USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 751 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 2 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -127:sc= 0.0629 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0.0837 K(o=0.084,f=-8.1!) USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= -0.301 K(o=-0.3,f=-2.6!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc=-0.00819 X(o=-0.0082,f=-0.036) USER MOD Single : A 14 HIS : no HD1:sc= -0.0713 X(o=-0.071,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 163:sc= -0.0138 (180deg=-0.209) USER MOD Single : A 16 GLN : amide:sc=-0.00736 X(o=-0.0074,f=0) USER MOD Single : A 19 GLN : amide:sc= -0.0118 X(o=-0.012,f=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -0.341 X(o=-0.34,f=-0.07) USER MOD Single : A 29 GLN : amide:sc= -0.0198 X(o=-0.02,f=-0.15) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -89:sc= 0.691 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 35 ASN : amide:sc= -3.84! C(o=-3.8!,f=-7.2!) USER MOD Single : A 42 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.239) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -0.559 K(o=-0.56,f=-1.3) USER MOD Single : A 50 THR OG1 : rot -86:sc= 1.3! USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.265 K(o=-0.27,f=-5!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 57 CYS SG : rot 119:sc= -1.19 USER MOD Single : A 62 HIS : no HD1:sc= -1.09 K(o=-1.1,f=-0.26) USER MOD Single : A 64 CYS SG : rot 157:sc= -2.77 USER MOD Single : A 65 ASN : amide:sc= -1.15! C(o=-1.2!,f=-1.3!) USER MOD Single : A 69 ASN : amide:sc= -0.139 X(o=-0.14,f=-0.035) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= -0.0837 X(o=-0.084,f=-0.5) USER MOD Single : A 82 THR OG1 : rot 18:sc= 0.272 USER MOD Single : A 83 HIS : no HD1:sc= -0.292 K(o=-0.29,f=-1.3) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -120:sc= -0.38 (180deg=-0.993) USER MOD Single : A 95 SER OG : rot 46:sc= 0.543 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.057 23.505 -19.802 1.00 0.00 N ATOM 2 CA GLY A 1 -14.412 22.466 -18.850 1.00 0.00 C ATOM 3 C GLY A 1 -15.867 22.031 -19.031 1.00 0.00 C ATOM 4 O GLY A 1 -16.438 22.192 -20.109 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.199 23.224 -20.319 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.838 23.640 -20.475 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.880 24.395 -19.294 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.753 21.608 -18.981 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.262 22.832 -17.834 1.00 0.00 H new ATOM 8 N SER A 2 -16.426 21.487 -17.960 1.00 0.00 N ATOM 9 CA SER A 2 -17.804 21.027 -17.987 1.00 0.00 C ATOM 10 C SER A 2 -18.733 22.125 -17.465 1.00 0.00 C ATOM 11 O SER A 2 -19.639 22.565 -18.172 1.00 0.00 O ATOM 12 CB SER A 2 -17.975 19.750 -17.162 1.00 0.00 C ATOM 13 OG SER A 2 -19.295 19.222 -17.262 1.00 0.00 O ATOM 0 H SER A 2 -15.950 21.354 -17.068 1.00 0.00 H new ATOM 0 HA SER A 2 -18.068 20.798 -19.020 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.259 19.001 -17.500 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.747 19.960 -16.117 1.00 0.00 H new ATOM 0 HG SER A 2 -19.363 18.407 -16.723 1.00 0.00 H new ATOM 19 N SER A 3 -18.476 22.536 -16.232 1.00 0.00 N ATOM 20 CA SER A 3 -19.278 23.574 -15.607 1.00 0.00 C ATOM 21 C SER A 3 -20.744 23.142 -15.552 1.00 0.00 C ATOM 22 O SER A 3 -21.404 23.040 -16.585 1.00 0.00 O ATOM 23 CB SER A 3 -19.144 24.901 -16.358 1.00 0.00 C ATOM 24 OG SER A 3 -18.170 25.755 -15.763 1.00 0.00 O ATOM 0 H SER A 3 -17.724 22.169 -15.649 1.00 0.00 H new ATOM 0 HA SER A 3 -18.912 23.723 -14.591 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.870 24.705 -17.394 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.109 25.408 -16.374 1.00 0.00 H new ATOM 0 HG SER A 3 -18.113 26.591 -16.272 1.00 0.00 H new ATOM 30 N GLY A 4 -21.211 22.898 -14.336 1.00 0.00 N ATOM 31 CA GLY A 4 -22.588 22.479 -14.133 1.00 0.00 C ATOM 32 C GLY A 4 -22.790 21.029 -14.579 1.00 0.00 C ATOM 33 O GLY A 4 -21.862 20.224 -14.524 1.00 0.00 O ATOM 0 H GLY A 4 -20.660 22.982 -13.481 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -22.851 22.580 -13.080 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -23.257 23.132 -14.693 1.00 0.00 H new ATOM 37 N SER A 5 -24.010 20.741 -15.010 1.00 0.00 N ATOM 38 CA SER A 5 -24.346 19.403 -15.465 1.00 0.00 C ATOM 39 C SER A 5 -23.249 18.873 -16.390 1.00 0.00 C ATOM 40 O SER A 5 -22.416 19.639 -16.873 1.00 0.00 O ATOM 41 CB SER A 5 -25.698 19.388 -16.181 1.00 0.00 C ATOM 42 OG SER A 5 -25.732 20.301 -17.275 1.00 0.00 O ATOM 0 H SER A 5 -24.777 21.412 -15.053 1.00 0.00 H new ATOM 0 HA SER A 5 -24.420 18.754 -14.592 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.906 18.381 -16.542 1.00 0.00 H new ATOM 0 HB3 SER A 5 -26.487 19.641 -15.472 1.00 0.00 H new ATOM 0 HG SER A 5 -26.611 20.261 -17.707 1.00 0.00 H new ATOM 48 N SER A 6 -23.284 17.567 -16.610 1.00 0.00 N ATOM 49 CA SER A 6 -22.302 16.927 -17.469 1.00 0.00 C ATOM 50 C SER A 6 -22.968 16.458 -18.765 1.00 0.00 C ATOM 51 O SER A 6 -24.192 16.485 -18.883 1.00 0.00 O ATOM 52 CB SER A 6 -21.635 15.747 -16.759 1.00 0.00 C ATOM 53 OG SER A 6 -20.845 16.169 -15.651 1.00 0.00 O ATOM 0 H SER A 6 -23.977 16.935 -16.209 1.00 0.00 H new ATOM 0 HA SER A 6 -21.529 17.657 -17.708 1.00 0.00 H new ATOM 0 HB2 SER A 6 -22.400 15.051 -16.415 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.007 15.206 -17.467 1.00 0.00 H new ATOM 0 HG SER A 6 -20.437 15.387 -15.223 1.00 0.00 H new ATOM 59 N GLY A 7 -22.132 16.041 -19.704 1.00 0.00 N ATOM 60 CA GLY A 7 -22.624 15.567 -20.987 1.00 0.00 C ATOM 61 C GLY A 7 -21.542 14.786 -21.734 1.00 0.00 C ATOM 62 O GLY A 7 -21.611 13.562 -21.833 1.00 0.00 O ATOM 0 H GLY A 7 -21.117 16.021 -19.602 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.496 14.931 -20.834 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.949 16.414 -21.591 1.00 0.00 H new ATOM 66 N ASN A 8 -20.566 15.525 -22.242 1.00 0.00 N ATOM 67 CA ASN A 8 -19.471 14.917 -22.978 1.00 0.00 C ATOM 68 C ASN A 8 -18.459 14.336 -21.989 1.00 0.00 C ATOM 69 O ASN A 8 -18.687 14.352 -20.780 1.00 0.00 O ATOM 70 CB ASN A 8 -18.747 15.951 -23.842 1.00 0.00 C ATOM 71 CG ASN A 8 -18.140 17.059 -22.980 1.00 0.00 C ATOM 72 OD1 ASN A 8 -17.260 16.835 -22.165 1.00 0.00 O ATOM 73 ND2 ASN A 8 -18.658 18.263 -23.203 1.00 0.00 N ATOM 0 H ASN A 8 -20.511 16.540 -22.158 1.00 0.00 