9.663 1.00 0.00 C ATOM 21 C SER A 3 17.565 7.801 -9.104 1.00 0.00 C ATOM 22 O SER A 3 16.752 7.894 -8.185 1.00 0.00 O ATOM 23 CB SER A 3 16.942 5.984 -10.708 1.00 0.00 C ATOM 24 OG SER A 3 17.448 4.909 -11.481 1.00 0.00 O ATOM 0 H SER A 3 17.174 5.094 -8.260 1.00 0.00 H new ATOM 0 HA SER A 3 18.940 6.530 -10.137 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.021 5.678 -10.212 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.690 6.819 -11.362 1.00 0.00 H new ATOM 0 HG SER A 3 16.777 4.636 -12.140 1.00 0.00 H new ATOM 30 N GLY A 4 18.144 8.857 -9.668 1.00 0.00 N ATOM 31 CA GLY A 4 17.837 10.201 -9.214 1.00 0.00 C ATOM 32 C GLY A 4 17.301 11.080 -10.326 1.00 0.00 C ATOM 33 O GLY A 4 16.093 11.292 -10.432 1.00 0.00 O ATOM 0 H GLY A 4 18.820 8.806 -10.430 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.104 10.151 -8.409 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.736 10.655 -8.798 1.00 0.00 H new ATOM 37 N SER A 5 18.202 11.595 -11.157 1.00 0.00 N ATOM 38 CA SER A 5 17.813 12.461 -12.264 1.00 0.00 C ATOM 39 C SER A 5 17.964 11.738 -13.599 1.00 0.00 C ATOM 40 O SER A 5 19.025 11.775 -14.221 1.00 0.00 O ATOM 41 CB SER A 5 18.660 13.736 -12.263 1.00 0.00 C ATOM 42 OG SER A 5 20.043 13.429 -12.238 1.00 0.00 O ATOM 0 H SER A 5 19.206 11.428 -11.085 1.00 0.00 H new ATOM 0 HA SER A 5 16.765 12.729 -12.133 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.432 14.329 -13.149 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.404 14.346 -11.397 1.00 0.00 H new ATOM 0 HG SER A 5 20.232 12.717 -12.885 1.00 0.00 H new ATOM 48 N SER A 6 16.893 11.080 -14.032 1.00 0.00 N ATOM 49 CA SER A 6 16.906 10.345 -15.291 1.00 0.00 C ATOM 50 C SER A 6 15.558 10.454 -15.998 1.00 0.00 C ATOM 51 O SER A 6 14.510 10.219 -15.399 1.00 0.00 O ATOM 52 CB SER A 6 17.247 8.874 -15.043 1.00 0.00 C ATOM 53 OG SER A 6 18.594 8.726 -14.629 1.00 0.00 O ATOM 0 H SER A 6 16.006 11.041 -13.530 1.00 0.00 H new ATOM 0 HA SER A 6 17.670 10.785 -15.932 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.582 8.467 -14.281 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.078 8.300 -15.954 1.00 0.00 H new ATOM 0 HG SER A 6 18.787 7.777 -14.475 1.00 0.00 H new ATOM 59 N GLY A 7 15.595 10.812 -17.278 1.00 0.00 N ATOM 60 CA GLY A 7 14.372 10.947 -18.046 1.00 0.00 C ATOM 61 C GLY A 7 13.326 9.921 -17.656 1.00 0.00 C ATOM 62 O GLY A 7 12.450 10.199 -16.839 1.00 0.00 O ATOM 0 H GLY A 7 16.451 11.011 -17.796 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.965 11.948 -17.903 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.600 10.844 -19.107 1.00 0.00 H new ATOM 66 N GLN A 8 13.418 8.732 -18.243 1.00 0.00 N ATOM 67 CA GLN A 8 12.471 7.662 -17.954 1.00 0.00 C ATOM 68 C GLN A 8 12.941 6.341 -18.555 1.00 0.00 C ATOM 69 O GLN A 8 12.986 6.185 -19.774 1.00 0.00 O ATOM 70 CB GLN A 8 11.085 8.018 -18.496 1.00 0.00 C ATOM 71 CG GLN A 8 10.071 6.895 -18.357 1.00 0.00 C ATOM 72 CD GLN A 8 9.422 6.860 -16.988 1.00 0.00 C ATOM 73 OE1 GLN A 8 9.764 7.648 -16.106 1.00 0.00 O ATOM 74 NE2 GLN A 8 8.478 5.944 -16.802 1.00 0.00 N ATOM 0 H GLN A 8 14.139 8.486 -18.921 1.00 0.00 H new ATOM 0 HA GLN A 8 12.412 7.547 -16.872 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.714 8.898 -17.971 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.174 8.288 -19.548 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.299 7.012 -19.118 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.563 5.941 -18.546 1.00 0.00 H new ATOM 0 HE21 GLN A 8 8.225 5.311 -17.561 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.006 5.874 -15.901 1.00 0.00 H new ATOM 83 N GLU A 9 13.290 5.394 -17.690 1.00 0.00 N ATOM 84 CA GLU A 9 13.758 4.087 -18.136 1.00 0.00 C ATOM 85 C GLU A 9 12.584 3.141 -18.374 1.00 0.00 C ATOM 86 O GLU A 9 11.664 3.060 -17.560 1.00 0.00 O ATOM 87 CB GLU A 9 14.713 3.483 -17.105 1.00 0.00 C ATOM 88 CG GLU A 9 16.027 4.236 -16.978 1.00 0.00 C ATOM 89 CD GLU A 9 16.935 3.650 -15.914 1.00 0.00 C ATOM 90 OE1 GLU A 9 16.581 3.733 -14.720 1.00 0.00 O ATOM 91 OE2 GLU A 9 18.000 3.108 -16.277 1.00 0.00 O ATOM 0 H GLU A 9 13.258 5.507 -16.677 1.00 0.00 H new ATOM 0 HA GLU A 9 14.290 4.222 -19.078 1.00 0.00 H new ATOM 0 HB2 GLU A 9 14.220 3.463 -16.133 1.00 0.00 H new ATOM 0 HB3 GLU A 9 14.922 2.448 -17.378 1.00 0.00 H new ATOM 0 HG2 GLU A 9 16.543 4.223 -17.938 1.00 0.00 H new ATOM 0 HG3 GLU A 9 15.822 5.280 -16.740 1.00 0.00 H new ATOM 98 N SER A 10 12.624 2.429 -19.495 1.00 0.00 N ATOM 99 CA SER A 10 11.563 1.492 -19.843 1.00 0.00 C ATOM 100 C SER A 10 11.964 0.062 -19.495 1.00 0.00 C ATOM 101 O SER A 10 11.738 -0.866 -20.272 1.00 0.00 O ATOM 102 CB SER A 10 11.233 1.592 -21.334 1.00 0.00 C ATOM 103 OG SER A 10 12.342 1.207 -22.128 1.00 0.00 O ATOM 0 H SER A 10 13.380 2.483 -20.178 1.00 0.00 H new ATOM 0 HA SER A 10 10.678 1.754 -19.263 1.00 0.00 H new ATOM 0 HB2 SER A 10 10.378 0.956 -21.564 1.00 0.00 H new ATOM 0 HB3 SER A 10 10.944 2.614 -21.578 1.00 0.00 H new ATOM 0 HG SER A 10 12.106 1.278 -23.076 1.00 0.00 H new ATOM 109 N VAL A 11 12.562 -0.109 -18.320 1.00 0.00 N ATOM 110 CA VAL A 11 12.995 -1.425 -17.866 1.00 0.00 C ATOM 111 C VAL A 11 12.474 -1.722 -16.465 1.00 0.00 C ATOM 112 O VAL A 11 12.597 -0.899 -15.559 1.00 0.00 O ATOM 113 CB VAL A 11 14.531 -1.541 -17.866 1.00 0.00 C ATOM 114 CG1 VAL A 11 15.136 -0.627 -16.811 1.00 0.00 C ATOM 115 CG2 VAL A 11 14.956 -2.984 -17.639 1.00 0.00 C ATOM 0 H VAL A 11 12.758 0.648 -17.665 1.00 0.00 H new ATOM 0 HA VAL A 11 12.583 -2.153 -18.565 1.00 0.00 H new ATOM 0 HB VAL A 11 14.902 -1.226 -18.841 1.00 0.00 H new ATOM 0 HG11 VAL A 11 16.222 -0.723 -16.826 1.00 0.00 H new ATOM 0 HG12 VAL A 11 14.860 0.406 -17.023 1.00 0.00 H new ATOM 0 HG13 VAL A 11 14.761 -0.908 -15.827 1.00 0.00 H new ATOM 0 HG21 VAL A 11 16.044 -3.048 -17.642 1.00 0.00 H new ATOM 0 HG22 VAL A 11 14.575 -3.329 -16.678 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.554 -3.611 -18.435 1.00 0.00 H new ATOM 125 N GLU A 12 11.891 -2.905 -16.295 1.00 0.00 N ATOM 126 CA GLU A 12 11.350 -3.310 -15.003 1.00 0.00 C ATOM 127 C GLU A 12 11.956 -4.636 -14.551 1.00 0.00 C ATOM 128 O GLU A 12 11.264 -5.491 -13.998 1.00 0.00 O ATOM 129 CB GLU A 12 9.827 -3.433 -15.078 1.00 0.00 C ATOM 130 CG GLU A 12 9.349 -4.509 -16.039 1.00 0.00 C ATOM 131 CD GLU A 12 7.840 -4.657 -16.046 1.00 0.00 C ATOM 132 OE1 GLU A 12 7.142 -3.625 -15.961 1.00 0.00 O ATOM 133 OE2 GLU A 12 7.358 -5.805 -16.138 1.00 0.00 O ATOM 0 H GLU A 12 11.782 -3.599 -17.035 1.00 0.00 H new ATOM 0 HA GLU A 12 11.610 -2.543 -14.273 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.439 -3.649 -14.082 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.408 -2.474 -15.382 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.691 -4.270 -17.046 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.802 -5.462 -15.766 1.00 0.00 H new ATOM 140 N ASP A 13 13.252 -4.799 -14.791 1.00 0.00 N ATOM 141 CA ASP A 13 13.953 -6.020 -14.410 1.00 0.00 C ATOM 142 C ASP A 13 13.556 -6.457 -13.003 1.00 0.00 C ATOM 143 O ASP A 13 13.295 -7.635 -12.758 1.00 0.00 O ATOM 144 CB ASP A 13 15.466 -5.810 -14.484 1.00 0.00 C ATOM 145 CG ASP A 13 15.976 -4.886 -13.396 1.00 0.00 C ATOM 146 OD1 ASP A 13 15.808 -3.656 -13.533 1.00 0.00 O ATOM 147 OD2 ASP A 13 16.542 -5.394 -12.405 1.00 0.00 O ATOM 0 H ASP A 13 13.839 -4.101 -15.248 1.00 0.00 H new ATOM 0 HA ASP A 13 13.669 -6.806 -15.110 1.00 0.00 H new ATOM 0 HB2 ASP A 13 15.968 -6.774 -14.403 1.00 0.00 H new ATOM 0 HB3 ASP A 13 15.725 -5.397 -15.459 1.00 0.00 H new ATOM 152 N SER A 14 13.514 -5.500 -12.081 1.00 0.00 N ATOM 153 CA SER A 14 13.154 -5.787 -10.698 1.00 0.00 C ATOM 154 C SER A 14 11.747 -5.284 -10.387 1.00 0.00 C ATOM 155 O SER A 14 10.971 -5.956 -9.706 1.00 0.00 O ATOM 156 CB SER A 14 14.160 -5.142 -9.743 1.00 0.00 C ATOM 157 OG SER A 14 13.993 -3.736 -9.699 1.00 0.00 O ATOM 0 H SER A 14 13.725 -4.520 -12.267 1.00 0.00 H new ATOM 0 HA SER A 14 13.174 -6.868 -10.560 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.035 -5.558 -8.743 1.00 0.00 H new ATOM 0 HB3 SER A 14 15.174 -5.381 -10.063 1.00 0.00 H new ATOM 0 HG SER A 14 14.647 -3.348 -9.080 1.00 0.00 H new ATOM 163 N LEU A 15 11.425 -4.098 -10.890 1.00 0.00 N ATOM 164 CA LEU A 15 10.112 -3.503 -10.668 1.00 0.00 C ATOM 165 C LEU A 15 9.015 -4.561 -10.741 1.00 0.00 C ATOM 166 O LEU A 15 9.112 -5.517 -11.509 1.00 0.00 O ATOM 167 CB LEU A 15 9.846 -2.404 -11.699 1.00 0.00 C ATOM 168 CG LEU A 15 10.293 -0.995 -11.308 1.00 0.00 C ATOM 169 CD1 LEU A 15 10.228 -0.063 -12.508 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.438 -0.461 -10.168 1.00 0.00 C ATOM 0 H LEU A 15 12.055 -3.529 -11.455 1.00 0.00 H new ATOM 0 HA LEU A 15 10.104 -3.065 -9.670 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.345 -2.677 -12.629 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.776 -2.380 -11.907 1.00 0.00 H new ATOM 0 HG LEU A 15 11.327 -1.044 -10.967 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.550 0.935 -12.211 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.884 -0.436 -13.295 1.00 0.00 H new ATOM 0 HD13 LEU A 15 9.204 -0.019 -12.879 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.770 0.543 -9.903 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.394 -0.427 -10.481 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.536 -1.116 -9.302 1.00 0.00 H new ATOM 182 N ALA A 16 7.972 -4.381 -9.938 1.00 0.00 N ATOM 183 CA ALA A 16 6.855 -5.317 -9.915 1.00 0.00 C ATOM 184 C ALA A 16 5.525 -4.582 -9.794 1.00 0.00 C ATOM 185 O ALA A 16 5.470 -3.449 -9.314 1.00 0.00 O ATOM 186 CB ALA A 16 7.020 -6.307 -8.771 1.00 0.00 C ATOM 0 H ALA A 16 7.877 -3.595 -9.295 1.00 0.00 H new ATOM 0 HA ALA A 16 6.852 -5.865 -10.857 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.179 -7.000 -8.766 1.00 0.00 H new ATOM 0 HB2 ALA A 16 7.948 -6.864 -8.902 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.052 -5.767 -7.825 1.00 0.00 H new ATOM 192 N THR A 17 4.451 -5.233 -10.232 1.00 0.00 N ATOM 193 CA THR A 17 3.121 -4.640 -10.174 1.00 0.00 C ATOM 194 C THR A 17 2.468 -4.887 -8.819 1.00 0.00 C ATOM 195 O THR A 17 2.079 -6.011 -8.501 1.00 0.00 O ATOM 196 CB THR A 17 2.208 -5.201 -11.281 1.00 0.00 C ATOM 197 OG1 THR A 17 2.907 -5.217 -12.531 1.00 0.00 O ATOM 198 CG2 THR A 17 0.943 -4.366 -11.412 1.00 0.00 C ATOM 0 H THR A 17 4.477 -6.171 -10.631 1.00 0.00 H new ATOM 0 HA THR A 17 3.246 -3.568 -10.324 1.00 0.00 H new ATOM 0 HB THR A 17 1.927 -6.219 -11.010 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.321 -5.576 -13.229 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.313 -4.780 -12.199 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.399 -4.379 -10.468 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.209 -3.339 -11.663 1.00 0.00 H new ATOM 206 N VAL A 18 2.350 -3.829 -8.023 1.00 0.00 N ATOM 207 CA VAL A 18 1.742 -3.930 -6.702 1.00 0.00 C ATOM 208 C VAL A 18 0.382 -3.241 -6.668 1.00 0.00 C ATOM 209 O VAL A 18 0.296 -2.017 -6.573 1.00 0.00 O ATOM 210 CB VAL A 18 2.646 -3.311 -5.619 1.00 0.00 C ATOM 211 CG1 VAL A 18 1.920 -3.260 -4.283 1.00 0.00 C ATOM 212 CG2 VAL A 18 3.945 -4.093 -5.499 1.00 0.00 C ATOM 0 H VAL A 18 2.668 -2.892 -8.270 1.00 0.00 H new ATOM 0 HA VAL A 18 1.613 -4.992 -6.494 1.00 0.00 H new ATOM 0 HB VAL A 18 2.889 -2.290 -5.913 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.574 -2.820 -3.530 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.020 -2.653 -4.381 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.646 -4.270 -3.979 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.571 -3.642 -4.730 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.724 -5.126 -5.228 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.471 -4.073 -6.453 1.00 0.00 H new ATOM 222 N LYS A 19 -0.679 -4.036 -6.747 1.00 0.00 N ATOM 223 CA LYS A 19 -2.037 -3.505 -6.724 1.00 0.00 C ATOM 224 C LYS A 19 -2.422 -3.058 -5.318 1.00 0.00 C ATOM 225 O LYS A 19 -2.264 -3.805 -4.352 1.00 0.00 O ATOM 226 CB LYS A 19 -3.028 -4.559 -7.225 1.00 0.00 C ATOM 227 CG LYS A 19 -2.891 -4.866 -8.706 1.00 0.00 C ATOM 228 CD LYS A 19 -3.973 -5.823 -9.179 1.00 0.00 C ATOM 229 CE LYS A 19 -3.731 -6.274 -10.611 1.00 0.00 C ATOM 230 NZ LYS A 19 -4.488 -7.514 -10.938 1.00 0.00 N ATOM 0 H LYS A 19 -0.625 -5.051 -6.828 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.073 -2.639 -7.385 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.886 -5.478 -6.657 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.043 -4.215 -7.026 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.948 -3.940 -9.277 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.910 -5.300 -8.899 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -4.003 -6.693 -8.523 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.946 -5.337 -9.109 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -4.024 -5.479 -11.296 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -2.666 -6.449 -10.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -4.296 -7.788 -11.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -4.191 -8.280 -10.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.507 -7.340 -10.819 1.00 0.00 H new ATOM 244 N VAL A 20 -2.930 -1.834 -5.209 1.00 0.00 N ATOM 245 CA VAL A 20 -3.341 -1.288 -3.921 1.00 0.00 C ATOM 246 C VAL A 20 -4.857 -1.152 -3.840 1.00 0.00 C ATOM 247 O VAL A 20 -5.493 -0.617 -4.749 1.00 0.00 O ATOM 248 CB VAL A 20 -2.698 0.088 -3.664 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.220 0.687 -2.367 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.182 -0.030 -3.635 1.00 0.00 C ATOM 0 H VAL A 20 -3.067 -1.202 -5.998 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.001 -1.988 -3.158 1.00 0.00 H new ATOM 0 HB VAL A 20 -2.972 0.756 -4.480 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.755 1.659 -2.202 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.301 0.809 -2.432 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -2.979 0.023 -1.537 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.744 0.951 -3.452 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.885 -0.713 -2.839 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.828 -0.413 -4.592 1.00 0.00 H new ATOM 260 N VAL A 21 -5.432 -1.639 -2.745 1.00 0.00 N ATOM 261 CA VAL A 21 -6.875 -1.570 -2.544 1.00 0.00 C ATOM 262 C VAL A 21 -7.215 -0.848 -1.245 1.00 0.00 C ATOM 263 O VAL A 21 -6.652 -1.147 -0.190 1.00 0.00 O ATOM 264 CB VAL A 21 -7.505 -2.975 -2.517 1.00 0.00 C ATOM 265 CG1 VAL A 21 -8.984 -2.891 -2.169 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.303 -3.675 -3.853 1.00 0.00 C ATOM 0 H VAL A 21 -4.921 -2.086 -1.984 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.286 -1.011 -3.385 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.007 -3.562 -1.745 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.412 -3.893 -2.155 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.101 -2.432 -1.187 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.500 -2.287 -2.916 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.754 -4.666 -3.816 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.773 -3.091 -4.644 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.236 -3.769 -4.057 1.00 0.00 H new ATOM 276 N LEU A 22 -8.138 0.103 -1.327 1.00 0.00 N ATOM 277 CA LEU A 22 -8.555 0.869 -0.158 1.00 0.00 C ATOM 278 C LEU A 22 -9.633 0.125 0.624 1.00 0.00 C ATOM 279 O LEU A 22 -10.653 -0.277 0.064 1.00 0.00 O ATOM 280 CB LEU A 22 -9.073 2.244 -0.582 1.00 0.00 C ATOM 281 CG LEU A 22 -8.010 3.266 -0.988 1.00 0.00 C ATOM 282 CD1 LEU A 22 -8.657 4.478 -1.641 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.185 3.685 0.220 1.00 0.00 C ATOM 0 H LEU A 22 -8.613 0.363 -2.192 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.687 0.999 0.489 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.758 2.110 -1.419 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.654 2.661 0.241 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.344 2.800 -1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.886 5.194 -1.923 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.203 4.164 -2.530 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.346 4.945 -0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.434 4.412 -0.087 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -7.838 4.132 0.969 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.691 2.811 0.644 1.00 0.00 H new ATOM 295 N ILE A 23 -9.401 -0.051 1.920 1.00 0.00 N ATOM 296 CA ILE A 23 -10.355 -0.743 2.779 1.00 0.00 C ATOM 297 C ILE A 23 -11.587 0.118 3.038 1.00 0.00 C ATOM 298 O ILE A 23 -12.717 -0.267 2.739 1.00 0.00 O ATOM 299 CB ILE A 23 -9.720 -1.129 4.128 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.102 -2.526 4.044 1.00 0.00 C ATOM 301 CG2 ILE A 23 -10.758 -1.069 5.238 1.00 0.00 C ATOM 302 CD1 ILE A 23 -10.083 -3.596 3.619 1.00 0.00 C ATOM 0 H ILE A 23 -8.562 0.276 2.399 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.653 -1.650 2.253 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.929 -0.415 4.358 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.271 -2.505 3.339 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.687 -2.790 5.017 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.294 -1.344 6.185 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.156 -0.057 5.310 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.569 -1.763 5.016 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.576 -4.560 3.581 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -10.902 -3.645 4.337 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.479 -3.355 2.632 1.00 0.00 H new ATOM 314 N PRO A 24 -11.365 1.313 3.605 1.00 0.00 N ATOM 315 CA PRO A 24 -12.445 2.254 3.914 1.00 0.00 C ATOM 316 C PRO A 24 -13.067 2.856 2.659 1.00 0.00 C ATOM 317 O PRO A 24 -14.205 3.326 2.681 1.00 0.00 O ATOM 318 CB PRO A 24 -11.745 3.339 4.737 1.00 0.00 C ATOM 319 CG PRO A 24 -10.320 3.280 4.308 1.00 0.00 C ATOM 320 CD PRO A 24 -10.044 1.837 3.988 1.00 0.00 C ATOM 0 HA PRO A 24 -13.271 1.770 4.435 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.176 4.322 4.545 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -11.845 3.151 5.806 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.148 3.913 3.437 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.659 3.638 5.098 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.322 1.736 3.178 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.635 1.306 4.848 1.00 0.00 H new ATOM 328 N VAL A 25 -12.313 2.839 1.564 1.00 0.00 N ATOM 329 CA VAL A 25 -12.790 3.382 0.298 1.00 0.00 C ATOM 330 C VAL A 25 -13.239 2.269 -0.643 1.00 0.00 C ATOM 331 O VAL A 25 -14.385 2.242 -1.087 1.00 0.00 O ATOM 332 CB VAL A 25 -11.703 4.222 -0.399 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.325 5.151 -1.429 1.00 0.00 C ATOM 334 CG2 VAL A 25 -10.900 5.009 0.626 1.00 0.00 C ATOM 0 H VAL A 25 -11.369 2.455 1.529 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.640 4.023 0.530 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.023 3.547 -0.919 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.542 5.736 -1.911 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.852 4.562 -2.180 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.028 5.822 -0.936 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.136 5.597 0.117 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.565 5.676 1.175 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.422 4.319 1.322 1.00 0.00 H new ATOM 344 N GLY A 26 -12.325 1.351 -0.943 1.00 0.00 N ATOM 345 CA GLY A 26 -12.645 0.248 -1.829 1.00 0.00 C ATOM 346 C GLY A 26 -12.166 0.486 -3.247 1.00 0.00 C ATOM 347 O GLY A 26 -12.459 -0.301 -4.148 1.00 0.00 O ATOM 0 H GLY A 26 -11.369 1.352 -0.588 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.192 -0.666 -1.444 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -13.724 0.092 -1.835 1.00 0.00 H new ATOM 351 N GLN A 27 -11.429 1.574 -3.447 1.00 0.00 N ATOM 352 CA GLN A 27 -10.912 1.914 -4.767 1.00 0.00 C ATOM 353 C GLN A 27 -9.648 1.118 -5.077 1.00 0.00 C ATOM 354 O GLN A 27 -8.878 0.783 -4.178 1.00 0.00 O ATOM 355 CB GLN A 27 -10.619 3.413 -4.853 1.00 0.00 C ATOM 356 CG GLN A 27 -10.168 3.867 -6.232 1.00 0.00 C ATOM 357 CD GLN A 27 -9.593 5.269 -6.225 1.00 0.00 C ATOM 358 OE1 GLN A 27 -10.027 6.134 -6.986 1.00 0.00 O ATOM 359 NE2 GLN A 27 -8.609 5.502 -5.364 1.00 0.00 N ATOM 0 H GLN A 27 -11.177 2.235 -2.712 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.672 1.657 -5.505 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.515 3.967 -4.573 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -9.847 3.666 -4.126 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -9.418 3.173 -6.612 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.014 3.829 -6.918 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.280 4.756 -4.751 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -8.182 6.427 -5.315 1.00 0.00 H new ATOM 368 N GLU A 28 -9.441 0.820 -6.356 1.00 0.00 N ATOM 369 CA GLU A 28 -8.271 0.063 -6.784 1.00 0.00 C ATOM 370 C GLU A 28 -7.262 0.969 -7.483 1.00 0.00 C ATOM 371 O GLU A 28 -7.618 1.742 -8.373 1.00 0.00 O ATOM 372 CB GLU A 28 -8.685 -1.074 -7.720 1.00 0.00 C ATOM 373 CG GLU A 28 -9.464 -2.180 -7.027 1.00 0.00 C ATOM 374 CD GLU A 28 -9.986 -3.222 -7.997 1.00 0.00 C ATOM 375 OE1 GLU A 28 -9.252 -3.567 -8.947 1.00 0.00 O ATOM 376 OE2 GLU A 28 -11.126 -3.693 -7.805 1.00 0.00 O ATOM 0 H GLU A 28 -10.068 1.091 -7.113 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.800 -0.360 -5.896 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.292 -0.665 -8.528 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.792 -1.501 -8.176 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.823 -2.664 -6.290 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.302 -1.743 -6.483 1.00 0.00 H new ATOM 383 N ILE A 29 -6.002 0.869 -7.073 1.00 0.00 N ATOM 384 CA ILE A 29 -4.941 1.679 -7.660 1.00 0.00 C ATOM 385 C ILE A 29 -3.775 0.810 -8.117 1.00 0.00 C ATOM 386 O ILE A 29 -3.515 -0.250 -7.547 1.00 0.00 O ATOM 387 CB ILE A 29 -4.422 2.733 -6.664 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.560 3.656 -6.224 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.291 3.538 -7.287 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.163 4.631 -5.139 1.00 0.00 C ATOM 0 H ILE A 29 -5.691 0.235 -6.337 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.372 2.187 -8.523 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.035 2.220 -5.784 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -5.919 4.214 -7.089 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.392 3.049 -5.868 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.935 4.279 -6.571 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.473 2.869 -7.555 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.654 4.043 -8.182 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.019 5.253 -4.877 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.832 4.080 -4.258 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.351 5.264 -5.498 1.00 0.00 H new ATOM 402 N VAL A 30 -3.073 1.266 -9.150 1.00 0.00 N ATOM 403 CA VAL A 30 -1.932 0.532 -9.683 1.00 0.00 C ATOM 404 C VAL A 30 -0.711 1.436 -9.816 1.00 0.00 C ATOM 405 O VAL A 30 -0.776 2.495 -10.440 1.00 0.00 O ATOM 406 CB VAL A 30 -2.254 -0.084 -11.058 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.023 -0.763 -11.640 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.410 -1.065 -10.944 1.00 0.00 C ATOM 0 H VAL A 30 -3.275 2.141 -9.634 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.712 -0.269 -8.977 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.552 0.717 -11.735 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.269 -1.192 -12.611 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.225 -0.030 -11.759 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.691 -1.554 -10.967 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.624 -1.491 -11.924 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.143 -1.864 -10.252 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.293 -0.545 -10.574 1.00 0.00 H new ATOM 418 N ILE A 31 0.400 1.010 -9.226 1.00 0.00 N ATOM 419 CA ILE A 31 1.637 1.780 -9.280 1.00 0.00 C ATOM 420 C ILE A 31 2.855 0.873 -9.146 1.00 0.00 C ATOM 421 O ILE A 31 2.900 -0.029 -8.309 1.00 0.00 O ATOM 422 CB ILE A 31 1.683 2.849 -8.174 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.787 3.868 -8.464 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.899 2.198 -6.816 1.00 0.00 C ATOM 425 CD1 ILE A 31 2.980 4.882 -7.358 1.00 0.00 C ATOM 0 H ILE A 31 0.470 0.136 -8.705 1.00 0.00 H new ATOM 0 HA ILE A 31 1.660 2.273 -10.252 1.00 0.00 H new ATOM 0 HB ILE A 31 0.727 3.373 -8.156 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.725 3.338 -8.628 1.00 0.00 H new ATOM 0 HG13 ILE A 31 2.552 4.393 -9.390 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.929 2.967 -6.044 1.00 0.00 H new ATOM 0 HG22 ILE A 31 1.081 1.508 -6.609 1.00 0.00 H new ATOM 0 HG23 ILE A 31 2.842 1.651 -6.820 1.00 0.00 H new ATOM 0 HD11 ILE A 31 3.778 5.572 -7.632 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.055 5.438 -7.209 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.247 4.367 -6.435 1.00 0.00 H new ATOM 437 N PRO A 32 3.870 1.116 -9.989 1.00 0.00 N ATOM 438 CA PRO A 32 5.110 0.334 -9.983 1.00 0.00 C ATOM 439 C PRO A 32 5.952 0.593 -8.738 1.00 0.00 C ATOM 440 O PRO A 32 6.065 1.729 -8.278 1.00 0.00 O ATOM 441 CB PRO A 32 5.842 0.821 -11.235 1.00 0.00 C ATOM 442 CG PRO A 32 5.317 2.194 -11.472 1.00 0.00 C ATOM 443 CD PRO A 32 3.885 2.175 -11.013 1.00 0.00 C ATOM 0 HA PRO A 32 4.916 -0.739 -9.977 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.921 0.831 -11.084 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.646 0.170 -12.087 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.895 2.934 -10.918 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.385 2.461 -12.527 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.582 3.137 -10.600 1.00 0.00 H new ATOM 0 HD3 PRO A 32 3.203 1.951 -11.833 1.00 0.00 H new ATOM 451 N PHE A 33 6.542 -0.468 -8.198 1.00 0.00 N ATOM 452 CA PHE A 33 7.375 -0.356 -7.006 1.00 0.00 C ATOM 453 C PHE A 33 8.494 -1.392 -7.024 1.00 0.00 C ATOM 454 O PHE A 33 8.373 -2.443 -7.655 1.00 0.00 O ATOM 455 CB PHE A 33 6.524 -0.529 -5.746 1.00 0.00 C ATOM 456 CG PHE A 33 7.134 0.090 -4.521 1.00 0.00 C ATOM 457 CD1 PHE A 33 7.445 1.440 -4.493 1.00 0.00 C ATOM 458 CD2 PHE A 33 7.398 -0.678 -3.398 1.00 0.00 C ATOM 459 CE1 PHE A 33 8.006 2.014 -3.367 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.958 -0.110 -2.270 1.00 0.00 C ATOM 461 CZ PHE A 33 8.264 1.237 -2.254 1.00 0.00 C ATOM 0 H PHE A 33 6.459 -1.415 -8.567 1.00 0.00 H new ATOM 0 HA PHE A 33 7.825 0.637 -7.000 1.00 0.00 H new ATOM 0 HB2 PHE A 33 5.543 -0.087 -5.917 1.00 0.00 H new ATOM 0 HB3 PHE A 33 6.367 -1.593 -5.566 1.00 0.00 H new ATOM 0 HD1 PHE A 33 7.247 2.051 -5.361 1.00 0.00 H new ATOM 0 HD2 PHE A 33 7.163 -1.732 -3.405 1.00 0.00 H new ATOM 0 HE1 PHE A 33 8.242 3.068 -3.358 1.00 0.00 H new ATOM 0 HE2 PHE A 33 8.157 -0.719 -1.401 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.704 1.682 -1.374 1.00 0.00 H new ATOM 471 N LYS A 34 9.584 -1.090 -6.328 1.00 0.00 N ATOM 472 CA LYS A 34 10.726 -1.994 -6.262 1.00 0.00 C ATOM 473 C LYS A 34 10.490 -3.095 -5.233 1.00 0.00 C ATOM 474 O LYS A 34 9.976 -2.840 -4.143 1.00 0.00 O ATOM 475 CB LYS A 34 11.998 -1.218 -5.911 1.00 0.00 C ATOM 476 CG LYS A 34 12.748 -0.698 -7.125 1.00 0.00 C ATOM 477 CD LYS A 34 11.910 0.290 -7.918 1.00 0.00 C ATOM 478 CE LYS A 34 12.782 1.277 -8.678 1.00 0.00 C ATOM 479 NZ LYS A 34 12.027 2.500 -9.068 1.00 0.00 N ATOM 0 H LYS A 34 9.701 -0.225 -5.801 1.00 0.00 H new ATOM 0 HA LYS A 34 10.848 -2.456 -7.242 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.735 -0.377 -5.269 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.660 -1.864 -5.335 1.00 0.00 H new ATOM 0 HG2 LYS A 34 13.672 -0.217 -6.804 1.00 0.00 H new ATOM 0 HG3 LYS A 34 13.029 -1.534 -7.765 1.00 0.00 H new ATOM 0 HD2 LYS A 34 11.275 -0.251 -8.619 1.00 0.00 H new ATOM 0 HD3 LYS A 34 11.249 0.832 -7.242 1.00 0.00 H new ATOM 0 HE2 LYS A 34 13.635 1.558 -8.060 1.00 0.00 H new ATOM 0 HE3 LYS A 34 13.181 0.796 -9.