H new ATOM 0 HA ASN A 8 -19.886 14.139 -23.619 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -17.961 15.462 -24.418 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -19.445 16.384 -24.558 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -18.320 19.069 -22.677 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -19.393 18.381 -23.900 1.00 0.00 H new ATOM 80 N GLN A 9 -17.362 13.836 -22.539 1.00 0.00 N ATOM 81 CA GLN A 9 -16.314 13.251 -21.720 1.00 0.00 C ATOM 82 C GLN A 9 -14.967 13.906 -22.033 1.00 0.00 C ATOM 83 O GLN A 9 -13.982 13.216 -22.291 1.00 0.00 O ATOM 84 CB GLN A 9 -16.245 11.736 -21.918 1.00 0.00 C ATOM 85 CG GLN A 9 -16.171 11.379 -23.404 1.00 0.00 C ATOM 86 CD GLN A 9 -16.021 9.869 -23.599 1.00 0.00 C ATOM 87 OE1 GLN A 9 -16.153 9.082 -22.676 1.00 0.00 O ATOM 88 NE2 GLN A 9 -15.738 9.511 -24.848 1.00 0.00 N ATOM 0 H GLN A 9 -17.176 13.824 -23.542 1.00 0.00 H new ATOM 0 HA GLN A 9 -16.552 13.438 -20.673 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -15.372 11.338 -21.401 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -17.122 11.267 -21.471 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -17.071 11.727 -23.910 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -15.328 11.894 -23.864 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -15.641 10.222 -25.573 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -15.618 8.525 -25.081 1.00 0.00 H new ATOM 97 N ASN A 10 -14.968 15.231 -22.000 1.00 0.00 N ATOM 98 CA ASN A 10 -13.758 15.987 -22.278 1.00 0.00 C ATOM 99 C ASN A 10 -13.377 15.809 -23.749 1.00 0.00 C ATOM 100 O ASN A 10 -13.731 14.807 -24.369 1.00 0.00 O ATOM 101 CB ASN A 10 -12.590 15.491 -21.423 1.00 0.00 C ATOM 102 CG ASN A 10 -12.171 16.549 -20.400 1.00 0.00 C ATOM 103 OD1 ASN A 10 -12.405 16.425 -19.209 1.00 0.00 O ATOM 104 ND2 ASN A 10 -11.542 17.594 -20.930 1.00 0.00 N ATOM 0 H ASN A 10 -15.787 15.800 -21.785 1.00 0.00 H new ATOM 0 HA ASN A 10 -13.954 17.034 -22.047 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -12.876 14.574 -20.907 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -11.744 15.245 -22.065 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -11.223 18.355 -20.330 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -11.378 17.634 -21.936 1.00 0.00 H new ATOM 111 N GLN A 11 -12.658 16.795 -24.264 1.00 0.00 N ATOM 112 CA GLN A 11 -12.225 16.760 -25.651 1.00 0.00 C ATOM 113 C GLN A 11 -10.730 16.445 -25.731 1.00 0.00 C ATOM 114 O GLN A 11 -10.334 15.443 -26.325 1.00 0.00 O ATOM 115 CB GLN A 11 -12.547 18.077 -26.360 1.00 0.00 C ATOM 116 CG GLN A 11 -13.383 17.832 -27.617 1.00 0.00 C ATOM 117 CD GLN A 11 -12.830 18.621 -28.806 1.00 0.00 C ATOM 118 OE1 GLN A 11 -11.712 19.109 -28.794 1.00 0.00 O ATOM 119 NE2 GLN A 11 -13.672 18.718 -29.830 1.00 0.00 N ATOM 0 H GLN A 11 -12.364 17.623 -23.746 1.00 0.00 H new ATOM 0 HA GLN A 11 -12.772 15.968 -26.163 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -13.088 18.737 -25.682 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -11.621 18.586 -26.628 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -13.388 16.768 -27.853 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -14.417 18.123 -27.433 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -14.594 18.286 -29.775 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -13.396 19.225 -30.671 1.00 0.00 H new ATOM 128 N THR A 12 -9.940 17.319 -25.125 1.00 0.00 N ATOM 129 CA THR A 12 -8.497 17.147 -25.121 1.00 0.00 C ATOM 130 C THR A 12 -8.117 15.847 -24.410 1.00 0.00 C ATOM 131 O THR A 12 -7.572 14.934 -25.027 1.00 0.00 O ATOM 132 CB THR A 12 -7.874 18.392 -24.486 1.00 0.00 C ATOM 133 OG1 THR A 12 -8.077 19.416 -25.456 1.00 0.00 O ATOM 134 CG2 THR A 12 -6.352 18.289 -24.365 1.00 0.00 C ATOM 0 H THR A 12 -10.272 18.149 -24.633 1.00 0.00 H new ATOM 0 HA THR A 12 -8.107 17.052 -26.134 1.00 0.00 H new ATOM 0 HB THR A 12 -8.306 18.550 -23.498 1.00 0.00 H new ATOM 0 HG1 THR A 12 -7.704 20.259 -25.124 1.00 0.00 H new ATOM 0 HG21 THR A 12 -5.961 19.198 -23.908 1.00 0.00 H new ATOM 0 HG22 THR A 12 -6.094 17.431 -23.744 1.00 0.00 H new ATOM 0 HG23 THR A 12 -5.916 18.164 -25.356 1.00 0.00 H new ATOM 142 N GLN A 13 -8.421 15.805 -23.121 1.00 0.00 N ATOM 143 CA GLN A 13 -8.118 14.632 -22.319 1.00 0.00 C ATOM 144 C GLN A 13 -6.604 14.453 -22.189 1.00 0.00 C ATOM 145 O GLN A 13 -5.882 14.510 -23.183 1.00 0.00 O ATOM 146 CB GLN A 13 -8.769 13.380 -22.910 1.00 0.00 C ATOM 147 CG GLN A 13 -9.895 12.869 -22.009 1.00 0.00 C ATOM 148 CD GLN A 13 -9.390 11.772 -21.069 1.00 0.00 C ATOM 149 OE1 GLN A 13 -8.594 12.004 -20.174 1.00 0.00 O ATOM 150 NE2 GLN A 13 -9.895 10.568 -21.322 1.00 0.00 N ATOM 0 H GLN A 13 -8.874 16.564 -22.612 1.00 0.00 H new ATOM 0 HA GLN A 13 -8.533 14.782 -21.322 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -9.165 13.605 -23.900 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -8.018 12.600 -23.036 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -10.301 13.695 -21.425 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -10.709 12.481 -22.622 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -10.558 10.443 -22.087 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -9.620 9.769 -20.751 1.00 0.00 H new ATOM 159 N HIS A 14 -6.168 14.242 -20.956 1.00 0.00 N ATOM 160 CA HIS A 14 -4.753 14.055 -20.684 1.00 0.00 C ATOM 161 C HIS A 14 -4.497 12.604 -20.270 1.00 0.00 C ATOM 162 O HIS A 14 -5.401 11.924 -19.787 1.00 0.00 O ATOM 163 CB HIS A 14 -4.262 15.063 -19.644 1.00 0.00 C ATOM 164 CG HIS A 14 -4.599 16.498 -19.973 1.00 0.00 C ATOM 165 ND1 HIS A 14 -3.663 17.397 -20.453 1.00 0.00 N ATOM 166 CD2 HIS A 14 -5.778 17.179 -19.886 1.00 0.00 C ATOM 167 CE1 HIS A 14 -4.262 18.564 -20.643 1.00 0.00 C ATOM 168 NE2 HIS A 14 -5.573 18.427 -20.290 1.00 0.00 N ATOM 0 H HIS A 14 -6.770 14.196 -20.134 1.00 0.00 H new ATOM 0 HA HIS A 14 -4.177 14.245 -21.590 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -4.696 14.811 -18.676 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -3.181 14.968 -19.543 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -6.719 16.772 -19.546 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -3.795 19.465 -21.012 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -6.279 19.162 -20.330 1.00 0.00 H new ATOM 176 N LYS A 15 -3.262 12.173 -20.476 1.00 0.00 N ATOM 177 CA LYS A 15 -2.875 10.816 -20.130 1.00 0.00 C ATOM 178 C LYS A 15 -2.823 10.677 -18.607 1.00 0.00 C ATOM 179 O LYS A 15 -3.581 9.903 -18.024 1.00 0.00 O ATOM 180 CB LYS A 15 -1.567 10.437 -20.828 1.00 0.00 C ATOM 181 CG LYS A 15 -1.840 9.719 -22.151 1.00 0.00 C ATOM 182 CD LYS A 15 -1.077 10.380 -23.301 1.00 0.00 C ATOM 183 CE LYS A 15 -1.580 9.876 -24.655 1.00 0.00 C ATOM 184 NZ LYS A 15 -2.923 10.427 -24.946 1.00 0.00 N ATOM 0 H LYS A 15 -2.516 12.740 -20.878 1.00 0.00 H new ATOM 0 HA LYS A 15 -3.618 10.105 -20.490 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -0.976 11.334 -21.012 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -0.976 9.794 -20.176 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -1.546 8.673 -22.069 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.909 9.734 -22.363 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -1.195 11.462 -23.245 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.012 10.170 -23.204 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -0.883 10.168 -25.440 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.620 8.787 -24.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.129 10.322 -25.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -3.637 9.912 -24.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.948 11.435 -24.690 1.00 0.00 H new ATOM 198 N GLN A 16 -1.921 11.439 -18.006 1.00 0.00 N ATOM 199 CA GLN A 16 -1.760 11.411 -16.563 1.00 0.00 C ATOM 200 C GLN A 16 -1.405 9.998 -16.096 1.00 0.00 C ATOM 201 O GLN A 16 -1.483 9.046 -16.871 1.00 0.00 O ATOM 202 CB GLN A 16 -3.020 11.921 -15.860 1.00 0.00 C ATOM 203 CG GLN A 16 -2.756 13.256 -15.161 1.00 0.00 C ATOM 204 CD GLN A 16 -3.909 14.234 -15.394 1.00 0.00 C ATOM 205 OE1 GLN A 16 -5.015 14.056 -14.913 1.00 0.00 O ATOM 206 NE2 GLN A 16 -3.589 15.275 -16.158 1.00 0.00 N ATOM 0 H GLN A 16 -1.294 12.080 -18.493 1.00 0.00 H new ATOM 0 HA GLN A 16 -0.940 12.078 -16.296 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -3.823 12.040 -16.587 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.357 11.185 -15.130 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -2.625 13.091 -14.092 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -1.827 13.688 -15.533 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -2.643 15.364 -16.529 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.290 15.985 -16.373 1.00 0.00 H new ATOM 215 N ARG A 17 -1.024 9.906 -14.830 1.00 0.00 N ATOM 216 CA ARG A 17 -0.657 8.625 -14.250 1.00 0.00 C ATOM 217 C ARG A 17 -1.912 7.823 -13.897 1.00 0.00 C ATOM 218 O ARG A 17 -2.723 8.260 -13.082 1.00 0.00 O ATOM 219 CB ARG A 17 0.191 8.812 -12.991 1.00 0.00 C ATOM 220 CG ARG A 17 1.673 8.955 -13.344 1.00 0.00 C ATOM 221 CD ARG A 17 1.878 10.011 -14.433 1.00 0.00 C ATOM 222 NE ARG A 17 3.323 10.200 -14.689 1.00 0.00 N ATOM 223 CZ ARG A 17 3.849 11.295 -15.253 1.00 0.00 C ATOM 224 NH1 ARG A 17 3.052 12.307 -15.623 1.00 0.00 N ATOM 225 NH2 ARG A 17 5.172 11.380 -15.446 1.00 0.00 N ATOM 0 H ARG A 17 -0.962 10.698 -14.190 1.00 0.00 H new ATOM 0 HA ARG A 17 -0.071 8.082 -14.991 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -0.145 9.697 -12.450 1.00 0.00 H new ATOM 0 HB3 ARG A 17 0.053 7.960 -12.325 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.238 9.231 -12.454 1.00 0.00 H new ATOM 0 HG3 ARG A 17 2.064 7.996 -13.684 1.00 0.00 H new ATOM 0 HD2 ARG A 17 1.375 9.702 -15.350 1.00 0.00 H new ATOM 0 HD3 ARG A 17 1.428 10.955 -14.125 1.00 0.00 H new ATOM 0 HE ARG A 17 3.958 9.449 -14.419 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.045 12.243 -15.475 1.00 0.00 H new ATOM 0 HH12 ARG A 17 3.453 13.141 -16.053 1.00 0.00 H new ATOM 0 HH21 ARG A 17 5.779 10.611 -15.163 1.00 0.00 H new ATOM 0 HH22 ARG A 17 5.572 12.214 -15.876 1.00 0.00 H new ATOM 239 N PRO A 18 -2.036 6.634 -14.545 1.00 0.00 N ATOM 240 CA PRO A 18 -3.178 5.768 -14.307 1.00 0.00 C ATOM 241 C PRO A 18 -3.057 5.059 -12.957 1.00 0.00 C ATOM 242 O PRO A 18 -2.080 5.253 -12.235 1.00 0.00 O ATOM 243 CB PRO A 18 -3.193 4.805 -15.484 1.00 0.00 C ATOM 244 CG PRO A 18 -1.800 4.866 -16.090 1.00 0.00 C ATOM 245 CD PRO A 18 -1.095 6.084 -15.517 1.00 0.00 C ATOM 0 HA PRO A 18 -4.117 6.318 -14.246 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -3.433 3.793 -15.158 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -3.950 5.092 -16.214 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -1.243 3.958 -15.858 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -1.859 4.935 -17.176 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -0.152 5.810 -15.044 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -0.861 6.809 -16.296 1.00 0.00 H new ATOM 253 N GLN A 19 -4.064 4.252 -12.656 1.00 0.00 N ATOM 254 CA GLN A 19 -4.083 3.513 -11.405 1.00 0.00 C ATOM 255 C GLN A 19 -4.113 4.479 -10.218 1.00 0.00 C ATOM 256 O GLN A 19 -3.131 4.601 -9.488 1.00 0.00 O ATOM 257 CB GLN A 19 -2.885 2.565 -11.309 1.00 0.00 C ATOM 258 CG GLN A 19 -3.267 1.272 -10.587 1.00 0.00 C ATOM 259 CD GLN A 19 -2.046 0.367 -10.403 1.00 0.00 C ATOM 260 OE1 GLN A 19 -1.522 -0.210 -11.341 1.00 0.00 O ATOM 261 NE2 GLN A 19 -1.626 0.276 -9.144 1.00 0.00 N ATOM 0 H GLN A 19 -4.873 4.094 -13.257 1.00 0.00 H new ATOM 0 HA GLN A 19 -4.988 2.906 -11.378 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -2.519 2.333 -12.309 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -2.070 3.056 -10.777 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -3.699 1.508 -9.615 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -4.032 0.745 -11.157 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -2.111 0.786 -8.406 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.818 -0.304 -8.916 1.00 0.00 H new ATOM 270 N ALA A 20 -5.251 5.141 -10.064 1.00 0.00 N ATOM 271 CA ALA A 20 -5.422 6.092 -8.979 1.00 0.00 C ATOM 272 C ALA A 20 -6.793 6.759 -9.103 1.00 0.00 C ATOM 273 O ALA A 20 -7.562 6.442 -10.009 1.00 0.00 O ATOM 274 CB ALA A 20 -4.276 7.106 -9.003 1.00 0.00 C ATOM 0 H ALA A 20 -6.063 5.037 -10.672 1.00 0.00 H new ATOM 0 HA ALA A 20 -5.388 5.585 -8.015 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -4.404 7.819 -8.189 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -3.326 6.585 -8.882 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -4.280 7.637 -9.955 1.00 0.00 H new ATOM 280 N THR A 21 -7.058 7.671 -8.179 1.00 0.00 N ATOM 281 CA THR A 21 -8.323 8.385 -8.173 1.00 0.00 C ATOM 282 C THR A 21 -9.485 7.410 -7.976 1.00 0.00 C ATOM 283 O THR A 21 -9.985 7.251 -6.864 1.00 0.00 O ATOM 