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 12.657 3.147 -9.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.228 2.235 -9.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 11.668 2.973 -8.214 1.00 0.00 H new ATOM 493 N VAL A 35 10.870 -4.319 -5.585 1.00 0.00 N ATOM 494 CA VAL A 35 10.701 -5.459 -4.691 1.00 0.00 C ATOM 495 C VAL A 35 11.857 -5.557 -3.702 1.00 0.00 C ATOM 496 O VAL A 35 11.728 -6.163 -2.638 1.00 0.00 O ATOM 497 CB VAL A 35 10.600 -6.779 -5.478 1.00 0.00 C ATOM 498 CG1 VAL A 35 9.438 -6.728 -6.459 1.00 0.00 C ATOM 499 CG2 VAL A 35 11.906 -7.070 -6.200 1.00 0.00 C ATOM 0 H VAL A 35 11.297 -4.547 -6.483 1.00 0.00 H new ATOM 0 HA VAL A 35 9.772 -5.298 -4.145 1.00 0.00 H new ATOM 0 HB VAL A 35 10.414 -7.589 -4.773 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.382 -7.669 -7.006 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.508 -6.570 -5.913 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.590 -5.909 -7.161 1.00 0.00 H new ATOM 0 HG21 VAL A 35 11.816 -8.006 -6.751 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.126 -6.260 -6.895 1.00 0.00 H new ATOM 0 HG23 VAL A 35 12.713 -7.153 -5.472 1.00 0.00 H new ATOM 509 N ASP A 36 12.987 -4.956 -4.060 1.00 0.00 N ATOM 510 CA ASP A 36 14.167 -4.974 -3.203 1.00 0.00 C ATOM 511 C ASP A 36 14.280 -3.678 -2.406 1.00 0.00 C ATOM 512 O ASP A 36 15.298 -3.417 -1.765 1.00 0.00 O ATOM 513 CB ASP A 36 15.429 -5.184 -4.041 1.00 0.00 C ATOM 514 CG ASP A 36 15.794 -3.957 -4.854 1.00 0.00 C ATOM 515 OD1 ASP A 36 16.347 -3.002 -4.270 1.00 0.00 O ATOM 516 OD2 ASP A 36 15.527 -3.953 -6.074 1.00 0.00 O ATOM 0 H ASP A 36 13.111 -4.451 -4.937 1.00 0.00 H new ATOM 0 HA ASP A 36 14.064 -5.802 -2.502 1.00 0.00 H new ATOM 0 HB2 ASP A 36 16.260 -5.441 -3.384 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.280 -6.030 -4.712 1.00 0.00 H new ATOM 521 N THR A 37 13.227 -2.867 -2.452 1.00 0.00 N ATOM 522 CA THR A 37 13.208 -1.598 -1.737 1.00 0.00 C ATOM 523 C THR A 37 12.133 -1.591 -0.656 1.00 0.00 C ATOM 524 O THR A 37 11.032 -2.102 -0.860 1.00 0.00 O ATOM 525 CB THR A 37 12.964 -0.417 -2.695 1.00 0.00 C ATOM 526 OG1 THR A 37 14.059 -0.293 -3.609 1.00 0.00 O ATOM 527 CG2 THR A 37 12.793 0.882 -1.921 1.00 0.00 C ATOM 0 H THR A 37 12.376 -3.068 -2.978 1.00 0.00 H new ATOM 0 HA THR A 37 14.187 -1.483 -1.272 1.00 0.00 H new ATOM 0 HB THR A 37 12.047 -0.613 -3.251 1.00 0.00 H new ATOM 0 HG1 THR A 37 13.895 0.459 -4.216 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.622 1.702 -2.619 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.940 0.795 -1.248 1.00 0.00 H new ATOM 0 HG23 THR A 37 13.694 1.081 -1.341 1.00 0.00 H new ATOM 535 N ILE A 38 12.460 -1.009 0.493 1.00 0.00 N ATOM 536 CA ILE A 38 11.521 -0.935 1.605 1.00 0.00 C ATOM 537 C ILE A 38 10.151 -0.455 1.137 1.00 0.00 C ATOM 538 O ILE A 38 9.983 -0.047 -0.013 1.00 0.00 O ATOM 539 CB ILE A 38 12.031 0.008 2.711 1.00 0.00 C ATOM 540 CG1 ILE A 38 12.458 1.349 2.112 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.187 -0.635 3.462 1.00 0.00 C ATOM 542 CD1 ILE A 38 11.297 2.205 1.657 1.00 0.00 C ATOM 0 H ILE A 38 13.368 -0.582 0.678 1.00 0.00 H new ATOM 0 HA ILE A 38 11.432 -1.943 2.010 1.00 0.00 H new ATOM 0 HB ILE A 38 11.220 0.189 3.416 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.037 1.901 2.853 1.00 0.00 H new ATOM 0 HG13 ILE A 38 13.118 1.165 1.264 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.537 0.043 4.240 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.852 -1.567 3.916 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.002 -0.842 2.768 1.00 0.00 H new ATOM 0 HD11 ILE A 38 11.675 3.140 1.243 1.00 0.00 H new ATOM 0 HD12 ILE A 38 10.730 1.673 0.893 1.00 0.00 H new ATOM 0 HD13 ILE A 38 10.648 2.420 2.506 1.00 0.00 H new ATOM 554 N LEU A 39 9.174 -0.505 2.035 1.00 0.00 N ATOM 555 CA LEU A 39 7.817 -0.074 1.715 1.00 0.00 C ATOM 556 C LEU A 39 7.621 1.400 2.052 1.00 0.00 C ATOM 557 O LEU A 39 6.822 2.092 1.420 1.00 0.00 O ATOM 558 CB LEU A 39 6.798 -0.923 2.477 1.00 0.00 C ATOM 559 CG LEU A 39 6.677 -2.382 2.038 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.266 -3.261 3.209 1.00 0.00 C ATOM 561 CD2 LEU A 39 5.682 -2.514 0.894 1.00 0.00 C ATOM 0 H LEU A 39 9.296 -0.840 2.991 1.00 0.00 H new ATOM 0 HA LEU A 39 7.663 -0.207 0.644 1.00 0.00 H new ATOM 0 HB2 LEU A 39 7.058 -0.903 3.535 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.819 -0.453 2.380 1.00 0.00 H new ATOM 0 HG LEU A 39 7.653 -2.717 1.685 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.185 -4.296 2.876 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.015 -3.191 3.997 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.302 -2.927 3.594 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.609 -3.559 0.594 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.704 -2.160 1.220 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.020 -1.917 0.047 1.00 0.00 H new ATOM 573 N LYS A 40 8.357 1.877 3.050 1.00 0.00 N ATOM 574 CA LYS A 40 8.268 3.271 3.470 1.00 0.00 C ATOM 575 C LYS A 40 7.951 4.177 2.284 1.00 0.00 C ATOM 576 O LYS A 40 6.845 4.706 2.172 1.00 0.00 O ATOM 577 CB LYS A 40 9.577 3.712 4.127 1.00 0.00 C ATOM 578 CG LYS A 40 9.454 4.998 4.925 1.00 0.00 C ATOM 579 CD LYS A 40 8.814 4.754 6.281 1.00 0.00 C ATOM 580 CE LYS A 40 8.273 6.042 6.883 1.00 0.00 C ATOM 581 NZ LYS A 40 7.203 5.780 7.884 1.00 0.00 N ATOM 0 H LYS A 40 9.023 1.318 3.584 1.00 0.00 H new ATOM 0 HA LYS A 40 7.459 3.355 4.195 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.929 2.918 4.786 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.335 3.845 3.355 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.442 5.438 5.062 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.858 5.719 4.365 1.00 0.00 H new ATOM 0 HD2 LYS A 40 8.004 4.032 6.177 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.548 4.316 6.957 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.087 6.591 7.357 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.880 6.677 6.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 7.062 6.627 8.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 6.316 5.549 7.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.482 4.981 8.489 1.00 0.00 H new ATOM 595 N TYR A 41 8.927 4.350 1.400 1.00 0.00 N ATOM 596 CA TYR A 41 8.753 5.192 0.223 1.00 0.00 C ATOM 597 C TYR A 41 7.319 5.115 -0.294 1.00 0.00 C ATOM 598 O TYR A 41 6.704 6.136 -0.607 1.00 0.00 O ATOM 599 CB TYR A 41 9.727 4.773 -0.879 1.00 0.00 C ATOM 600 CG TYR A 41 11.148 5.232 -0.638 1.00 0.00 C ATOM 601 CD1 TYR A 41 11.472 6.584 -0.643 1.00 0.00 C ATOM 602 CD2 TYR A 41 12.165 4.316 -0.407 1.00 0.00 C ATOM 603 CE1 TYR A 41 12.768 7.008 -0.424 1.00 0.00 C ATOM 604 CE2 TYR A 41 13.464 4.731 -0.185 1.00 0.00 C ATOM 605 CZ TYR A 41 13.761 6.078 -0.195 1.00 0.00 C ATOM 606 OH TYR A 41 15.053 6.495 0.024 1.00 0.00 O ATOM 0 H TYR A 41 9.848 3.918 1.476 1.00 0.00 H new ATOM 0 HA TYR A 41 8.962 6.222 0.511 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.715 3.687 -0.969 1.00 0.00 H new ATOM 0 HB3 TYR A 41 9.381 5.175 -1.831 1.00 0.00 H new ATOM 0 HD1 TYR A 41 10.697 7.315 -0.821 1.00 0.00 H new ATOM 0 HD2 TYR A 41 11.937 3.260 -0.401 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.003 8.062 -0.432 1.00 0.00 H new ATOM 0 HE2 TYR A 41 14.243 4.005 -0.005 1.00 0.00 H new ATOM 0 HH TYR A 41 15.628 5.715 0.169 1.00 0.00 H new ATOM 616 N LEU A 42 6.793 3.899 -0.380 1.00 0.00 N ATOM 617 CA LEU A 42 5.431 3.686 -0.858 1.00 0.00 C ATOM 618 C LEU A 42 4.412 4.183 0.163 1.00 0.00 C ATOM 619 O LEU A 42 3.427 4.830 -0.192 1.00 0.00 O ATOM 620 CB LEU A 42 5.197 2.203 -1.149 1.00 0.00 C ATOM 621 CG LEU A 42 3.955 1.869 -1.975 1.00 0.00 C ATOM 622 CD1 LEU A 42 4.097 2.401 -3.392 1.00 0.00 C ATOM 623 CD2 LEU A 42 3.712 0.367 -1.990 1.00 0.00 C ATOM 0 H LEU A 42 7.289 3.045 -0.125 1.00 0.00 H new ATOM 0 HA LEU A 42 5.302 4.255 -1.779 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.071 1.813 -1.671 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.130 1.673 -0.199 1.00 0.00 H new ATOM 0 HG LEU A 42 3.094 2.352 -1.512 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.203 2.154 -3.965 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.222 3.483 -3.363 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.968 1.948 -3.865 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.824 0.148 -2.583 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.574 -0.137 -2.428 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.564 0.012 -0.970 1.00 0.00 H new ATOM 635 N LYS A 43 4.657 3.877 1.432 1.00 0.00 N ATOM 636 CA LYS A 43 3.763 4.294 2.506 1.00 0.00 C ATOM 637 C LYS A 43 3.519 5.799 2.457 1.00 0.00 C ATOM 638 O LYS A 43 2.404 6.248 2.188 1.00 0.00 O ATOM 639 CB LYS A 43 4.350 3.907 3.865 1.00 0.00 C ATOM 640 CG LYS A 43 3.433 4.218 5.035 1.00 0.00 C ATOM 641 CD LYS A 43 3.670 3.268 6.197 1.00 0.00 C ATOM 642 CE LYS A 43 2.804 2.022 6.084 1.00 0.00 C ATOM 643 NZ LYS A 43 1.354 2.342 6.198 1.00 0.00 N ATOM 0 H LYS A 43 5.468 3.341 1.742 1.00 0.00 H new ATOM 0 HA LYS A 43 2.809 3.784 2.370 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.574 2.840 3.864 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.295 4.431 4.006 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.596 5.244 5.364 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.394 4.148 4.713 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.721 2.981 6.225 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.454 3.779 7.136 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.994 1.533 5.128 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.082 1.314 6.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 0.839 1.504 6.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 1.223 3.124 6.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 0.986 2.621 5.266 1.00 0.00 H new ATOM 657 N ASP A 44 4.567 6.573 2.716 1.00 0.00 N ATOM 658 CA ASP A 44 4.466 8.028 2.698 1.00 0.00 C ATOM 659 C ASP A 44 3.762 8.508 1.433 1.00 0.00 C ATOM 660 O ASP A 44 2.837 9.319 1.495 1.00 0.00 O ATOM 661 CB ASP A 44 5.857 8.658 2.793 1.00 0.00 C ATOM 662 CG ASP A 44 6.535 8.368 4.118 1.00 0.00 C ATOM 663 OD1 ASP A 44 6.081 8.909 5.148 1.00 0.00 O ATOM 664 OD2 ASP A 44 7.518 7.599 4.125 1.00 0.00 O ATOM 0 H ASP A 44 5.496 6.217 2.941 1.00 0.00 H new ATOM 0 HA ASP A 44 3.876 8.338 3.560 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.479 8.283 1.980 1.00 0.00 H new ATOM 0 HB3 ASP A 44 5.774 9.737 2.659 1.00 0.00 H new ATOM 669 N HIS A 45 4.205 8.003 0.286 1.00 0.00 N ATOM 670 CA HIS A 45 3.618 8.381 -0.994 1.00 0.00 C ATOM 671 C HIS A 45 2.118 8.624 -0.852 1.00 0.00 C ATOM 672 O HIS A 45 1.568 9.546 -1.455 1.00 0.00 O ATOM 673 CB HIS A 45 3.874 7.294 -2.038 1.00 0.00 C ATOM 674 CG HIS A 45 3.679 7.760 -3.448 1.00 0.00 C ATOM 675 ND1 HIS A 45 4.646 7.633 -4.423 1.00 0.00 N ATOM 676 CD2 HIS A 45 2.620 8.353 -4.046 1.00 0.00 C ATOM 677 CE1 HIS A 45 4.190 8.130 -5.559 1.00 0.00 C ATOM 678 NE2 HIS A 45 2.962 8.573 -5.357 1.00 0.00 N ATOM 0 H HIS A 45 4.969 7.331 0.217 1.00 0.00 H new ATOM 0 HA HIS A 45 4.089 9.307 -1.323 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.893 6.925 -1.924 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.207 6.453 -1.846 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.680 8.606 -3.579 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.729 8.168 -6.494 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.365 9.008 -6.061 1.00 0.00 H new ATOM 687 N PHE A 46 1.461 7.790 -0.053 1.00 0.00 N ATOM 688 CA PHE A 46 0.025 7.913 0.166 1.00 0.00 C ATOM 689 C PHE A 46 -0.268 8.810 1.365 1.00 0.00 C ATOM 690 O PHE A 46 -1.002 9.792 1.255 1.00 0.00 O ATOM 691 CB PHE A 46 -0.599 6.533 0.384 1.00 0.00 C ATOM 692 CG PHE A 46 -0.821 5.768 -0.890 1.00 0.00 C ATOM 693 CD1 PHE A 46 0.216 5.066 -1.482 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.068 5.752 -1.495 1.00 0.00 C ATOM 695 CE1 PHE A 46 0.015 4.361 -2.654 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.275 5.048 -2.667 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.232 4.353 -3.247 1.00 0.00 C ATOM 0 H PHE A 46 1.900 7.022 0.454 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.415 8.368 -0.722 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.047 5.950 1.041 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.553 6.651 0.898 1.00 0.00 H new ATOM 0 HD1 PHE A 46 1.193 5.069 -1.022 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.887 6.295 -1.046 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.832 3.817 -3.105 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.251 5.042 -3.128 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.391 3.804 -4.163 1.00 0.00 H new ATOM 707 N SER A 47 0.312 8.466 2.510 1.00 0.00 N ATOM 708 CA SER A 47 0.111 9.236 3.732 1.00 0.00 C ATOM 709 C SER A 47 0.034 10.729 3.425 1.00 0.00 C ATOM 710 O SER A 47 -1.027 11.344 3.539 1.00 0.00 O ATOM 711 CB SER A 47 1.244 8.966 4.723 1.00 0.00 C ATOM 712 OG SER A 47 1.428 7.574 4.920 1.00 0.00 O ATOM 0 H SER A 47 0.926 7.658 2.617 1.00 0.00 H new ATOM 0 HA SER A 47 -0.833 8.924 4.178 1.00 0.00 H new ATOM 0 HB2 SER A 47 2.168 9.410 4.353 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.020 9.445 5.676 1.00 0.00 H