284 CB THR A 21 -8.418 9.189 -9.472 1.00 0.00 C ATOM 285 OG1 THR A 21 -7.429 10.205 -9.324 1.00 0.00 O ATOM 286 CG2 THR A 21 -9.732 9.964 -9.586 1.00 0.00 C ATOM 0 H THR A 21 -6.418 7.932 -7.429 1.00 0.00 H new ATOM 0 HA THR A 21 -8.380 9.082 -7.337 1.00 0.00 H new ATOM 0 HB THR A 21 -8.318 8.516 -10.323 1.00 0.00 H new ATOM 0 HG1 THR A 21 -7.421 10.772 -10.123 1.00 0.00 H new ATOM 0 HG21 THR A 21 -9.748 10.517 -10.525 1.00 0.00 H new ATOM 0 HG22 THR A 21 -10.569 9.266 -9.561 1.00 0.00 H new ATOM 0 HG23 THR A 21 -9.816 10.662 -8.753 1.00 0.00 H new ATOM 294 N ALA A 22 -9.881 6.782 -9.074 1.00 0.00 N ATOM 295 CA ALA A 22 -10.975 5.827 -9.035 1.00 0.00 C ATOM 296 C ALA A 22 -10.437 4.458 -8.616 1.00 0.00 C ATOM 297 O ALA A 22 -11.092 3.730 -7.872 1.00 0.00 O ATOM 298 CB ALA A 22 -11.668 5.789 -10.399 1.00 0.00 C ATOM 0 H ALA A 22 -9.464 6.916 -9.995 1.00 0.00 H new ATOM 0 HA ALA A 22 -11.720 6.127 -8.299 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.489 5.073 -10.370 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.058 6.779 -10.637 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -10.951 5.489 -11.163 1.00 0.00 H new ATOM 304 N GLU A 23 -9.247 4.148 -9.112 1.00 0.00 N ATOM 305 CA GLU A 23 -8.613 2.879 -8.798 1.00 0.00 C ATOM 306 C GLU A 23 -8.430 2.737 -7.286 1.00 0.00 C ATOM 307 O GLU A 23 -8.932 1.789 -6.683 1.00 0.00 O ATOM 308 CB GLU A 23 -7.276 2.740 -9.527 1.00 0.00 C ATOM 309 CG GLU A 23 -7.050 1.298 -9.988 1.00 0.00 C ATOM 310 CD GLU A 23 -7.880 0.985 -11.235 1.00 0.00 C ATOM 311 OE1 GLU A 23 -9.031 0.534 -11.051 1.00 0.00 O ATOM 312 OE2 GLU A 23 -7.345 1.203 -12.343 1.00 0.00 O ATOM 0 H GLU A 23 -8.706 4.754 -9.729 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.263 2.075 -9.143 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -7.256 3.408 -10.388 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.464 3.046 -8.867 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -5.993 1.142 -10.202 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.318 0.610 -9.186 1.00 0.00 H new ATOM 319 N GLN A 24 -7.711 3.693 -6.716 1.00 0.00 N ATOM 320 CA GLN A 24 -7.456 3.686 -5.286 1.00 0.00 C ATOM 321 C GLN A 24 -8.724 3.298 -4.522 1.00 0.00 C ATOM 322 O GLN A 24 -8.710 2.364 -3.722 1.00 0.00 O ATOM 323 CB GLN A 24 -6.927 5.042 -4.816 1.00 0.00 C ATOM 324 CG GLN A 24 -6.168 4.907 -3.494 1.00 0.00 C ATOM 325 CD GLN A 24 -6.917 5.609 -2.359 1.00 0.00 C ATOM 326 OE1 GLN A 24 -6.622 6.733 -1.988 1.00 0.00 O ATOM 327 NE2 GLN A 24 -7.899 4.885 -1.830 1.00 0.00 N ATOM 0 H GLN A 24 -7.297 4.478 -7.219 1.00 0.00 H new ATOM 0 HA GLN A 24 -6.688 2.941 -5.078 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.269 5.463 -5.576 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -7.757 5.737 -4.693 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -6.038 3.852 -3.251 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -5.171 5.336 -3.597 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.093 3.950 -2.188 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.458 5.265 -1.066 1.00 0.00 H new ATOM 336 N ILE A 25 -9.790 4.035 -4.796 1.00 0.00 N ATOM 337 CA ILE A 25 -11.064 3.781 -4.145 1.00 0.00 C ATOM 338 C ILE A 25 -11.322 2.273 -4.111 1.00 0.00 C ATOM 339 O ILE A 25 -11.356 1.669 -3.040 1.00 0.00 O ATOM 340 CB ILE A 25 -12.180 4.580 -4.820 1.00 0.00 C ATOM 341 CG1 ILE A 25 -11.993 6.082 -4.594 1.00 0.00 C ATOM 342 CG2 ILE A 25 -13.557 4.098 -4.358 1.00 0.00 C ATOM 343 CD1 ILE A 25 -12.889 6.894 -5.531 1.00 0.00 C ATOM 0 H ILE A 25 -9.798 4.809 -5.461 1.00 0.00 H new ATOM 0 HA ILE A 25 -11.038 4.125 -3.111 1.00 0.00 H new ATOM 0 HB ILE A 25 -12.122 4.406 -5.894 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -12.226 6.329 -3.558 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -10.950 6.351 -4.759 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -14.332 4.683 -4.853 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -13.678 3.045 -4.613 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -13.643 4.222 -3.278 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -12.736 7.958 -5.349 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -12.637 6.663 -6.566 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -13.933 6.641 -5.346 1.00 0.00 H new ATOM 355 N ARG A 26 -11.496 1.708 -5.297 1.00 0.00 N ATOM 356 CA ARG A 26 -11.750 0.282 -5.416 1.00 0.00 C ATOM 357 C ARG A 26 -10.653 -0.514 -4.705 1.00 0.00 C ATOM 358 O ARG A 26 -10.942 -1.466 -3.982 1.00 0.00 O ATOM 359 CB ARG A 26 -11.811 -0.146 -6.884 1.00 0.00 C ATOM 360 CG ARG A 26 -13.102 0.342 -7.544 1.00 0.00 C ATOM 361 CD ARG A 26 -13.704 -0.743 -8.439 1.00 0.00 C ATOM 362 NE ARG A 26 -15.075 -0.360 -8.846 1.00 0.00 N ATOM 363 CZ ARG A 26 -15.792 -1.010 -9.772 1.00 0.00 C ATOM 364 NH1 ARG A 26 -15.274 -2.078 -10.393 1.00 0.00 N ATOM 365 NH2 ARG A 26 -17.028 -0.591 -10.077 1.00 0.00 N ATOM 0 H ARG A 26 -11.466 2.212 -6.184 1.00 0.00 H new ATOM 0 HA ARG A 26 -12.713 0.077 -4.949 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.950 0.255 -7.420 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -11.751 -1.232 -6.953 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -13.822 0.626 -6.777 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -12.897 1.234 -8.136 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.080 -0.886 -9.321 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.726 -1.694 -7.907 1.00 0.00 H new ATOM 0 HE ARG A 26 -15.500 0.449 -8.393 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -14.333 -2.396 -10.161 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -15.820 -2.573 -11.098 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -17.422 0.222 -9.604 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -17.575 -1.085 -10.782 1.00 0.00 H new ATOM 379 N LEU A 27 -9.418 -0.094 -4.935 1.00 0.00 N ATOM 380 CA LEU A 27 -8.277 -0.755 -4.326 1.00 0.00 C ATOM 381 C LEU A 27 -8.491 -0.841 -2.813 1.00 0.00 C ATOM 382 O LEU A 27 -8.635 -1.932 -2.265 1.00 0.00 O ATOM 383 CB LEU A 27 -6.976 -0.055 -4.724 1.00 0.00 C ATOM 384 CG LEU A 27 -6.564 -0.189 -6.192 1.00 0.00 C ATOM 385 CD1 LEU A 27 -5.072 0.096 -6.370 1.00 0.00 C ATOM 386 CD2 LEU A 27 -6.957 -1.559 -6.748 1.00 0.00 C ATOM 0 H LEU A 27 -9.183 0.696 -5.535 1.00 0.00 H new ATOM 0 HA LEU A 27 -8.187 -1.777 -4.695 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.071 1.005 -4.489 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -6.171 -0.448 -4.104 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.106 0.560 -6.770 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.805 -0.006 -7.422 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.853 1.110 -6.037 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -4.493 -0.613 -5.778 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.653 -1.629 -7.792 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.461 -2.341 -6.173 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.037 -1.685 -6.675 1.00 0.00 H new ATOM 398 N ALA A 28 -8.504 0.324 -2.182 1.00 0.00 N ATOM 399 CA ALA A 28 -8.697 0.394 -0.744 1.00 0.00 C ATOM 400 C ALA A 28 -9.911 -0.453 -0.356 1.00 0.00 C ATOM 401 O ALA A 28 -9.964 -1.000 0.745 1.00 0.00 O ATOM 402 CB ALA A 28 -8.846 1.856 -0.319 1.00 0.00 C ATOM 0 H ALA A 28 -8.384 1.227 -2.641 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.831 -0.010 -0.220 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -8.991 1.908 0.760 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.946 2.408 -0.592 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.707 2.295 -0.822 1.00 0.00 H new ATOM 408 N GLN A 29 -10.856 -0.535 -1.281 1.00 0.00 N ATOM 409 CA GLN A 29 -12.065 -1.306 -1.049 1.00 0.00 C ATOM 410 C GLN A 29 -11.775 -2.802 -1.181 1.00 0.00 C ATOM 411 O GLN A 29 -12.381 -3.620 -0.491 1.00 0.00 O ATOM 412 CB GLN A 29 -13.181 -0.877 -2.004 1.00 0.00 C ATOM 413 CG GLN A 29 -14.284 -1.935 -2.069 1.00 0.00 C ATOM 414 CD GLN A 29 -15.668 -1.283 -2.106 1.00 0.00 C ATOM 415 OE1 GLN A 29 -16.025 -0.477 -1.262 1.00 0.00 O ATOM 416 NE2 GLN A 29 -16.423 -1.674 -3.128 1.00 0.00 N ATOM 0 H GLN A 29 -10.809 -0.080 -2.193 1.00 0.00 H new ATOM 0 HA GLN A 29 -12.407 -1.111 -0.033 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.602 0.073 -1.674 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -12.769 -0.714 -3.000 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -14.146 -2.555 -2.955 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -14.212 -2.594 -1.204 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -16.062 -2.352 -3.799 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -17.363 -1.295 -3.242 1.00 0.00 H new ATOM 425 N MET A 30 -10.847 -3.115 -2.074 1.00 0.00 N ATOM 426 CA MET A 30 -10.468 -4.499 -2.306 1.00 0.00 C ATOM 427 C MET A 30 -9.460 -4.975 -1.258 1.00 0.00 C ATOM 428 O MET A 30 -9.553 -6.099 -0.767 1.00 0.00 O ATOM 429 CB MET A 30 -9.856 -4.634 -3.702 1.00 0.00 C ATOM 430 CG MET A 30 -10.941 -4.612 -4.780 1.00 0.00 C ATOM 431 SD MET A 30 -11.053 -6.211 -5.566 1.00 0.00 S ATOM 432 CE MET A 30 -9.974 -5.945 -6.963 1.00 0.00 C ATOM 0 H MET A 30 -10.347 -2.434 -2.645 1.00 0.00 H new ATOM 0 HA MET A 30 -11.362 -5.118 -2.230 1.00 0.00 H new ATOM 0 HB2 MET A 30 -9.151 -3.821 -3.874 1.00 0.00 H new ATOM 0 HB3 MET A 30 -9.292 -5.564 -3.767 1.00 0.00 H new ATOM 0 HG2 MET A 30 -11.901 -4.348 -4.336 1.00 0.00 H new ATOM 0 HG3 MET A 30 -10.712 -3.848 -5.523 1.00 0.00 H new ATOM 0 HE1 MET A 30 -9.929 -6.852 -7.566 1.00 0.00 H new ATOM 0 HE2 MET A 30 -10.359 -5.125 -7.569 1.00 0.00 H new ATOM 0 HE3 MET A 30 -8.974 -5.695 -6.608 1.00 0.00 H new ATOM 442 N ILE A 31 -8.519 -4.095 -0.946 1.00 0.00 N ATOM 443 CA ILE A 31 -7.495 -4.412 0.034 1.00 0.00 C ATOM 444 C ILE A 31 -8.158 -4.716 1.379 1.00 0.00 C ATOM 445 O ILE A 31 -8.009 -5.814 1.914 1.00 0.00 O ATOM 446 CB ILE A 31 -6.454 -3.292 0.102 1.00 0.00 C ATOM 447 CG1 ILE A 31 -5.477 -3.380 -1.072 1.00 0.00 C ATOM 448 CG2 ILE A 31 -5.732 -3.295 1.451 1.00 0.00 C ATOM 449 CD1 ILE A 31 -5.468 -2.079 -1.877 1.00 0.00 C ATOM 0 H ILE A 31 -8.445 -3.163 -1.355 1.00 0.00 H new ATOM 0 HA ILE A 31 -6.949 -5.307 -0.262 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.973 -2.337 0.018 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -4.474 -3.589 -0.700 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.756 -4.211 -1.720 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.998 -2.490 1.473 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.457 -3.147 2.252 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -5.226 -4.250 1.591 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.765 -2.169 -2.705 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -6.467 -1.886 -2.268 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.165 -1.254 -1.232 1.00 0.00 H new ATOM 461 N SER A 32 -8.878 -3.726 1.886 1.00 0.00 N ATOM 462 CA SER A 32 -9.565 -3.875 3.157 1.00 0.00 C ATOM 463 C SER A 32 -10.192 -5.267 3.254 1.00 0.00 C ATOM 464 O SER A 32 -9.975 -5.983 4.230 1.00 0.00 O ATOM 465 CB SER A 32 -10.636 -2.797 3.334 1.00 0.00 C ATOM 466 OG SER A 32 -11.568 -2.789 2.257 1.00 0.00 O ATOM 0 H SER A 32 -9.000 -2.817 1.439 1.00 0.00 H new ATOM 0 HA SER A 32 -8.833 -3.757 3.956 1.00 0.00 H new ATOM 0 HB2 SER A 32 -11.167 -2.964 4.271 1.00 0.00 H new ATOM 0 HB3 SER A 32 -10.158 -1.820 3.407 1.00 0.00 H new ATOM 0 HG SER A 32 -11.246 -2.191 1.550 1.00 0.00 H new ATOM 472 N ASP A 33 -10.957 -5.608 2.227 1.00 0.00 N ATOM 473 CA ASP A 33 -11.618 -6.902 2.184 1.00 0.00 C ATOM 474 C ASP A 33 -10.563 -8.010 2.226 1.00 0.00 C ATOM 475 O ASP A 33 -10.639 -8.913 3.057 1.00 0.00 O ATOM 476 CB ASP A 33 -12.424 -7.066 0.894 1.00 0.00 C ATOM 477 CG ASP A 33 -13.768 -6.334 0.875 1.00 0.00 C ATOM 478 OD1 ASP A 33 -13.810 -5.210 1.421 1.00 0.00 O ATOM 479 OD2 ASP A 33 -14.722 -6.914 0.314 1.00 0.00 O ATOM 0 H ASP A 33 -11.134 -5.011 1.419 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.290 -6.966 3.040 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -11.821 -6.710 0.059 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -12.603 -8.128 0.728 1.00 0.00 H new ATOM 484 N HIS A 34 -9.604 -7.904 1.318 1.00 0.00 N ATOM 485 CA HIS A 34 -8.535 -8.885 1.241 1.00 0.00 C ATOM 486 C HIS A 34 -7.360 -8.434 2.111 1.00 0.00 C ATOM 487 O HIS A 34 -6.489 -7.697 1.651 1.00 0.00 O ATOM 488 CB HIS A 34 -8.133 -9.137 -0.214 1.00 0.00 C ATOM 489 CG HIS A 34 -9.113 -9.991 -0.982 1.00 0.00 C ATOM 490 ND1 HIS A 34 -9.299 -11.338 -0.721 1.00 0.00 N ATOM 491 CD2 HIS A 34 -9.958 -9.677 -2.006 1.00 0.00 C ATOM 492 CE1 HIS A 34 -10.217 -11.802 -1.556 1.00 0.00 C ATOM 493 NE2 HIS A 34 -10.623 -10.772 -2.352 1.00 0.00 N ATOM 0 H HIS A 34 -9.545 -7.154 0.629 1.00 0.00 H new ATOM 0 HA HIS A 34 -8.885 -9.841 1.632 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -8.026 -8.179 -0.722 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -7.155 -9.618 -0.232 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -10.067 -8.702 -2.458 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -10.580 -12.818 -1.599 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -11.323 -10.833 -3.092 1.00 0.00 H new ATOM 501 N ASN A 35 -7.373 -8.896 3.353 1.00 0.00 N ATOM 502 CA ASN A 35 -6.320 -8.550 4.291 1.00 0.00 C ATOM 503 C ASN A 35 -6.254 -9.611 5.391 1.00 0.00 C ATOM 504 O ASN A 35 -7.109 -10.492 5.462 1.00 0.00 O ATOM 505 CB ASN A 35 -6.595 -7.199 4.954 1.00 0.00 C ATOM 506 CG ASN A 35 -8.007 -7.153 5.540 1.00 0.00 C ATOM 507 OD1 ASN A 35 -8.765 -8.107 5.476 1.00 0.00 O ATOM 508 ND2 ASN A 35 -8.318 -5.993 6.113 1.00 0.00 N ATOM 0 H ASN A 35 -8.097 -9.507 3.731 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.381 -8.497 3.739 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.864 -7.022 5.743 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -6.475 -6.400 4.223 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.238 -5.862 6.533 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -7.636 -5.235 6.132 1.00 0.00 H new ATOM 515 N ASP A 36 -5.229 -9.492 6.223 1.00 0.00 N ATOM 516 CA ASP A 36 -5.040 -10.430 7.316 1.00 0.00 C ATOM 517 C ASP A 36 -5.132 -9.681 8.647 1.00 0.00 C ATOM 518 O ASP A 36 -5.217 -8.454 8.668 1.00 0.00 O ATOM 519 CB ASP A 36 -3.663 -11.094 7.241 1.00 0.00 C ATOM 520 CG ASP A 36 -3.621 -12.551 7.704 1.00 0.00 C ATOM 521 OD1 ASP A 36 -4.689 -13.199 7.637 1.00 0.00 O ATOM 522 OD2 ASP A 36 -2.523 -12.985 8.114 1.00 0.00 O ATOM 0 H ASP A 36 -4.521 -8.760 6.162 1.00 0.00 H new ATOM 0 HA ASP A 36 -5.813 -11.195 7.241 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -3.309 -11.046 6.211 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -2.964 -10.516 7.846 1.00 0.00 H new ATOM 527 N ALA A 37 -5.111 -10.451 9.726 1.00 0.00 N ATOM 528 CA ALA A 37 -5.191 -9.875 11.057 1.00 0.00 C ATOM 529 C ALA A 37 -3.951 -9.017 11.312 1.00 0.00 C ATOM 530 O ALA A 37 -4.044 -7.949 11.916 1.00 0.00 O ATOM 531 CB ALA A 37 -5.348 -10.994 12.089 1.00 0.00 C ATOM 0 H ALA A 37 -5.040 -11.468 9.705 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.063 -9.227 11.143 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -5.408 -10.562 13.088 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -6.259 -11.555 11.881 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -4.489 -11.663 12.034 1.00 0.00 H new ATOM 537 N ASP A 38 -2.818 -9.515 10.840 1.00 0.00 N ATOM 538 CA ASP A 38 -1.561 -8.807 11.009 1.00 0.00 C ATOM 539 C ASP A 38 -1.719 -7.369 10.512 1.00 0.00 C ATOM 540 O ASP A 38 -1.587 -6.422 11.286 1.00 0.00 O ATOM 541 CB ASP A 38 -0.443 -9.467 10.198 1.00 0.00 C ATOM 542 CG ASP A 38 -0.111 -10.903 10.605 1.00 0.00 C ATOM 543 OD1 ASP A 38 -0.878 -11.801 10.195 1.00 0.00 O ATOM 544 OD2 ASP A 38 0.902 -11.072 11.318 1.00 0.00 O ATOM 0 H ASP A 38 -2.744 -10.401 10.340 1.00 0.00 H new ATOM 0 HA ASP A 38 -1.301 -8.830 12.067 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -0.725 -9.460 9.145 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.459 -8.861 10.290 1.00 0.00 H new ATOM 549 N PHE A 39 -2.001 -7.249 9.223 1.00 0.00 N ATOM 550 CA PHE A 39 -2.179 -5.943 8.613 1.00 0.00 C ATOM 551 C PHE A 39 -3.213 -5.116 9.380 1.00 0.00 C ATOM 552 O PHE A 39 -3.034 -3.915 9.573 1.00 0.00 O ATOM 553 CB PHE A 39 -2.687 -6.179 7.189 1.00 0.00 C ATOM 554 CG PHE A 39 -2.948 -4.894 6.401 1.00 0.00 C ATOM 555 CD1 PHE A 39 -1.904 -4.130 5.980 1.00 0.00 C ATOM 556 CD2 PHE A 39 -4.224 -4.516 6.120 1.00 0.00 C ATOM 557 CE1 PHE A 39 -2.147 -2.937 5.248 1.00 0.00 C ATOM 558 CE2 PHE A 39 -4.467 -3.323 5.388 1.00 0.00 C ATOM 559 CZ PHE A 39 -3.423 -2.559 4.968 1.00 0.00 C ATOM 0 H PHE A 39 -2.111 -8.036 8.584 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.236 -5.396 8.623 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -1.957 -6.782 6.649 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -3.609 -6.759 7.234 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.891 -4.430 6.202 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -5.053 -5.123 6.453 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.318 -2.330 4.914 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -5.480 -3.023 5.165 1.00 0.00 H new ATOM 0 HZ PHE A 39 -3.607 -1.652 4.412 1.00 0.00 H new ATOM 569 N GLU A 40 -4.273 -5.793 9.797 1.00 0.00 N ATOM 570 CA GLU A 40 -5.336 -5.137 10.539 1.00 0.00 C ATOM 571 C GLU A 40 -4.773 -4.471 11.796 1.00 0.00 C ATOM 572 O GLU A 40 -4.935 -3.267 11.990 1.00 0.00 O ATOM 573 CB GLU A 40 -6.449 -6.125 10.893 1.00 0.00 C ATOM 574 CG GLU A 40 -7.480 -6.218 9.767 1.00 0.00 C ATOM 575 CD GLU A 40 -8.732 -6.965 10.229 1.00 0.00 C ATOM 576 OE1 GLU A 40 -8.566 -8.108 10.709 1.00 0.00 O ATOM 577 OE2 GLU A 40 -9.827 -6.377 10.093 1.00 0.00 O ATOM 0 H GLU A 40 -4.418 -6.790 9.635 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.771 -4.364 9.906 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.020 -7.109 11.080 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.939 -5.811 11.814 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.752 -5.216 9.435 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.042 -6.730 8.910 1.00 0.00 H new ATOM 584 N GLU A 41 -4.124 -5.283 12.617 1.00 0.00 N ATOM 585 CA GLU A 41 -3.536 -4.787 13.850 1.00 0.00 C ATOM 586 C GLU A 41 -2.617 -3.598 13.560 1.00 0.00 C ATOM 587 O GLU A 41 -2.597 -2.627 14.314 1.00 0.00 O ATOM 588 CB GLU A 41 -2.780 -5.898 14.582 1.00 0.00 C ATOM 589 CG GLU A 41 -3.488 -6.276 15.885 1.00 0.00 C ATOM 590 CD GLU A 41 -2.478 -6.692 16.956 1.00 0.00 C ATOM 591 OE1 GLU A 41 -1.628 -7.549 16.633 1.00 0.00 O ATOM 592 OE2 GLU A 41 -2.580 -6.143 18.075 1.00 0.00 O ATOM 0 H GLU A 41 -3.992 -6.281 12.453 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.341 -4.448 14.503 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.702 -6.775 13.939 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.763 -5.570 14.798 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.075 -5.430 16.243 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.185 -7.093 15.701 1.00 0.00 H new ATOM 599 N LYS A 42 -1.880 -3.714 12.465 1.00 0.00 N ATOM 600 CA LYS A 42 -0.962 -2.661 12.066 1.00 0.00 C ATOM 601 C LYS A 42 -1.750 -1.376 11.804 1.00 0.00 C ATOM 602 O LYS A 42 -1.448 -0.331 12.378 1.00 0.00 O ATOM 603 CB LYS A 42 -0.111 -3.114 10.878 1.00 0.00 C ATOM 604 CG LYS A 42 0.987 -4.080 11.327 1.00 0.00 C ATOM 605 CD LYS A 42 2.146 -4.095 10.328 1.00 0.00 C ATOM 606 CE LYS A 42 3.261 -5.032 10.797 1.00 0.00 C ATOM 607 NZ LYS A 42 4.588 -4.434 10.526 1.00 0.00 N ATOM 0 H LYS A 42 -1.900 -4.521 11.842 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.257 -2.445 12.869 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.745 -3.598 10.135 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.338 -2.246 10.396 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.354 -3.787 12.311 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.575 -5.084 11.426 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.784 -4.415 9.351 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.540 -3.086 10.208 1.00 0.00 H new ATOM 0 HE2 LYS A 42 3.155 -5.228 11.864 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.177 -5.991 10.