new ATOM 0 HG SER A 47 2.087 7.237 4.277 1.00 0.00 H new ATOM 718 N HIS A 48 1.166 11.306 3.036 1.00 0.00 N ATOM 719 CA HIS A 48 1.228 12.727 2.712 1.00 0.00 C ATOM 720 C HIS A 48 0.063 13.131 1.813 1.00 0.00 C ATOM 721 O HIS A 48 -0.683 14.060 2.126 1.00 0.00 O ATOM 722 CB HIS A 48 2.555 13.058 2.028 1.00 0.00 C ATOM 723 CG HIS A 48 2.486 13.007 0.532 1.00 0.00 C ATOM 724 ND1 HIS A 48 2.273 14.123 -0.250 1.00 0.00 N ATOM 725 CD2 HIS A 48 2.605 11.966 -0.324 1.00 0.00 C ATOM 726 CE1 HIS A 48 2.263 13.770 -1.523 1.00 0.00 C ATOM 727 NE2 HIS A 48 2.462 12.466 -1.595 1.00 0.00 N ATOM 0 H HIS A 48 2.053 10.812 2.937 1.00 0.00 H new ATOM 0 HA HIS A 48 1.157 13.290 3.643 1.00 0.00 H new ATOM 0 HB2 HIS A 48 2.874 14.054 2.335 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.317 12.359 2.373 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.780 10.934 -0.057 1.00 0.00 H new ATOM 0 HE1 HIS A 48 2.117 14.434 -2.362 1.00 0.00 H new ATOM 0 HE2 HIS A 48 2.503 11.919 -2.455 1.00 0.00 H new ATOM 736 N LEU A 49 -0.086 12.428 0.696 1.00 0.00 N ATOM 737 CA LEU A 49 -1.160 12.714 -0.249 1.00 0.00 C ATOM 738 C LEU A 49 -2.500 12.836 0.470 1.00 0.00 C ATOM 739 O LEU A 49 -3.133 13.892 0.451 1.00 0.00 O ATOM 740 CB LEU A 49 -1.237 11.616 -1.311 1.00 0.00 C ATOM 741 CG LEU A 49 -2.089 11.930 -2.542 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.526 12.217 -2.136 1.00 0.00 C ATOM 743 CD2 LEU A 49 -1.504 13.107 -3.309 1.00 0.00 C ATOM 0 H LEU A 49 0.523 11.656 0.422 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.940 13.665 -0.734 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.224 11.389 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.629 10.713 -0.843 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.085 11.058 -3.196 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -4.118 12.438 -3.024 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.942 11.346 -1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.550 13.073 -1.462 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.123 13.316 -4.182 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.478 13.985 -2.664 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.492 12.864 -3.632 1.00 0.00 H new ATOM 755 N LEU A 50 -2.926 11.749 1.104 1.00 0.00 N ATOM 756 CA LEU A 50 -4.191 11.735 1.832 1.00 0.00 C ATOM 757 C LEU A 50 -4.232 12.848 2.874 1.00 0.00 C ATOM 758 O LEU A 50 -5.303 13.333 3.236 1.00 0.00 O ATOM 759 CB LEU A 50 -4.396 10.379 2.509 1.00 0.00 C ATOM 760 CG LEU A 50 -4.414 9.162 1.584 1.00 0.00 C ATOM 761 CD1 LEU A 50 -3.892 7.931 2.310 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.819 8.915 1.054 1.00 0.00 C ATOM 0 H LEU A 50 -2.415 10.867 1.129 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.996 11.903 1.117 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.604 10.239 3.244 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.338 10.408 3.057 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.758 9.364 0.737 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.912 7.075 1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.868 8.109 2.639 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.521 7.726 3.176 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -5.812 8.045 0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.496 8.735 1.889 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.156 9.788 0.496 1.00 0.00 H new ATOM 774 N GLY A 51 -3.057 13.250 3.350 1.00 0.00 N ATOM 775 CA GLY A 51 -2.982 14.304 4.344 1.00 0.00 C ATOM 776 C GLY A 51 -2.993 13.767 5.761 1.00 0.00 C ATOM 777 O GLY A 51 -3.249 14.509 6.711 1.00 0.00 O ATOM 0 H GLY A 51 -2.157 12.865 3.065 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.073 14.884 4.186 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.822 14.985 4.211 1.00 0.00 H new ATOM 781 N ILE A 52 -2.716 12.476 5.905 1.00 0.00 N ATOM 782 CA ILE A 52 -2.696 11.841 7.217 1.00 0.00 C ATOM 783 C ILE A 52 -1.342 11.198 7.496 1.00 0.00 C ATOM 784 O ILE A 52 -0.627 10.779 6.586 1.00 0.00 O ATOM 785 CB ILE A 52 -3.796 10.769 7.340 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.579 9.663 6.305 1.00 0.00 C ATOM 787 CG2 ILE A 52 -5.170 11.398 7.171 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.601 8.551 6.386 1.00 0.00 C ATOM 0 H ILE A 52 -2.502 11.849 5.129 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.881 12.626 7.950 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.741 10.326 8.334 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.608 10.100 5.307 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.583 9.241 6.440 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.936 10.628 7.260 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.322 12.153 7.943 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.238 11.865 6.188 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.386 7.803 5.623 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.557 8.088 7.372 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.598 8.960 6.221 1.00 0.00 H new ATOM 800 N PRO A 53 -0.980 11.117 8.785 1.00 0.00 N ATOM 801 CA PRO A 53 0.290 10.524 9.215 1.00 0.00 C ATOM 802 C PRO A 53 0.324 9.014 9.008 1.00 0.00 C ATOM 803 O PRO A 53 -0.679 8.327 9.207 1.00 0.00 O ATOM 804 CB PRO A 53 0.351 10.861 10.707 1.00 0.00 C ATOM 805 CG PRO A 53 -1.071 11.026 11.117 1.00 0.00 C ATOM 806 CD PRO A 53 -1.784 11.596 9.922 1.00 0.00 C ATOM 0 HA PRO A 53 1.134 10.908 8.642 1.00 0.00 H new ATOM 0 HB2 PRO A 53 0.836 10.066 11.273 1.00 0.00 H new ATOM 0 HB3 PRO A 53 0.922 11.772 10.884 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.505 10.071 11.411 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -1.155 11.692 11.976 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.814 11.244 9.863 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.821 12.685 9.958 1.00 0.00 H new ATOM 814 N HIS A 54 1.484 8.502 8.609 1.00 0.00 N ATOM 815 CA HIS A 54 1.649 7.071 8.376 1.00 0.00 C ATOM 816 C HIS A 54 1.537 6.292 9.683 1.00 0.00 C ATOM 817 O HIS A 54 1.424 5.066 9.678 1.00 0.00 O ATOM 818 CB HIS A 54 3.000 6.793 7.717 1.00 0.00 C ATOM 819 CG HIS A 54 4.169 7.274 8.519 1.00 0.00 C ATOM 820 ND1 HIS A 54 4.508 6.744 9.746 1.00 0.00 N ATOM 821 CD2 HIS A 54 5.080 8.241 8.263 1.00 0.00 C ATOM 822 CE1 HIS A 54 5.577 7.366 10.211 1.00 0.00 C ATOM 823 NE2 HIS A 54 5.945 8.279 9.330 1.00 0.00 N ATOM 0 H HIS A 54 2.323 9.056 8.440 1.00 0.00 H new ATOM 0 HA HIS A 54 0.853 6.742 7.708 1.00 0.00 H new ATOM 0 HB2 HIS A 54 3.100 5.720 7.552 1.00 0.00 H new ATOM 0 HB3 HIS A 54 3.022 7.270 6.737 1.00 0.00 H new ATOM 0 HD2 HIS A 54 5.120 8.867 7.384 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.067 7.163 11.152 1.00 0.00 H new ATOM 0 HE2 HIS A 54 6.741 8.909 9.426 1.00 0.00 H new ATOM 832 N SER A 55 1.570 7.011 10.800 1.00 0.00 N ATOM 833 CA SER A 55 1.477 6.387 12.115 1.00 0.00 C ATOM 834 C SER A 55 0.192 5.574 12.240 1.00 0.00 C ATOM 835 O SER A 55 0.226 4.379 12.535 1.00 0.00 O ATOM 836 CB SER A 55 1.530 7.451 13.213 1.00 0.00 C ATOM 837 OG SER A 55 1.799 6.867 14.476 1.00 0.00 O ATOM 0 H SER A 55 1.660 8.027 10.821 1.00 0.00 H new ATOM 0 HA SER A 55 2.326 5.713 12.231 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.301 8.184 12.976 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.581 7.987 13.251 1.00 0.00 H new ATOM 0 HG SER A 55 1.830 7.568 15.161 1.00 0.00 H new ATOM 843 N VAL A 56 -0.941 6.231 12.014 1.00 0.00 N ATOM 844 CA VAL A 56 -2.238 5.571 12.101 1.00 0.00 C ATOM 845 C VAL A 56 -2.464 4.646 10.910 1.00 0.00 C ATOM 846 O VAL A 56 -3.058 3.575 11.046 1.00 0.00 O ATOM 847 CB VAL A 56 -3.386 6.595 12.166 1.00 0.00 C ATOM 848 CG1 VAL A 56 -3.306 7.407 13.449 1.00 0.00 C ATOM 849 CG2 VAL A 56 -3.358 7.505 10.947 1.00 0.00 C ATOM 0 H VAL A 56 -0.987 7.220 11.769 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.233 4.983 13.019 1.00 0.00 H new ATOM 0 HB VAL A 56 -4.332 6.054 12.166 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -4.125 8.125 13.477 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.379 6.739 14.307 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.356 7.939 13.484 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -4.176 8.222 11.010 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -2.409 8.039 10.914 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.469 6.906 10.043 1.00 0.00 H new ATOM 859 N LEU A 57 -1.986 5.064 9.744 1.00 0.00 N ATOM 860 CA LEU A 57 -2.135 4.273 8.527 1.00 0.00 C ATOM 861 C LEU A 57 -1.267 3.020 8.583 1.00 0.00 C ATOM 862 O LEU A 57 -0.128 3.064 9.047 1.00 0.00 O ATOM 863 CB LEU A 57 -1.764 5.110 7.302 1.00 0.00 C ATOM 864 CG LEU A 57 -1.345 4.328 6.057 1.00 0.00 C ATOM 865 CD1 LEU A 57 -2.549 3.651 5.421 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.657 5.246 5.057 1.00 0.00 C ATOM 0 H LEU A 57 -1.491 5.947 9.615 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.178 3.967 8.447 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.617 5.737 7.043 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.949 5.779 7.577 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.637 3.556 6.358 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.231 3.099 4.536 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.999 2.962 6.136 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.281 4.406 5.134 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.366 4.672 4.177 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.342 6.041 4.762 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.230 5.683 5.515 1.00 0.00 H new ATOM 878 N GLN A 58 -1.813 1.906 8.105 1.00 0.00 N ATOM 879 CA GLN A 58 -1.087 0.642 8.100 1.00 0.00 C ATOM 880 C GLN A 58 -1.291 -0.098 6.782 1.00 0.00 C ATOM 881 O GLN A 58 -2.142 0.277 5.975 1.00 0.00 O ATOM 882 CB GLN A 58 -1.541 -0.237 9.267 1.00 0.00 C ATOM 883 CG GLN A 58 -1.246 0.364 10.632 1.00 0.00 C ATOM 884 CD GLN A 58 0.176 0.104 11.089 1.00 0.00 C ATOM 885 OE1 GLN A 58 1.035 -0.280 10.295 1.00 0.00 O ATOM 886 NE2 GLN A 58 0.432 0.314 12.375 1.00 0.00 N ATOM 0 H GLN A 58 -2.755 1.854 7.717 1.00 0.00 H new ATOM 0 HA GLN A 58 -0.025 0.862 8.212 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.613 -0.415 9.182 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -1.050 -1.207 9.193 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.421 1.439 10.597 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.940 -0.049 11.364 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.311 0.632 12.997 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.371 0.157 12.740 1.00 0.00 H new ATOM 895 N ILE A 59 -0.505 -1.148 6.570 1.00 0.00 N ATOM 896 CA ILE A 59 -0.601 -1.940 5.350 1.00 0.00 C ATOM 897 C ILE A 59 -0.665 -3.430 5.666 1.00 0.00 C ATOM 898 O ILE A 59 0.216 -3.972 6.333 1.00 0.00 O ATOM 899 CB ILE A 59 0.592 -1.676 4.413 1.00 0.00 C ATOM 900 CG1 ILE A 59 0.677 -0.188 4.067 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.467 -2.513 3.148 1.00 0.00 C ATOM 902 CD1 ILE A 59 1.793 0.145 3.100 1.00 0.00 C ATOM 0 H ILE A 59 0.205 -1.470 7.227 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.520 -1.638 4.848 1.00 0.00 H new ATOM 0 HB ILE A 59 1.509 -1.963 4.927 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.272 0.132 3.638 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.820 0.383 4.985 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.318 -2.316 2.496 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.450 -3.570 3.412 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.456 -2.253 2.630 1.00 0.00 H new ATOM 0 HD11 ILE A 59 1.794 1.216 2.900 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.750 -0.143 3.535 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.640 -0.398 2.167 1.00 0.00 H new ATOM 914 N ARG A 60 -1.713 -4.088 5.181 1.00 0.00 N ATOM 915 CA ARG A 60 -1.892 -5.516 5.410 1.00 0.00 C ATOM 916 C ARG A 60 -1.677 -6.305 4.122 1.00 0.00 C ATOM 917 O ARG A 60 -2.226 -5.964 3.074 1.00 0.00 O ATOM 918 CB ARG A 60 -3.291 -5.794 5.964 1.00 0.00 C ATOM 919 CG ARG A 60 -3.513 -7.245 6.359 1.00 0.00 C ATOM 920 CD ARG A 60 -4.671 -7.386 7.334 1.00 0.00 C ATOM 921 NE ARG A 60 -4.455 -6.615 8.556 1.00 0.00 N ATOM 922 CZ ARG A 60 -5.354 -6.513 9.529 1.00 0.00 C ATOM 923 NH1 ARG A 60 -6.523 -7.129 9.424 1.00 0.00 N ATOM 924 NH2 ARG A 60 -5.083 -5.793 10.610 1.00 0.00 N ATOM 0 H ARG A 60 -2.451 -3.654 4.627 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.149 -5.837 6.140 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.461 -5.160 6.834 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -4.031 -5.513 5.215 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -3.712 -7.840 5.467 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -2.605 -7.643 6.811 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.592 -7.054 6.854 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -4.805 -8.438 7.588 1.00 0.00 H new ATOM 0 HE ARG A 60 -3.566 -6.128 8.668 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.735 -7.683 8.594 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -7.211 -7.049 10.173 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -4.184 -5.318 10.694 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -5.773 -5.715 11.357 1.00 0.00 H new ATOM 938 N TYR A 61 -0.876 -7.361 4.208 1.00 0.00 N ATOM 939 CA TYR A 61 -0.586 -8.196 3.049 1.00 0.00 C ATOM 940 C TYR A 61 -0.587 -9.674 3.428 1.00 0.00 C ATOM 941 O TYR A 61 0.124 -10.092 4.342 1.00 0.00 O ATOM 942 CB TYR A 61 0.766 -7.815 2.444 1.00 0.00 C ATOM 943 CG TYR A 61 1.261 -8.792 1.402 1.00 0.00 C ATOM 944 CD1 TYR A 61 0.752 -8.777 0.109 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.239 -9.730 1.709 1.00 0.00 C ATOM 946 CE1 TYR A 61 1.200 -9.668 -0.846 1.00 0.00 C ATOM 947 CE2 TYR A 61 2.694 -10.625 0.760 1.00 0.00 C ATOM 948 CZ TYR A 61 2.172 -10.590 -0.516 1.00 0.00 C ATOM 949 OH TYR A 61 2.622 -11.479 -1.465 1.00 0.00 O ATOM 0 H TYR A 61 -0.416 -7.659 5.068 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.368 -8.028 2.309 1.00 0.00 H new ATOM 0 HB2 TYR A 61 0.687 -6.826 1.993 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.505 -7.743 3.242 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.008 -8.056 -0.154 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.651 -9.760 2.707 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.792 -9.643 -1.846 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.454 -11.348 1.016 1.00 0.00 H new ATOM 0 HH TYR A 61 3.307 -12.059 -1.071 1.00 0.00 H new ATOM 959 N SER A 62 -1.391 -10.460 2.719 1.00 0.00 N ATOM 960 CA SER A 62 -1.488 -11.891 2.982 1.00 0.00 C ATOM 961 C SER A 62 -1.852 -12.151 4.441 1.00 0.00 C ATOM 962 O SER A 62 -1.481 -13.176 5.012 1.00 0.00 O ATOM 963 CB SER A 62 -0.167 -12.584 2.643 1.00 0.00 C ATOM 964 OG SER A 62 -0.377 -13.947 2.313 1.00 0.00 O ATOM 0 H SER A 62 -1.985 -10.130 1.958 1.00 0.00 H new ATOM 0 HA SER A 62 -2.277 -12.299 2.350 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.311 -12.074 1.807 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.513 -12.512 3.492 1.00 0.00 H new ATOM 0 HG SER A 62 0.482 -14.368 2.099 1.00 0.00 H new ATOM 970 N GLY A 63 -2.581 -11.214 5.039 1.00 0.00 N ATOM 971 CA GLY A 63 -2.984 -11.360 6.426 1.00 0.00 C ATOM 972 C GLY A 63 -1.857 -11.051 7.392 1.00 0.00 C ATOM 973 O GLY A 63 -1.931 -11.391 8.573 1.00 0.00 O ATOM 0 H GLY A 63 -2.900 -10.356 4.588 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.825 -10.696 6.629 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.334 -12.378 6.594 1.00 0.00 H new ATOM 977 N LYS A 64 -0.810 -10.406 6.890 1.00 0.00 N ATOM 978 CA LYS A 64 0.339 -10.052 7.715 1.00 0.00 C ATOM 979 C LYS A 64 0.506 -8.537 7.793 1.00 0.00 C ATOM 980 O LYS A 64 0.056 -7.808 6.909 1.00 0.00 O ATOM 981 CB LYS A 64 1.612 -10.688 7.154 1.00 0.00 C ATOM 982 CG LYS A 64 1.638 -12.202 7.272 1.00 0.00 C ATOM 983 CD LYS A 64 2.928 -12.783 6.717 1.00 0.00 C ATOM 984 CE LYS A 64 2.865 -12.936 5.205 1.00 0.00 C ATOM 985 NZ LYS A 64 3.716 -14.060 4.725 1.00 0.00 N ATOM 0 H LYS A 64 -0.733 -10.117 5.915 1.00 0.00 H new ATOM 0 HA LYS A 64 0.164 -10.433 8.721 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.714 -10.412 6.104 1.00 0.00 H new ATOM 0 HB3 LYS A 64 2.475 -10.276 7.677 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.530 -12.488 8.318 1.00 0.00 H new ATOM 0 HG3 LYS A 64 0.788 -12.624 6.736 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.764 -12.136 6.984 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.117 -13.754 7.174 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.833 -13.106 4.900 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.188 -12.008 4.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.646 -14.131 3.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.705 -13.886 4.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.392 -14.949 5.156 1.00 0.00 H new ATOM 999 N ILE A 65 1.158 -8.072 8.854 1.00 0.00 N ATOM 1000 CA ILE A 65 1.386 -6.645 9.044 1.00 0.00 C ATOM 1001 C ILE A 65 2.775 -6.242 8.559 1.00 0.00 C ATOM 1002 O ILE A 65 3.774 -6.472 9.242 1.00 0.00 O ATOM 1003 CB ILE A 65 1.234 -6.243 10.523 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.180 -6.556 11.016 1.00 0.00 C ATOM 1005 CG2 ILE A 65 1.550 -4.766 10.705 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.265 -5.867 10.218 1.00 0.00 C ATOM 0 H ILE A 65 1.537 -8.662 9.594 1.00 0.00 H new ATOM 0 HA ILE A 65 0.632 -6.123 8.455 1.00 0.00 H new ATOM 0 HB ILE A 65 1.942 -6.822 11.117 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.340 -7.634 10.976 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.265 -6.260 12.061 1.00 0.00 H new ATOM 0 HG21 ILE A 65 1.438 -4.497 11.755 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.574 -4.571 10.387 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.864 -4.170 10.103 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.241 -6.135 10.624 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.131 -4.787 10.278 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.206 -6.182 9.176 1.00 0.00 H new ATOM 1018 N LEU A 66 2.830 -5.638 7.377 1.00 0.00 N ATOM 1019 CA LEU A 66 4.096 -5.199 6.801 1.00 0.00 C ATOM 1020 C LEU A 66 4.670 -4.019 7.579 1.00 0.00 C ATOM 1021 O LEU A 66 4.097 -3.583 8.578 1.00 0.00 O ATOM 1022 CB LEU A 66 3.904 -4.812 5.334 1.00 0.00 C ATOM 1023 CG LEU A 66 3.250 -5.867 4.441 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.169 -5.375 3.004 1.00 0.00 C ATOM 1025 CD2 LEU A 66 4.019 -7.179 4.514 1.00 0.00 C ATOM 0 H LEU A 66 2.013 -5.441 6.799 1.00 0.00 H new ATOM 0 HA LEU A 66 4.801 -6.028 6.863 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.299 -3.906 5.294 1.00 0.00 H new ATOM 0 HB3 LEU A 66 4.879 -4.563 4.914 1.00 0.00 H new ATOM 0 HG LEU A 66 2.236 -6.042 4.802 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.701 -6.139 2.384 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.575 -4.462 2.965 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.173 -5.171 2.632 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.539 -7.918 3.872 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.044 -7.019 4.180 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.025 -7.541 5.542 1.00 0.00 H new ATOM 1037 N LYS A 67 5.802 -3.504 7.113 1.00 0.00 N ATOM 1038 CA LYS A 67 6.453 -2.372 7.763 1.00 0.00 C ATOM 1039 C LYS A 67 7.501 -1.748 6.847 1.00 0.00 C ATOM 1040 O LYS A 67 7.724 -2.219 5.732 1.00 0.00 O ATOM 1041 CB LYS A 67 7.105 -2.816 9.074 1.00 0.00 C ATOM 1042 CG LYS A 67 6.152 -2.820 10.257 1.00 0.00 C ATOM 1043 CD LYS A 67 6.889 -2.602 11.568 1.00 0.00 C ATOM 1044 CE LYS A 67 5.964 -2.774 12.762 1.00 0.00 C ATOM 1045 NZ LYS A 67 5.665 -4.208 13.031 1.00 0.00 N ATOM 0 H LYS A 67 6.289 -3.852 6.287 1.00 0.00 H new ATOM 0 HA LYS A 67 5.692 -1.622 7.979 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.515 -3.818 8.945 1.00 0.00 H new ATOM 0 HB3 LYS A 67 7.943 -2.155 9.295 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.404 -2.039 10.125 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.618 -3.770 10.292 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.717 -3.307 11.643 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.321 -1.601 11.582 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.423 -2.327 13.644 1.00 0.00 H new ATOM 0 HE3 LYS A 67 5.033 -2.237 12.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 5.087 -4.287 13.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 5.144 -4.611 12.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.555 -4.729 13.163 1.00 0.00 H new ATOM 1059 N ASN A 68 8.141 -0.686 7.325 1.00 0.00 N ATOM 1060 CA ASN A 68 9.167 0.001 6.549 1.00 0.00 C ATOM 1061 C ASN A 68 10.411 -0.869 6.399 1.00 0.00 C ATOM 1062 O ASN A 68 10.698 -1.377 5.316 1.00 0.00 O ATOM 1063 CB ASN A 68 9.536 1.328 7.215 1.00 0.00 C ATOM 1064 CG ASN A 68 10.963 1.747 6.918 1.00 0.00 C ATOM 1065 OD1 ASN A 68 11.642 2.325 7.766 1.00 0.00 O ATOM 1066 ND2 ASN A 68 11.424 1.456 5.707 1.00 0.00 N ATOM 0 H ASN A 68 7.967 -0.283 8.246 1.00 0.00 H new ATOM 0 HA ASN A 68 8.764 0.200 5.556 1.00 0.00 H new ATOM 0 HB2 ASN A 68 8.853 2.106 6.872 1.00 0.00 H new ATOM 0 HB3 ASN A 68 9.403 1.240 8.293 1.00 0.00 H new ATOM 0 HD21 ASN A 68 12.377 1.713 5.449 1.00 0.00 H new ATOM 0 HD22 ASN A 68 10.825 0.975 5.035 1.00 0.00 H new ATOM 1073 N ASN A 69 11.145 -1.037 7.494 1.00 0.00 N ATOM 1074 CA ASN A 69 12.358 -1.846 7.485 1.00 0.00 C ATOM 1075 C ASN A 69 12.141 -3.143 6.710 1.00 0.00 C ATOM 1076 O ASN A 69 13.086 -3.722 6.175 1.00 0.00 O ATOM 1077 CB ASN A 69 12.796 -2.162 8.917 1.00 0.00 C ATOM 1078 CG ASN A 69 13.704 -3.374 8.989 1.00 0.00 C ATOM 1079 OD1 ASN A 69 13.309 -4.430 9.484 1.00 0.00 O ATOM 1080 ND2 ASN A 69 14.928 -3.227 8.496 1.00 0.00 N ATOM 0 H ASN A 69 10.921 -0.623 8.399 1.00 0.00 H new ATOM 0 HA ASN A 69 13.143 -1.274 6.990 1.00 0.00 H new ATOM 0 HB2 ASN A 69 13.313 -1.298 9.335 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.914 -2.335 9.534 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.584 -4.008 8.518 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.212 -2.333 8.095 1.00 0.00 H new ATOM 1087 N GLU A 70 10.891 -3.591 6.655 1.00 0.00 N ATOM 1088 CA GLU A 70 10.551 -4.819 5.946 1.00 0.00 C ATOM 1089 C GLU A 70 10.498 -4.580 4.440 1.00 0.00 C ATOM 1090 O GLU A 70 10.150 -3.491 3.983 1.00 0.00 O ATOM 1091 CB GLU A 70 9.206 -5.361 6.435 1.00 0.00 C ATOM 1092 CG GLU A 70 9.322 -6.281 7.638 1.00 0.00 C ATOM 1093 CD GLU A 70 10.133 -5.671 8.764 1.00 0.00 C ATOM 1094 OE1 GLU A 70 11.378 -5.656 8.657 1.00 0.00 O ATOM 1095 OE2 GLU A 70 9.525 -5.208 9.751 1.00 0.00 O ATOM 0 H GLU A 70 10.098 -3.123 7.092 1.00 0.00 H new ATOM 0 HA GLU A 70 11.328 -5.555 6.153 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.557 -4.523 6.690 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.724 -5.901 5.620 1.00 0.00 H new ATOM 0 HG2 GLU A 70 8.324 -6.522 8.004 1.00 0.00 H new ATOM 0 HG3 GLU A 70 9.784 -7.219 7.330 1.00 0.00 H new ATOM 1102 N THR A 71 10.848 -5.607 3.671 1.00 0.00 N ATOM 1103 CA THR A 71 10.843 -5.511 2.217 1.00 0.00 C ATOM 1104 C THR A 71 9.903 -6.540 1.601 1.00 0.00 C ATOM 1105 O THR A 71 9.530 -7.520 2.247 1.00 0.00 O ATOM 1106 CB THR A 71 12.256 -5.709 1.636 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.238 -5.217 2.555 1.00 0.00 O ATOM 1108 CG2 THR A 71 12.398 -4.992 0.302 1.00 0.00 C ATOM 0 H THR A 71 11.139 -6.516 4.032 1.00 0.00 H new ATOM 0 HA THR A 71 10.493 -4.509 1.968 1.00 0.00 H new ATOM 0 HB THR A 71 12.412 -6.776 1.476 1.00 0.00 H new ATOM 0 HG1 THR A 71 14.133 -5.348 2.179 1.00 0.00 H new ATOM 0 HG21 THR A 71 13.404 -5.146 -0.089 1.00 0.00 H new ATOM 0 HG22 THR A 71 11.669 -5.390 -0.404 1.00 0.00 H new ATOM 0 HG23 THR A 71 12.223 -3.925 0.442 1.00 0.00 H new ATOM 1116 N LEU A 72 9.525 -6.313 0.348 1.00 0.00 N ATOM 1117 CA LEU A 72 8.628 -7.223 -0.357 1.00 0.00 C ATOM 1118 C LEU A 72 9.278 -8.589 -0.548 1.00 0.00 C ATOM 1119 O LEU A 72 8.648 -9.624 -0.332 1.00 0.00 O ATOM 1120 CB LEU A 72 8.239 -6.636 -1.715 1.00 0.00 C ATOM 1121 CG LEU A 72 7.305 -5.426 -1.680 1.00 0.00 C ATOM 1122 CD1 LEU A 72 6.046 -5.745 -0.889 1.00 0.00 C ATOM 1123 CD2 LEU A 72 8.018 -4.219 -1.087 1.00 0.00 C ATOM 0 H LEU A 72 9.825 -5.507 -0.201 1.00 0.00 H new ATOM 0 HA LEU A 72 7.730 -7.350 0.248 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.151 -6.351 -2.240 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.764 -7.420 -2.305 1.00 0.00 H new ATOM 0 HG LEU A 72 7.015 -5.186 -2.703 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.394 -4.872 -0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.524 -6.580 -1.356 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.316 -6.012 0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.338 -3.367 -1.070 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.338 -4.448 -0.071 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.889 -3.976 -1.695 1.00 0.00 H new ATOM 1135 N VAL A 73 10.544 -8.585 -0.953 1.00 0.00 N ATOM 1136 CA VAL A 73 11.282 -9.824 -1.170 1.00 0.00 C ATOM 1137 C VAL A 73 11.505 -10.568 0.141 1.00 0.00 C ATOM 1138 O VAL A 73 11.737 -11.776 0.149 1.00 0.00 O ATOM 1139 CB VAL A 73 12.646 -9.556 -1.834 1.00 0.00 C ATOM 1140 CG1 VAL A 73 12.457 -8.968 -3.224 1.00 0.00 C ATOM 1141 CG2 VAL A 73 13.489 -8.634 -0.966 1.00 0.00 C ATOM 0 H VAL A 73 11.080 -7.737 -1.138 1.00 0.00 H new ATOM 0 HA VAL A 73 10.677 -10.440 -1.835 1.00 0.00 H new ATOM 0 HB VAL A 73 13.174 -10.504 -1.936 1.00 0.00 H new ATOM 0 HG11 VAL A 73 13.431 -8.785 -3.677 1.00 0.00 H new ATOM 0 HG12 VAL A 73 11.895 -9.668 -3.842 1.00 0.00 H new ATOM 0 HG13 VAL A 73 11.909 -8.028 -3.150 1.00 0.00 H new ATOM 0 HG21 VAL A 73 14.449 -8.455 -1.450 1.00 0.00 H new ATOM 0 HG22 VAL A 73 12.969 -7.686 -0.831 1.00 0.00 H new ATOM 0 HG23 VAL A 73 13.654 -9.099 0.006 1.00 0.00 H new ATOM 1151 N GLN A 74 11.432 -9.837 1.250 1.00 0.00 N ATOM 1152 CA GLN A 74 11.626 -10.429 2.568 1.00 0.00 C ATOM 1153 C GLN A 74 10.390 -11.210 3.002 1.00 0.00 C ATOM 1154 O GLN A 74 10.480 -12.140 3.803 1.00 0.00 O ATOM 1155 CB GLN A 74 11.944 -9.342 3.596 1.00 0.00 C ATOM 1156 CG GLN A 74 13.335 -8.748 3.444 1.00 0.00 C ATOM 1157 CD GLN A 74 14.392 -9.541 4.186 1.00 0.00 C ATOM 1158 OE1 GLN A 74 14.195 -9.936 5.336 1.00 0.00 O ATOM 1159 NE2 GLN A 74 15.523 -9.779 3.532 1.00 0.00 N ATOM 0 H GLN A 74 11.240 -8.835 1.261 1.00 0.00 H new ATOM 0 HA GLN A 74 12.467 -11.120 2.508 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.206 -8.544 3.509 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.844 -9.761 4.597 1.00 0.00 H new ATOM 0 HG2 GLN A 74 13.594 -8.705 2.386 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.330 -7.722 3.813 1.00 0.00 H new ATOM 0 HE21 GLN A 74 15.644 -9.433 2.580 1.00 0.00 H new ATOM 0 HE22 GLN A 74 16.270 -10.308 3.982 1.00 0.00 H new ATOM 1168 N HIS A 75 9.235 -10.825 2.467 1.00 0.00 N ATOM 1169 CA HIS A 75 7.980 -11.489 2.799 1.00 0.00 C ATOM 1170 C HIS A 75 7.688 -12.621 1.818 1.00 0.00 C ATOM 1171 O HIS A 75 6.920 -13.534 2.119 1.00 0.00 O ATOM 1172 CB HIS A 75 6.828 -10.483 2.793 1.00 0.00 C ATOM 1173 CG HIS A 75 6.616 -9.808 4.113 1.00 0.00 C ATOM 1174 ND1 HIS A 75 5.875 -10.366 5.133 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.054 -8.614 4.577 1.00 0.00 C ATOM 1176 CE1 HIS A 75 5.865 -9.543 6.167 1.00 0.00 C ATOM 1177 NE2 HIS A 75 6.574 -8.473 5.856 1.00 0.00 N ATOM 0 H HIS A 75 9.143 -10.057 1.802 1.00 0.00 H new ATOM 0 HA HIS A 75 8.076 -11.913 3.798 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.022 -9.725 2.034 1.00 0.00 H new ATOM 0 HB3 HIS A 75 5.910 -10.996 2.505 1.00 0.00 H new ATOM 0 HD2 HIS A 75 7.667 -7.904 4.041 1.00 0.00 H new ATOM 0 