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 5.320 -4.966 11.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.784 -4.472 9.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 4.594 -3.444 10.843 1.00 0.00 H new ATOM 621 N VAL A 43 -2.744 -1.496 10.936 1.00 0.00 N ATOM 622 CA VAL A 43 -3.578 -0.357 10.591 1.00 0.00 C ATOM 623 C VAL A 43 -3.906 0.432 11.860 1.00 0.00 C ATOM 624 O VAL A 43 -3.613 1.623 11.948 1.00 0.00 O ATOM 625 CB VAL A 43 -4.825 -0.829 9.841 1.00 0.00 C ATOM 626 CG1 VAL A 43 -5.895 0.263 9.815 1.00 0.00 C ATOM 627 CG2 VAL A 43 -4.472 -1.286 8.424 1.00 0.00 C ATOM 0 H VAL A 43 -2.991 -2.365 10.461 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.046 0.316 9.918 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.234 -1.686 10.377 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -6.771 -0.098 9.276 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.178 0.520 10.836 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.500 1.147 9.315 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.376 -1.617 7.912 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -4.027 -0.457 7.875 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -3.761 -2.111 8.474 1.00 0.00 H new ATOM 637 N LYS A 44 -4.512 -0.264 12.811 1.00 0.00 N ATOM 638 CA LYS A 44 -4.883 0.357 14.072 1.00 0.00 C ATOM 639 C LYS A 44 -3.655 1.034 14.683 1.00 0.00 C ATOM 640 O LYS A 44 -3.730 2.179 15.127 1.00 0.00 O ATOM 641 CB LYS A 44 -5.547 -0.665 14.997 1.00 0.00 C ATOM 642 CG LYS A 44 -6.991 -0.936 14.568 1.00 0.00 C ATOM 643 CD LYS A 44 -7.597 -2.083 15.380 1.00 0.00 C ATOM 644 CE LYS A 44 -8.237 -1.563 16.669 1.00 0.00 C ATOM 645 NZ LYS A 44 -9.665 -1.242 16.445 1.00 0.00 N ATOM 0 H LYS A 44 -4.755 -1.252 12.734 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.628 1.136 13.909 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -4.979 -1.595 14.984 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.532 -0.296 16.023 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -7.589 -0.035 14.702 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -7.019 -1.182 13.507 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -8.346 -2.601 14.781 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.823 -2.811 15.622 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.145 -2.312 17.456 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.708 -0.674 17.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -10.085 -0.890 17.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.745 -0.511 15.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -10.169 -2.098 16.139 1.00 0.00 H new ATOM 659 N GLN A 45 -2.554 0.298 14.688 1.00 0.00 N ATOM 660 CA GLN A 45 -1.312 0.813 15.238 1.00 0.00 C ATOM 661 C GLN A 45 -0.979 2.172 14.617 1.00 0.00 C ATOM 662 O GLN A 45 -0.528 3.082 15.310 1.00 0.00 O ATOM 663 CB GLN A 45 -0.166 -0.179 15.030 1.00 0.00 C ATOM 664 CG GLN A 45 0.172 -0.906 16.333 1.00 0.00 C ATOM 665 CD GLN A 45 1.545 -0.481 16.857 1.00 0.00 C ATOM 666 OE1 GLN A 45 1.686 0.482 17.593 1.00 0.00 O ATOM 667 NE2 GLN A 45 2.546 -1.250 16.438 1.00 0.00 N ATOM 0 H GLN A 45 -2.496 -0.651 14.320 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.442 0.947 16.312 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -0.443 -0.905 14.265 1.00 0.00 H new ATOM 0 HB3 GLN A 45 0.715 0.349 14.665 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -0.590 -0.690 17.082 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.160 -1.983 16.167 1.00 0.00 H new ATOM 0 HE21 GLN A 45 2.358 -2.041 15.822 1.00 0.00 H new ATOM 0 HE22 GLN A 45 3.502 -1.049 16.732 1.00 0.00 H new ATOM 676 N LEU A 46 -1.215 2.266 13.316 1.00 0.00 N ATOM 677 CA LEU A 46 -0.947 3.498 12.594 1.00 0.00 C ATOM 678 C LEU A 46 -1.849 4.608 13.136 1.00 0.00 C ATOM 679 O LEU A 46 -1.391 5.726 13.370 1.00 0.00 O ATOM 680 CB LEU A 46 -1.083 3.275 11.087 1.00 0.00 C ATOM 681 CG LEU A 46 0.191 2.849 10.354 1.00 0.00 C ATOM 682 CD1 LEU A 46 -0.092 2.579 8.875 1.00 0.00 C ATOM 683 CD2 LEU A 46 1.305 3.880 10.545 1.00 0.00 C ATOM 0 H LEU A 46 -1.589 1.509 12.744 1.00 0.00 H new ATOM 0 HA LEU A 46 0.083 3.818 12.754 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.846 2.515 10.920 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -1.447 4.197 10.635 1.00 0.00 H new ATOM 0 HG LEU A 46 0.540 1.914 10.792 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.830 2.278 8.377 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.830 1.782 8.785 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.478 3.485 8.407 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.199 3.553 10.014 1.00 0.00 H new ATOM 0 HD22 LEU A 46 0.981 4.843 10.151 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.530 3.980 11.607 1.00 0.00 H new ATOM 695 N ILE A 47 -3.115 4.263 13.319 1.00 0.00 N ATOM 696 CA ILE A 47 -4.085 5.216 13.829 1.00 0.00 C ATOM 697 C ILE A 47 -3.681 5.642 15.242 1.00 0.00 C ATOM 698 O ILE A 47 -3.517 6.831 15.513 1.00 0.00 O ATOM 699 CB ILE A 47 -5.500 4.641 13.741 1.00 0.00 C ATOM 700 CG1 ILE A 47 -6.086 4.840 12.342 1.00 0.00 C ATOM 701 CG2 ILE A 47 -6.400 5.229 14.829 1.00 0.00 C ATOM 702 CD1 ILE A 47 -7.408 4.085 12.189 1.00 0.00 C ATOM 0 H ILE A 47 -3.491 3.336 13.123 1.00 0.00 H new ATOM 0 HA ILE A 47 -4.093 6.116 13.214 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.444 3.567 13.917 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.247 5.902 12.159 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -5.375 4.491 11.593 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.400 