HE1 HIS A 75 5.362 -9.716 7.107 1.00 0.00 H new ATOM 0 HE2 HIS A 75 6.738 -7.672 6.466 1.00 0.00 H new ATOM 1186 N GLY A 76 8.305 -12.552 0.642 1.00 0.00 N ATOM 1187 CA GLY A 76 8.098 -13.576 -0.365 1.00 0.00 C ATOM 1188 C GLY A 76 7.584 -13.007 -1.673 1.00 0.00 C ATOM 1189 O GLY A 76 6.575 -13.468 -2.205 1.00 0.00 O ATOM 0 H GLY A 76 8.944 -11.805 0.369 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.037 -14.100 -0.544 1.00 0.00 H new ATOM 0 HA3 GLY A 76 7.388 -14.313 0.011 1.00 0.00 H new ATOM 1193 N VAL A 77 8.279 -11.999 -2.192 1.00 0.00 N ATOM 1194 CA VAL A 77 7.886 -11.365 -3.445 1.00 0.00 C ATOM 1195 C VAL A 77 9.038 -11.365 -4.444 1.00 0.00 C ATOM 1196 O VAL A 77 10.179 -11.066 -4.093 1.00 0.00 O ATOM 1197 CB VAL A 77 7.417 -9.916 -3.218 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.191 -9.213 -4.548 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.154 -9.892 -2.371 1.00 0.00 C ATOM 0 H VAL A 77 9.117 -11.604 -1.764 1.00 0.00 H new ATOM 0 HA VAL A 77 7.058 -11.947 -3.849 1.00 0.00 H new ATOM 0 HB VAL A 77 8.198 -9.380 -2.680 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.860 -8.190 -4.367 1.00 0.00 H new ATOM 0 HG12 VAL A 77 8.122 -9.198 -5.115 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.429 -9.746 -5.116 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.836 -8.860 -2.220 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.364 -10.444 -2.880 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.355 -10.354 -1.405 1.00 0.00 H new ATOM 1209 N LYS A 78 8.731 -11.701 -5.692 1.00 0.00 N ATOM 1210 CA LYS A 78 9.738 -11.738 -6.745 1.00 0.00 C ATOM 1211 C LYS A 78 9.559 -10.571 -7.712 1.00 0.00 C ATOM 1212 O LYS A 78 8.494 -9.958 -7.791 1.00 0.00 O ATOM 1213 CB LYS A 78 9.660 -13.062 -7.508 1.00 0.00 C ATOM 1214 CG LYS A 78 10.502 -14.168 -6.896 1.00 0.00 C ATOM 1215 CD LYS A 78 10.692 -15.325 -7.862 1.00 0.00 C ATOM 1216 CE LYS A 78 11.878 -15.091 -8.785 1.00 0.00 C ATOM 1217 NZ LYS A 78 13.176 -15.311 -8.087 1.00 0.00 N ATOM 0 H LYS A 78 7.791 -11.952 -5.999 1.00 0.00 H new ATOM 0 HA LYS A 78 10.719 -11.652 -6.277 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.621 -13.388 -7.548 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.982 -12.898 -8.536 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.475 -13.769 -6.609 1.00 0.00 H new ATOM 0 HG3 LYS A 78 10.024 -14.528 -5.985 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.842 -16.248 -7.301 1.00 0.00 H new ATOM 0 HD3 LYS A 78 9.788 -15.457 -8.456 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.809 -15.760 -9.642 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.842 -14.073 -9.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.951 -15.292 -8.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.323 -14.560 -7.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.161 -16.235 -7.610 1.00 0.00 H new ATOM 1231 N PRO A 79 10.623 -10.257 -8.465 1.00 0.00 N ATOM 1232 CA PRO A 79 10.606 -9.163 -9.441 1.00 0.00 C ATOM 1233 C PRO A 79 9.723 -9.473 -10.645 1.00 0.00 C ATOM 1234 O PRO A 79 9.620 -10.624 -11.070 1.00 0.00 O ATOM 1235 CB PRO A 79 12.071 -9.048 -9.870 1.00 0.00 C ATOM 1236 CG PRO A 79 12.645 -10.401 -9.625 1.00 0.00 C ATOM 1237 CD PRO A 79 11.924 -10.946 -8.423 1.00 0.00 C ATOM 0 HA PRO A 79 10.197 -8.246 -9.017 1.00 0.00 H new ATOM 0 HB2 PRO A 79 12.155 -8.766 -10.920 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.594 -8.286 -9.293 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.503 -11.047 -10.491 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.718 -10.342 -9.443 1.00 0.00 H new ATOM 0 HD2 PRO A 79 11.808 -12.028 -8.481 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.463 -10.732 -7.500 1.00 0.00 H new ATOM 1245 N GLN A 80 9.087 -8.440 -11.188 1.00 0.00 N ATOM 1246 CA GLN A 80 8.211 -8.604 -12.342 1.00 0.00 C ATOM 1247 C GLN A 80 7.028 -9.506 -12.005 1.00 0.00 C ATOM 1248 O GLN A 80 6.631 -10.350 -12.808 1.00 0.00 O ATOM 1249 CB GLN A 80 8.992 -9.187 -13.522 1.00 0.00 C ATOM 1250 CG GLN A 80 10.034 -8.237 -14.090 1.00 0.00 C ATOM 1251 CD GLN A 80 10.820 -8.849 -15.233 1.00 0.00 C ATOM 1252 OE1 GLN A 80 11.982 -9.224 -15.072 1.00 0.00 O ATOM 1253 NE2 GLN A 80 10.188 -8.954 -16.396 1.00 0.00 N ATOM 0 H GLN A 80 9.162 -7.481 -10.848 1.00 0.00 H new ATOM 0 HA GLN A 80 7.828 -7.622 -12.618 1.00 0.00 H new ATOM 0 HB2 GLN A 80 9.485 -10.105 -13.203 1.00 0.00 H new ATOM 0 HB3 GLN A 80 8.292 -9.459 -14.312 1.00 0.00 H new ATOM 0 HG2 GLN A 80 9.541 -7.329 -14.438 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.722 -7.942 -13.298 1.00 0.00 H new ATOM 0 HE21 GLN A 80 9.225 -8.630 -16.484 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.666 -9.359 -17.201 1.00 0.00 H new ATOM 1262 N GLU A 81 6.470 -9.321 -10.813 1.00 0.00 N ATOM 1263 CA GLU A 81 5.333 -10.119 -10.370 1.00 0.00 C ATOM 1264 C GLU A 81 4.171 -9.224 -9.950 1.00 0.00 C ATOM 1265 O GLU A 81 4.353 -8.035 -9.687 1.00 0.00 O ATOM 1266 CB GLU A 81 5.741 -11.025 -9.206 1.00 0.00 C ATOM 1267 CG GLU A 81 5.550 -10.385 -7.841 1.00 0.00 C ATOM 1268 CD GLU A 81 5.774 -11.361 -6.702 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.405 -12.413 -6.937 1.00 0.00 O ATOM 1270 OE2 GLU A 81 5.319 -11.072 -5.576 1.00 0.00 O ATOM 0 H GLU A 81 6.787 -8.626 -10.137 1.00 0.00 H new ATOM 0 HA GLU A 81 5.008 -10.738 -11.206 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.158 -11.945 -9.251 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.788 -11.304 -9.324 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.239 -9.547 -7.737 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.541 -9.978 -7.773 1.00 0.00 H new ATOM 1277 N ILE A 82 2.977 -9.805 -9.890 1.00 0.00 N ATOM 1278 CA ILE A 82 1.785 -9.061 -9.502 1.00 0.00 C ATOM 1279 C ILE A 82 1.264 -9.526 -8.146 1.00 0.00 C ATOM 1280 O ILE A 82 1.157 -10.725 -7.889 1.00 0.00 O ATOM 1281 CB ILE A 82 0.665 -9.207 -10.548 1.00 0.00 C ATOM 1282 CG1 ILE A 82 1.187 -8.844 -11.940 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.523 -8.332 -10.177 1.00 0.00 C ATOM 1284 CD1 ILE A 82 1.762 -10.022 -12.695 1.00 0.00 C ATOM 0 H ILE A 82 2.810 -10.788 -10.105 1.00 0.00 H new ATOM 0 HA ILE A 82 2.075 -8.012 -9.437 1.00 0.00 H new ATOM 0 HB ILE A 82 0.335 -10.246 -10.564 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.374 -8.411 -12.523 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.954 -8.076 -11.843 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.307 -8.446 -10.926 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.906 -8.633 -9.202 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.208 -7.289 -10.137 1.00 0.00 H new ATOM 0 HD11 ILE A 82 2.113 -9.691 -13.673 1.00 0.00 H new ATOM 0 HD12 ILE A 82 2.596 -10.442 -12.133 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.992 -10.783 -12.824 1.00 0.00 H new ATOM 1296 N VAL A 83 0.938 -8.569 -7.283 1.00 0.00 N ATOM 1297 CA VAL A 83 0.424 -8.880 -5.955 1.00 0.00 C ATOM 1298 C VAL A 83 -0.780 -8.010 -5.614 1.00 0.00 C ATOM 1299 O VAL A 83 -1.229 -7.208 -6.431 1.00 0.00 O ATOM 1300 CB VAL A 83 1.506 -8.687 -4.875 1.00 0.00 C ATOM 1301 CG1 VAL A 83 2.808 -9.348 -5.299 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.717 -7.207 -4.593 1.00 0.00 C ATOM 0 H VAL A 83 1.021 -7.572 -7.480 1.00 0.00 H new ATOM 0 HA VAL A 83 0.119 -9.926 -5.971 1.00 0.00 H new ATOM 0 HB VAL A 83 1.167 -9.165 -3.956 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.560 -9.201 -4.524 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.643 -10.415 -5.447 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.156 -8.902 -6.231 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.484 -7.088 -3.828 1.00 0.00 H new ATOM 0 HG22 VAL A 83 2.034 -6.704 -5.507 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.784 -6.767 -4.242 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.298 -8.175 -4.401 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.451 -7.404 -3.952 1.00 0.00 C ATOM 1314 C GLN A 84 -2.337 -7.068 -2.468 1.00 0.00 C ATOM 1315 O GLN A 84 -2.267 -7.960 -1.623 1.00 0.00 O ATOM 1316 CB GLN A 84 -3.743 -8.181 -4.213 1.00 0.00 C ATOM 1317 CG GLN A 84 -4.996 -7.325 -4.122 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.267 -8.151 -4.105 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.439 -9.064 -4.913 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.167 -7.834 -3.181 1.00 0.00 N ATOM 0 H GLN A 84 -0.938 -8.835 -3.712 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.475 -6.472 -4.516 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.692 -8.632 -5.204 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.818 -8.997 -3.495 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -4.951 -6.716 -3.219 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.025 -6.638 -4.968 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -6.983 -7.070 -2.531 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.042 -8.355 -3.121 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.319 -5.776 -2.159 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.214 -5.321 -0.778 1.00 0.00 C ATOM 1331 C VAL A 85 -3.436 -4.504 -0.374 1.00 0.00 C ATOM 1332 O VAL A 85 -4.184 -4.026 -1.226 1.00 0.00 O ATOM 1333 CB VAL A 85 -0.947 -4.472 -0.561 1.00 0.00 C ATOM 1334 CG1 VAL A 85 0.298 -5.270 -0.919 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -1.021 -3.189 -1.374 1.00 0.00 C ATOM 0 H VAL A 85 -2.376 -5.025 -2.847 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.155 -6.213 -0.155 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.886 -4.203 0.494 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.183 -4.654 -0.760 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.355 -6.158 -0.289 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.249 -5.571 -1.966 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.118 -2.601 -1.209 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.106 -3.434 -2.433 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.892 -2.611 -1.064 1.00 0.00 H new ATOM 1345 N GLU A 86 -3.631 -4.346 0.931 1.00 0.00 N ATOM 1346 CA GLU A 86 -4.763 -3.586 1.448 1.00 0.00 C ATOM 1347 C GLU A 86 -4.288 -2.429 2.322 1.00 0.00 C ATOM 1348 O GLU A 86 -3.346 -2.573 3.103 1.00 0.00 O ATOM 1349 CB GLU A 86 -5.694 -4.497 2.251 1.00 0.00 C ATOM 1350 CG GLU A 86 -6.561 -5.396 1.386 1.00 0.00 C ATOM 1351 CD GLU A 86 -5.747 -6.365 0.551 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -5.181 -7.316 1.130 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -5.674 -6.172 -0.681 1.00 0.00 O ATOM 0 H GLU A 86 -3.020 -4.734 1.650 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.311 -3.177 0.599 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.095 -5.117 2.918 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.337 -3.881 2.880 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.245 -5.957 2.023 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -7.173 -4.780 0.727 1.00 0.00 H new ATOM 1360 N ILE A 87 -4.945 -1.282 2.184 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.590 -0.101 2.960 1.00 0.00 C ATOM 1362 C ILE A 87 -5.746 0.336 3.854 1.00 0.00 C ATOM 1363 O ILE A 87 -6.909 0.285 3.454 1.00 0.00 O ATOM 1364 CB ILE A 87 -4.190 1.073 2.048 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.799 0.836 1.455 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -4.225 2.382 2.822 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -2.289 1.995 0.628 1.00 0.00 C ATOM 0 H ILE A 87 -5.726 -1.146 1.542 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.737 -0.375 3.580 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.907 1.138 1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -2.096 0.641 2.265 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.826 -0.059 0.834 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.940 3.202 2.163 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.233 2.554 3.200 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.528 2.329 3.658 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.299 1.757 0.240 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.971 2.177 -0.203 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -2.230 2.888 1.250 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.417 0.767 5.068 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.427 1.215 6.020 1.00 0.00 C ATOM 1381 C PHE A 88 -5.792 2.022 7.148 1.00 0.00 C ATOM 1382 O PHE A 88 -4.568 2.119 7.243 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.181 0.015 6.597 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.354 -0.818 7.535 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -6.005 -0.336 8.786 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -5.927 -2.083 7.165 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.244 -1.100 9.650 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.165 -2.851 8.025 1.00 0.00 C ATOM 1389 CZ PHE A 88 -4.825 -2.359 9.270 1.00 0.00 C ATOM 0 H PHE A 88 -4.459 0.815 5.415 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.131 1.857 5.490 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.066 0.371 7.124 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.530 -0.613 5.777 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.331 0.648 9.089 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.193 -2.473 6.194 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.977 -0.712 10.622 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.836 -3.835 7.724 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.232 -2.958 9.945 1.00 0.00 H new ATOM 1399 N SER A 89 -6.632 2.599 8.001 1.00 0.00 N ATOM 1400 CA SER A 89 -6.154 3.401 9.120 1.00 0.00 C ATOM 1401 C SER A 89 -6.613 2.808 10.449 1.00 0.00 C ATOM 1402 O SER A 89 -7.768 2.409 10.599 1.00 0.00 O ATOM 1403 CB SER A 89 -6.653 4.842 8.993 1.00 0.00 C ATOM 1404 OG SER A 89 -6.051 5.678 9.965 1.00 0.00 O ATOM 0 H SER A 89 -7.647 2.526 7.938 1.00 0.00 H new ATOM 0 HA SER A 89 -5.064 3.398 9.097 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.430 5.221 7.995 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.737 4.866 9.109 1.00 0.00 H new ATOM 0 HG SER A 89 -6.369 6.598 9.848 1.00 0.00 H new ATOM 1410 N THR A 90 -5.698 2.753 11.412 1.00 0.00 N ATOM 1411 CA THR A 90 -6.006 2.208 12.728 1.00 0.00 C ATOM 1412 C THR A 90 -7.062 3.048 13.438 1.00 0.00 C ATOM 1413 O THR A 90 -7.919 2.518 14.143 1.00 0.00 O ATOM 1414 CB THR A 90 -4.748 2.130 13.613 1.00 0.00 C ATOM 1415 OG1 THR A 90 -4.073 3.393 13.617 1.00 0.00 O ATOM 1416 CG2 THR A 90 -3.803 1.046 13.116 1.00 0.00 C ATOM 0 H THR A 90 -4.738 3.079 11.305 1.00 0.00 H new ATOM 0 HA THR A 90 -6.393 1.201 12.570 1.00 0.00 H new ATOM 0 HB THR A 90 -5.059 1.881 14.628 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.618 3.524 12.759 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.922 1.010 13.757 1.00 0.00 H new ATOM 0 HG22 THR A 90 -4.310 0.082 13.141 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.499 1.269 12.093 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.993 4.361 13.247 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.944 5.275 13.869 1.00 0.00 C ATOM 1426 C ASN A 91 -8.562 6.207 12.831 1.00 0.00 C ATOM 1427 O ASN A 91 -8.085 7.317 12.594 1.00 0.00 O ATOM 1428 CB ASN A 91 -7.254 6.096 14.961 1.00 0.00 C ATOM 1429 CG ASN A 91 -8.199 6.474 16.085 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -8.505 5.658 16.955 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -8.668 7.716 16.071 1.00 0.00 N ATOM 0 H ASN A 91 -6.289 4.816 12.667 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.740 4.681 14.318 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -6.420 5.525 15.368 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.836 7.002 14.521 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -9.309 8.027 16.801 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -8.387 8.359 15.330 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.651 5.747 12.197 1.00 0.00 N ATOM 1439 CA PRO A 92 -10.359 6.523 11.176 1.00 0.00 C ATOM 1440 C PRO A 92 -11.090 7.725 11.764 1.00 0.00 C ATOM 1441 O PRO A 92 -11.459 8.653 11.043 1.00 0.00 O ATOM 1442 CB PRO A 92 -11.360 5.519 10.598 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.581 4.532 11.692 1.00 0.00 C ATOM 1444 CD PRO A 92 -10.274 4.433 12.430 1.00 0.00 C ATOM 0 HA PRO A 92 -9.676 6.940 10.436 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.291 6.008 10.312 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.966 5.037 9.704 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.381 4.859 12.357 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.877 3.563 11.290 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.426 4.243 13.493 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.656 3.621 12.046 1.00 0.00 H new ATOM 1452 N ASP A 93 -11.294 7.703 13.076 1.00 0.00 N ATOM 1453 CA ASP A 93 -11.980 8.793 13.762 1.00 0.00 C ATOM 1454 C ASP A 93 -11.133 10.062 13.747 1.00 0.00 C ATOM 1455 O ASP A 93 -11.656 11.168 13.606 1.00 0.00 O ATOM 1456 CB ASP A 93 -12.300 8.395 15.203 1.00 0.00 C ATOM 1457 CG ASP A 93 -13.489 7.459 15.295 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -13.288 6.232 15.177 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -14.620 7.952 15.485 1.00 0.00 O ATOM 0 H ASP A 93 -10.994 6.943 13.687 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.912 8.994 13.234 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -11.428 7.914 15.646 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.501 9.292 15.788 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.824 9.895 13.894 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.904 11.027 13.899 1.00 0.00 C ATOM 1466 C LEU A 94 -8.415 11.338 12.487 1.00 0.00 C ATOM 1467 O LEU A 94 -8.519 12.472 12.019 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.711 10.737 14.811 1.00 0.00 C ATOM 1469 CG LEU A 94 -7.975 10.836 16.314 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -6.907 10.087 17.095 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -8.034 12.293 16.750 1.00 0.00 C ATOM 0 H LEU A 94 -9.375 8.987 14.011 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.440 11.897 14.278 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.347 9.733 14.592 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.908 11.429 14.557 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.940 10.375 16.525 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.112 10.169 18.162 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.913 9.037 16.804 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.929 10.518 16.879 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.223 12.345 17.822 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.085 12.779 16.525 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.837 12.800 16.216 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.885 10.323 11.814 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.381 10.487 10.456 1.00 0.00 C ATOM 1485 C TYR A 95 -8.001 9.458 9.516 1.00 0.00 C ATOM 1486 O TYR A 95 -7.387 8.450 9.165 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.857 10.359 10.437 1.00 0.00 C ATOM 1488 CG TYR A 95 -5.165 11.201 11.485 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -4.970 10.718 12.773 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.706 12.478 11.187 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -4.339 11.484 13.735 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -4.072 13.250 12.142 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.892 12.749 13.414 1.00 0.00 C ATOM 1494 OH TYR A 95 -3.262 13.514 14.369 1.00 0.00 O ATOM 0 H TYR A 95 -7.793 9.378 12.187 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.660 11.482 10.110 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.587 9.314 10.587 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.489 10.646 9.452 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.317 9.727 13.027 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.847 12.874 10.192 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -4.197 11.094 14.732 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.720 14.240 11.893 1.00 0.00 H new ATOM 0 HH TYR A 95 -3.008 14.378 13.981 1.00 0.00 H new ATOM 1504 N PRO A 96 -9.248 9.717 9.096 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.980 8.827 8.191 1.00 0.00 C ATOM 1506 C PRO A 96 -9.400 8.831 6.780 1.00 0.00 C ATOM 1507 O PRO A 96 -8.993 9.874 6.269 1.00 0.00 O ATOM 1508 CB PRO A 96 -11.396 9.409 8.188 1.00 0.00 C ATOM 1509 CG PRO A 96 -11.216 10.846 8.537 1.00 0.00 C ATOM 1510 CD PRO A 96 -10.040 10.900 9.474 1.00 0.00 C ATOM 0 HA PRO A 96 -9.933 7.788 8.516 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.869 9.295 7.213 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -12.034 8.903 8.913 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -11.032 11.444 7.645 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -12.112 11.248 9.011 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.470 11.821 9.351 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.355 10.857 10.517 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.366 7.658 6.156 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.837 7.527 4.803 1.00 0.00 C ATOM 1520 C VAL A 97 -9.841 8.027 3.770 1.00 0.00 C ATOM 1521 O VAL A 97 -11.048 7.833 3.917 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.472 6.066 4.483 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -7.827 5.965 3.109 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -7.555 5.498 5.555 1.00 0.00 C ATOM 0 H VAL A 97 -9.698 6.785 6.565 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.936 8.138 4.754 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.388 5.476 4.472 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.576 4.925 2.900 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.523 6.329 2.353 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.920 6.569 3.088 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.308 4.465 5.312 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.640 6.089 5.602 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.059 5.533 6.521 1.00 0.00 H new ATOM 1534 N ARG A 98 -9.333 8.672 2.725 1.00 0.00 N ATOM 1535 CA ARG A 98 -10.185 9.201 1.666 1.00 0.00 C ATOM 1536 C ARG A 98 -9.811 8.599 0.315 1.00 0.00 C ATOM 1537 O ARG A 98 -8.941 7.733 0.230 1.00 0.00 O ATOM 1538 CB ARG A 98 -10.073 10.725 1.607 1.00 0.00 C ATOM 1539 CG ARG A 98 -8.681 11.221 1.250 1.00 0.00 C ATOM 1540 CD ARG A 98 -8.504 12.689 1.605 1.00 0.00 C ATOM 1541 NE ARG A 98 -9.147 13.568 0.633 1.00 0.00 N ATOM 1542 CZ ARG A 98 -9.006 14.889 0.631 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -8.249 15.480 1.545 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -9.623 15.622 -0.287 1.00 0.00 N ATOM 0 H ARG A 98 -8.336 8.841 2.589 1.00 0.00 H new ATOM 0 HA ARG A 98 -11.216 8.928 1.892 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -10.784 11.105 0.873 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.360 11.139 2.573 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.935 10.626 1.777 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.506 11.080 0.183 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -8.922 12.876 2.594 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.441 12.923 1.658 1.00 0.00 H new ATOM 0 HE ARG A 98 -9.737 13.145 -0.084 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -7.773 14.920 2.252 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -8.143 16.494 1.541 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -10.206 15.171 -0.992 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -9.514 16.636 -0.288 1.00 0.00 H new ATOM 1558 N ARG A 99 -10.474 9.065 -0.738 1.00 0.00 N ATOM 1559 CA ARG A 99 -10.212 8.572 -2.085 1.00 0.00 C ATOM 1560 C ARG A 99 -9.352 9.560 -2.868 1.00 0.00 C ATOM 1561 O ARG A 99 -9.449 10.772 -2.673 1.00 0.00 O ATOM 1562 CB ARG A 99 -11.527 8.326 -2.826 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.380 8.307 -4.339 1.00 0.00 C ATOM 1564 CD ARG A 99 -12.428 7.417 -4.989 1.00 0.00 C ATOM 1565 NE ARG A 99 -13.756 8.025 -4.962 1.00 0.00 N ATOM 1566 CZ ARG A 99 -14.853 7.412 -5.392 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -14.782 6.181 -5.878 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -16.025 8.031 -5.334 1.00 0.00 N ATOM 0 H ARG A 99 -11.196 9.783 -0.685 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.669 7.631 -2.001 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -11.946 7.375 -2.498 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.241 9.101 -2.549 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.471 9.321 -4.727 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -10.384 7.952 -4.605 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -12.143 7.216 -6.021 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -12.458 6.457 -4.474 1.00 0.00 H new ATOM 0 HE ARG A 99 -13.846 8.972 -4.593 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -13.883 5.701 -5.923 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -15.626 5.713 -6.207 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -16.084 8.978 -4.959 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -16.867 7.560 -5.664 1.00 0.00 H new ATOM 1582 N ILE A 100 -8.513 9.034 -3.754 1.00 0.00 N ATOM 1583 CA ILE A 100 -7.637 9.870 -4.566 1.00 0.00 C ATOM 1584 C ILE A 100 -8.018 9.795 -6.040 1.00 0.00 C ATOM 1585 O ILE A 100 -8.284 8.715 -6.569 1.00 0.00 O ATOM 1586 CB ILE A 100 -6.161 9.460 -4.407 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -5.715 9.633 -2.954 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -5.281 10.279 -5.338 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.375 8.998 -2.654 1.00 0.00 C ATOM 0 H ILE A 100 -8.421 8.033 -3.928 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.761 10.894 -4.213 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.060 8.408 -4.675 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.664 10.697 -2.722 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -6.469 9.199 -2.297 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -4.241 9.978 -5.214 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.587 10.110 -6.370 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.383 11.337 -5.098 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.122 9.160 -1.606 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.427 7.928 -2.854 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.609 9.448 -3.286 1.00 0.00 H new ATOM 1601 N ASP A 101 -8.041 10.948 -6.699 1.00 0.00 N ATOM 1602 CA ASP A 101 -8.387 11.013 -8.114 1.00 0.00 C ATOM 1603 C ASP A 101 -7.145 10.853 -8.985 1.00 0.00 C ATOM 1604 O ASP A 101 -6.018 10.908 -8.493 1.00 0.00 O ATOM 1605 CB ASP A 101 -9.079 12.340 -8.432 1.00 0.00 C ATOM 1606 CG ASP A 101 -8.301 13.536 -7.920 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -7.144 13.721 -8.353 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -8.849 14.287 -7.087 1.00 0.00 O ATOM 0 H ASP A 101 -7.824 11.850 -6.276 1.00 0.00 H new ATOM 0 HA ASP A 101 -9.071 10.193 -8.333 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -9.209 12.429 -9.511 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -10.075 12.342 -7.990 1.00 0.00 H new ATOM 1613 N GLY A 102 -7.359 10.653 -10.282 1.00 0.00 N ATOM 1614 CA GLY A 102 -6.247 10.486 -11.200 1.00 0.00 C ATOM 1615 C GLY A 102 -6.254 11.517 -12.312 1.00 0.00 C ATOM 1616 O GLY A 102 -7.304 12.055 -12.664 1.00 0.00 O ATOM 0 H GLY A 102 -8.282 10.604 -10.713 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.310 10.558 -10.648 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.285 9.487 -11.634 1.00 0.00 H new ATOM 1620 N LEU A 103 -5.078 11.795 -12.865 1.00 0.00 N ATOM 1621 CA LEU A 103 -4.952 12.771 -13.942 1.00 0.00 C ATOM 1622 C LEU A 103 -5.781 12.356 -15.153 1.00 0.00 C ATOM 1623 O LEU A 103 -5.996 13.145 -16.073 1.00 0.00 O ATOM 1624 CB LEU A 103 -3.484 12.927 -14.345 1.00 0.00 C ATOM 1625 CG LEU A 103 -2.989 11.997 -15.452 1.00 0.00 C ATOM 1626 CD1 LEU A 103 -3.430 10.566 -15.184 1.00 0.00 C ATOM 1627 CD2 LEU A 103 -3.492 12.467 -16.809 1.00 0.00 C ATOM 0 H LEU A 103 -4.199 11.359 -12.586 1.00 0.00 H new ATOM 0 HA LEU A 103 -5.327 13.727 -13.578 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -3.323 13.957 -14.664 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.867 12.767 -13.461 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.899 12.024 -15.462 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -3.068 9.918 -15.983 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -3.020 10.231 -14.231 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -4.518 10.522 -15.146 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.130 11.793 -17.585 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.582 12.471 -16.812 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.125 13.475 -17.004 1.00 0.00 H new ATOM 1639 N THR A 104 -6.248 11.111 -15.145 1.00 0.00 N ATOM 1640 CA THR A 104 -7.056 10.591 -16.242 1.00 0.00 C ATOM 1641 C THR A 104 -8.376 11.343 -16.357 1.00 0.00 C ATOM 1642 O THR A 104 -8.798 11.712 -17.453 1.00 0.00 O ATOM 1643 CB THR A 104 -7.347 9.089 -16.061 1.00 0.00 C ATOM 1644 OG1 THR A 104 -6.119 8.353 -16.018 1.00 0.00 O ATOM 1645 CG2 THR A 104 -8.218 8.567 -17.194 1.00 0.00 C ATOM 0 H THR A 104 -6.081 10.444 -14.391 1.00 0.00 H new ATOM 0 HA THR A 104 -6.479 10.735 -17.156 1.00 0.00 H new ATOM 0 HB THR A 104 -7.882 8.956 -15.121 1.00 0.00 H new ATOM 0 HG1 THR A 104 -6.313 7.400 -15.901 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.410 7.504 -17.045 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.164 9.109 -17.205 1.00 0.00 H new ATOM 0 HG23 THR A 104 -7.705 8.713 -18.144 1.00 0.00 H new ATOM 1653 N ASP A 105 -9.025 11.567 -15.220 1.00 0.00 N ATOM 1654 CA ASP A 105 -10.298 12.278 -15.193 1.00 0.00 C ATOM 1655 C ASP A 105 -10.085 13.767 -14.938 1.00 0.00 C ATOM 1656 O ASP A 105 -9.348 14.152 -14.030 1.00 0.00 O ATOM 1657 CB ASP A 105 -11.212 11.690 -14.117 1.00 0.00 C ATOM 1658 CG ASP A 105 -12.649 12.151 -14.262 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -12.906 13.360 -14.077 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -13.517 11.305 -14.561 1.00 0.00 O ATOM 0 H ASP A 105 -8.691 11.266 -14.304 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.772 12.159 -16.167 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.176 10.602 -14.169 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -10.840 11.975 -13.133 1.00 0.00 H new ATOM 1665 N VAL A 106 -10.733 14.599 -15.747 1.00 0.00 N ATOM 1666 CA VAL A 106 -10.614 16.046 -15.609 1.00 0.00 C ATOM 1667 C VAL A 106 -11.721 16.607 -14.724 1.00 0.00 C ATOM 1668 O VAL A 106 -12.886 16.233 -14.858 1.00 0.00 O ATOM 1669 CB VAL A 106 -10.664 16.746 -16.980 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -12.011 16.517 -17.649 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -10.380 18.233 -16.830 1.00 0.00 C ATOM 0 H VAL A 106 -11.345 14.296 -16.504 1.00 0.00 H new ATOM 0 HA VAL A 106 -9.648 16.241 -15.144 1.00 0.00 H new ATOM 0 HB VAL A 106 -9.892 16.314 -17.616 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -12.027 17.019 -18.616 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -12.169 15.448 -17.792 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -12.804 16.919 -17.018 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -10.419 18.711 -17.809 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -11.128 18.682 -16.176 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -9.389 18.372 -16.398 1.00 0.00 H new ATOM 1681 N SER A 107 -11.349 17.507 -13.819 1.00 0.00 N ATOM 1682 CA SER A 107 -12.311 18.117 -12.909 1.00 0.00 C ATOM 1683 C SER A 107 -12.193 19.638 -12.935 1.00 0.00 C ATOM 1684 O SER A 107 -11.381 20.220 -12.216 1.00 0.00 O ATOM 1685 CB SER A 107 -12.095 17.602 -11.485 1.00 0.00 C ATOM 1686 OG SER A 107 -12.695 16.331 -11.306 1.00 0.00 O ATOM 0 H SER A 107 -10.389 17.829 -13.697 1.00 0.00 H new ATOM 0 HA SER A 107 -13.312 17.841 -13.239 1.00 0.00 H new ATOM 0 HB2 SER A 107 -11.027 17.536 -11.277 1.00 0.00 H new ATOM 0 HB3 SER A 107 -12.516 18.310 -10.771 1.00 0.00 H new ATOM 0 HG SER A 107 -12.541 16.023 -10.388 1.00 0.00 H new ATOM 1692 N GLN A 108 -13.009 20.275 -13.768 1.00 0.00 N ATOM 1693 CA GLN A 108 -12.996 21.728 -13.889 1.00 0.00 C ATOM 1694 C GLN A 108 -14.225 22.340 -13.224 1.00 0.00 C ATOM 1695 O GLN A 108 -14.121 23.327 -12.494 1.00 0.00 O ATOM 1696 CB GLN A 108 -12.941 22.138 -15.361 1.00 0.00 C ATOM 1697 CG GLN A 108 -13.054 23.638 -15.580 1.00 0.00 C ATOM 1698 CD GLN A 108 -11.731 24.356 -15.396 1.00 0.00 C ATOM 1699 OE1 GLN A 108 -10.728 24.002 -16.016 1.00 0.00 O ATOM 1700 NE2 GLN A 108 -11.722 25.372 -14.540 1.00 0.00 N ATOM 0 H GLN A 108 -13.688 19.808 -14.369 1.00 0.00 H new ATOM 0 HA GLN A 108 -12.106 22.102 -13.382 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -12.004 21.786 -15.793 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -13.747 21.639 -15.899 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -13.429 23.827 -16.586 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -13.786 24.049 -14.884 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -12.577 25.631 -14.047 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -10.860 25.893 -14.375 1.00 0.00 H new ATOM 1709 N ILE A 109 -15.387 21.750 -13.482 1.00 0.00 N ATOM 1710 CA ILE A 109 -16.635 22.237 -12.908 1.00 0.00 C ATOM 1711 C ILE A 109 -17.446 21.095 -12.305 1.00 0.00 C ATOM 1712 O ILE A 109 -18.327 20.535 -12.957 1.00 0.00 O ATOM 1713 CB ILE A 109 -17.494 22.962 -13.961 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -18.811 23.433 -13.340 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -17.759 22.048 -15.148 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -18.722 24.801 -12.702 1.00 0.00 C ATOM 0 H ILE A 109 -15.490 20.934 -14.085 1.00 0.00 H new ATOM 0 HA ILE A 109 -16.366 22.943 -12.122 1.00 0.00 H new ATOM 0 HB ILE A 109 -16.948 23.836 -14.315 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -19.581 23.450 -14.111 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -19.128 22.710 -12.588 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -18.367 22.574 -15.884 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -16.812 21.757 -15.602 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -18.288 21.157 -14.810 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -19.691 25.071 -12.282 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -17.975 24.784 -11.908 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -18.436 25.536 -13.455 1.00 0.00 H new ATOM 1728 N ILE A 110 -17.142 20.757 -11.056 1.00 0.00 N ATOM 1729 CA ILE A 110 -17.845 19.683 -10.364 1.00 0.00 C ATOM 1730 C ILE A 110 -17.855 19.915 -8.857 1.00 0.00 C ATOM 1731 O ILE A 110 -16.864 20.366 -8.280 1.00 0.00 O ATOM 1732 CB ILE A 110 -17.208 18.312 -10.657 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -18.081 17.189 -10.095 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -15.805 18.244 -10.073 1.00 0.00 C ATOM 1735 CD1 ILE A 110 -19.358 16.968 -10.874 1.00 0.00 C ATOM 0 H ILE A 110 -16.415 21.211 -10.503 1.00 0.00 H new ATOM 0 HA ILE A 110 -18.869 19.685 -10.737 1.00 0.00 H new ATOM 0 HB ILE A 110 -17.137 18.184 -11.737 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -17.506 16.263 -10.086 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -18.332 17.419 -9.059 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -15.368 17.269 -10.288 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -15.188 19.025 -10.518 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -15.853 18.390 -8.994 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.926 16.157 -10.418 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -19.954 17.880 -10.862 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -19.115 16.707 -11.904 1.00 0.00 H new ATOM 1747 N THR A 111 -18.980 19.601 -8.222 1.00 0.00 N ATOM 1748 CA THR A 111 -19.119 19.774 -6.782 1.00 0.00 C ATOM 1749 C THR A 111 -18.600 18.554 -6.029 1.00 0.00 C ATOM 1750 O THR A 111 -19.152 17.460 -6.145 1.00 0.00 O ATOM 1751 CB THR A 111 -20.586 20.022 -6.385 1.00 0.00 C ATOM 1752 OG1 THR A 111 -21.400 18.922 -6.804 1.00 0.00 O ATOM 1753 CG2 THR A 111 -21.105 21.310 -7.008 1.00 0.00 C ATOM 0 H THR A 111 -19.809 19.225 -8.683 1.00 0.00 H new ATOM 0 HA THR A 111 -18.524 20.646 -6.510 1.00 0.00 H new ATOM 0 HB THR A 111 -20.634 20.116 -5.300 1.00 0.00 H new ATOM 0 HG1 THR A 111 -20.884 18.091 -6.744 1.00 0.00 H new ATOM 0 HG21 THR A 111 -22.143 21.464 -6.713 1.00 0.00 H new ATOM 0 HG22 THR A 111 -20.502 22.150 -6.663 1.00 0.00 H new ATOM 0 HG23 THR A 111 -21.043 21.240 -8.094 1.00 0.00 H new ATOM 1761 N VAL A 112 -17.536 18.749 -5.257 1.00 0.00 N ATOM 1762 CA VAL A 112 -16.944 17.664 -4.483 1.00 0.00 C ATOM 1763 C VAL A 112 -17.423 17.696 -3.036 1.00 0.00 C ATOM 1764 O VAL A 112 -17.593 18.765 -2.451 1.00 0.00 O ATOM 1765 CB VAL A 112 -15.406 17.734 -4.504 1.00 0.00 C ATOM 1766 CG1 VAL A 112 -14.922 19.041 -3.894 1.00 0.00 C ATOM 1767 CG2 VAL A 112 -14.808 16.542 -3.773 1.00 0.00 C ATOM 0 H VAL A 112 -17.066 19.648 -5.151 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.265 16.732 -4.948 1.00 0.00 H new ATOM 0 HB VAL A 112 -15.073 17.699 -5.541 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -13.833 19.072 -3.918 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -15.322 19.879 -4.465 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -15.265 19.109 -2.861 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -13.720 16.608 -3.798 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.148 16.542 -2.737 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -15.127 15.620 -4.259 1.00 0.00 H new ATOM 1777 N SER A 113 -17.640 16.515 -2.465 1.00 0.00 N ATOM 1778 CA SER A 113 -18.104 16.407 -1.086 1.00 0.00 C ATOM 1779 C SER A 113 -17.502 17.512 -0.223 1.00 0.00 C ATOM 1780 O SER A 113 -16.324 17.843 -0.350 1.00 0.00 O ATOM 1781 CB SER A 113 -17.740 15.038 -0.509 1.00 0.00 C ATOM 1782 OG SER A 113 -18.268 14.878 0.796 1.00 0.00 O ATOM 0 H SER A 113 -17.502 15.620 -2.935 1.00 0.00 H new ATOM 0 HA SER A 113 -19.188 16.517 -1.083 1.00 0.00 H new ATOM 0 HB2 SER A 113 -18.124 14.252 -1.159 1.00 0.00 H new ATOM 0 HB3 SER A 113 -16.656 14.928 -0.482 1.00 0.00 H new ATOM 0 HG SER A 113 -18.023 13.994 1.142 1.00 0.00 H new ATOM 1788 N GLY A 114 -18.321 18.079 0.658 1.00 0.00 N ATOM 1789 CA GLY A 114 -17.853 19.140 1.530 1.00 0.00 C ATOM 1790 C GLY A 114 -17.710 18.687 2.969 1.00 0.00 C ATOM 1791 O GLY A 114 -18.496 19.060 3.841 1.00 0.00 O ATOM 0 H GLY A 114 -19.300 17.822 0.783 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -16.891 19.504 1.170 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -18.549 19.978 1.484 1.00 0.00 H new ATOM 1795 N PRO A 115 -16.687 17.861 3.235 1.00 0.00 N ATOM 1796 CA PRO A 115 -16.421 17.337 4.578 1.00 0.00 C ATOM 1797 C PRO A 115 -15.925 18.417 5.533 1.00 0.00 C ATOM 1798 O PRO A 115 -15.875 18.212 6.746 1.00 0.00 O ATOM 1799 CB PRO A 115 -15.329 16.291 4.340 1.00 0.00 C ATOM 1800 CG PRO A 115 -14.649 16.730 3.090 1.00 0.00 C ATOM 1801 CD PRO A 115 -15.712 17.375 2.244 1.00 0.00 C ATOM 0 HA PRO A 115 -17.320 16.936 5.045 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -14.631 16.250 5.176 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -15.754 15.293 4.230 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -13.845 17.433 3.309 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -14.199 15.883 2.572 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -15.308 18.190 1.644 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -16.162 16.663 1.552 1.00 0.00 H new ATOM 1809 N SER A 116 -15.559 19.569 4.979 1.00 0.00 N ATOM 1810 CA SER A 116 -15.063 20.680 5.782 1.00 0.00 C ATOM 1811 C SER A 116 -13.874 20.247 6.634 1.00 0.00 C ATOM 1812 O SER A 116 -13.835 20.500 7.838 1.00 0.00 O ATOM 1813 CB SER A 116 -16.176 21.226 6.679 1.00 0.00 C ATOM 1814 OG SER A 116 -15.946 22.584 7.008 1.00 0.00 O ATOM 0 H SER A 116 -15.597 19.757 3.977 1.00 0.00 H new ATOM 0 HA SER A 116 -14.734 21.467 5.104 1.00 0.00 H new ATOM 0 HB2 SER A 116 -17.136 21.129 6.172 1.00 0.00 H new ATOM 0 HB3 SER A 116 -16.236 20.633 7.591 1.00 0.00 H new ATOM 0 HG SER A 116 -16.672 22.909 7.580 1.00 0.00 H new ATOM 1820 N SER A 117 -12.907 19.592 6.000 1.00 0.00 N ATOM 1821 CA SER A 117 -11.718 19.120 6.700 1.00 0.00 C ATOM 1822 C SER A 117 -10.565 20.106 6.540 1.00 0.00 C ATOM 1823 O SER A 117 -10.226 20.507 5.427 1.00 0.00 O ATOM 1824 CB SER A 117 -11.303 17.744 6.173 1.00 0.00 C ATOM 1825 OG SER A 117 -9.929 17.498 6.415 1.00 0.00 O ATOM 0 H SER A 117 -12.923 19.376 5.003 1.00 0.00 H new ATOM 0 HA SER A 117 -11.959 19.039 7.760 1.00 0.00 H new ATOM 0 HB2 SER A 117 -11.904 16.971 6.652 1.00 0.00 H new ATOM 0 HB3 SER A 117 -11.503 17.685 5.103 1.00 0.00 H new ATOM 0 HG SER A 117 -9.690 16.612 6.070 1.00 0.00 H new ATOM 1831 N GLY A 118 -9.966 20.494 7.662 1.00 0.00 N ATOM 1832 CA GLY A 118 -8.858 21.430 7.626 1.00 0.00 C ATOM 1833 C GLY A 118 -7.511 20.736 7.666 1.00 0.00 C ATOM 1834 O GLY A 118 -7.008 20.403 8.739 1.00 0.00 O ATOM 0 H GLY A 118 -10.229 20.177 8.595 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -8.926 22.033 6.721 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -8.936 22.114 8.471 1.00 0.00 H new TER 1838 GLY A 118