4.803 14.744 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -5.987 4.992 15.810 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.455 6.311 14.710 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.803 4.243 11.186 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -7.239 3.020 12.349 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.124 4.453 12.923 1.00 0.00 H new ATOM 714 N ASP A 48 -3.533 4.648 16.105 1.00 0.00 N ATOM 715 CA ASP A 48 -3.151 4.905 17.484 1.00 0.00 C ATOM 716 C ASP A 48 -1.839 5.691 17.507 1.00 0.00 C ATOM 717 O ASP A 48 -1.663 6.589 18.329 1.00 0.00 O ATOM 718 CB ASP A 48 -2.933 3.597 18.247 1.00 0.00 C ATOM 719 CG ASP A 48 -3.974 3.299 19.329 1.00 0.00 C ATOM 720 OD1 ASP A 48 -4.334 4.255 20.049 1.00 0.00 O ATOM 721 OD2 ASP A 48 -4.385 2.121 19.411 1.00 0.00 O ATOM 0 H ASP A 48 -3.671 3.663 15.877 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.954 5.469 17.958 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.927 2.774 17.533 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.947 3.624 18.710 1.00 0.00 H new ATOM 726 N ILE A 49 -0.950 5.324 16.595 1.00 0.00 N ATOM 727 CA ILE A 49 0.341 5.984 16.501 1.00 0.00 C ATOM 728 C ILE A 49 0.143 7.413 15.993 1.00 0.00 C ATOM 729 O ILE A 49 0.330 8.373 16.739 1.00 0.00 O ATOM 730 CB ILE A 49 1.305 5.156 15.648 1.00 0.00 C ATOM 731 CG1 ILE A 49 1.726 3.880 16.380 1.00 0.00 C ATOM 732 CG2 ILE A 49 2.510 5.993 15.214 1.00 0.00 C ATOM 733 CD1 ILE A 49 2.223 2.821 15.393 1.00 0.00 C ATOM 0 H ILE A 49 -1.099 4.578 15.915 1.00 0.00 H new ATOM 0 HA ILE A 49 0.804 6.057 17.485 1.00 0.00 H new ATOM 0 HB ILE A 49 0.783 4.850 14.741 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.513 4.111 17.098 1.00 0.00 H new ATOM 0 HG13 ILE A 49 0.882 3.486 16.947 1.00 0.00 H new ATOM 0 HG21 ILE A 49 3.179 5.381 14.609 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.168 6.846 14.627 1.00 0.00 H new ATOM 0 HG23 ILE A 49 3.042 6.349 16.096 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.516 1.924 15.939 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.426 2.575 14.692 1.00 0.00 H new ATOM 0 HD13 ILE A 49 3.082 3.209 14.845 1.00 0.00 H new ATOM 745 N THR A 50 -0.233 7.510 14.726 1.00 0.00 N ATOM 746 CA THR A 50 -0.459 8.806 14.109 1.00 0.00 C ATOM 747 C THR A 50 -1.884 9.289 14.388 1.00 0.00 C ATOM 748 O THR A 50 -2.083 10.248 15.132 1.00 0.00 O ATOM 749 CB THR A 50 -0.140 8.682 12.618 1.00 0.00 C ATOM 750 OG1 THR A 50 -1.183 7.855 12.108 1.00 0.00 O ATOM 751 CG2 THR A 50 1.135 7.878 12.356 1.00 0.00 C ATOM 0 H THR A 50 -0.387 6.712 14.110 1.00 0.00 H new ATOM 0 HA THR A 50 0.197 9.566 14.534 1.00 0.00 H new ATOM 0 HB THR A 50 -0.036 9.677 12.185 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.935 6.913 12.214 1.00 0.00 H new ATOM 0 HG21 THR A 50 1.315 7.821 11.282 1.00 0.00 H new ATOM 0 HG22 THR A 50 1.980 8.368 12.840 1.00 0.00 H new ATOM 0 HG23 THR A 50 1.020 6.872 12.759 1.00 0.00 H new ATOM 759 N GLY A 51 -2.837 8.602 13.776 1.00 0.00 N ATOM 760 CA GLY A 51 -4.238 8.949 13.949 1.00 0.00 C ATOM 761 C GLY A 51 -4.816 9.549 12.666 1.00 0.00 C ATOM 762 O GLY A 51 -5.817 10.264 12.707 1.00 0.00 O ATOM 0 H GLY A 51 -2.667 7.807 13.160 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.805 8.060 14.227 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.342 9.662 14.767 1.00 0.00 H new ATOM 766 N LYS A 52 -4.162 9.237 11.557 1.00 0.00 N ATOM 767 CA LYS A 52 -4.600 9.736 10.265 1.00 0.00 C ATOM 768 C LYS A 52 -5.833 8.953 9.811 1.00 0.00 C ATOM 769 O LYS A 52 -6.260 8.016 10.484 1.00 0.00 O ATOM 770 CB LYS A 52 -3.446 9.704 9.260 1.00 0.00 C ATOM 771 CG LYS A 52 -2.281 10.574 9.734 1.00 0.00 C ATOM 772 CD LYS A 52 -2.600 12.060 9.560 1.00 0.00 C ATOM 773 CE LYS A 52 -1.330 12.863 9.269 1.00 0.00 C ATOM 774 NZ LYS A 52 -1.615 13.955 8.312 1.00 0.00 N ATOM 0 H LYS A 52 -3.332 8.645 11.527 1.00 0.00 H new ATOM 0 HA LYS A 52 -4.898 10.782 10.341 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.106 8.677 9.124 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -3.795 10.055 8.289 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.069 10.364 10.782 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.382 10.323 9.171 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -3.312 12.190 8.745 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -3.077 12.441 10.463 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.935 13.278 10.196 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.562 12.205 8.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.743 14.490 8.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -1.971 13.552 7.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -2.332 14.592 8.715 1.00 0.00 H new ATOM 788 N ASN A 53 -6.371 9.366 8.672 1.00 0.00 N ATOM 789 CA ASN A 53 -7.547 8.715 8.121 1.00 0.00 C ATOM 790 C ASN A 53 -7.261 7.223 7.941 1.00 0.00 C ATOM 791 O ASN A 53 -6.371 6.845 7.181 1.00 0.00 O ATOM 792 CB ASN A 53 -7.907 9.297 6.752 1.00 0.00 C ATOM 793 CG ASN A 53 -8.188 10.797 6.850 1.00 0.00 C ATOM 794 OD1 ASN A 53 -7.573 11.521 7.616 1.00 0.00 O ATOM 795 ND2 ASN A 53 -9.149 11.222 6.036 1.00 0.00 N ATOM 0 H ASN A 53 -6.014 10.143 8.116 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.376 8.875 8.810 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.090 9.122 6.052 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -8.783 8.785 6.354 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -9.411 12.208 6.028 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -9.624 10.563 5.420 1.00 0.00 H new ATOM 802 N GLN A 54 -8.034 6.415 8.652 1.00 0.00 N ATOM 803 CA GLN A 54 -7.874 4.973 8.580 1.00 0.00 C ATOM 804 C GLN A 54 -7.572 4.543 7.143 1.00 0.00 C ATOM 805 O GLN A 54 -6.532 3.943 6.877 1.00 0.00 O ATOM 806 CB GLN A 54 -9.116 4.257 9.117 1.00 0.00 C ATOM 807 CG GLN A 54 -8.854 2.759 9.288 1.00 0.00 C ATOM 808 CD GLN A 54 -10.160 1.997 9.520 1.00 0.00 C ATOM 809 OE1 GLN A 54 -11.064 2.455 10.199 1.00 0.00 O ATOM 810 NE2 GLN A 54 -10.209 0.812 8.918 1.00 0.00 N ATOM 0 H GLN A 54 -8.772 6.732 9.280 1.00 0.00 H new ATOM 0 HA GLN A 54 -7.030 4.689 9.208 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -9.405 4.691 10.074 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -9.951 4.408 8.433 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -8.355 2.370 8.401 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -8.180 2.598 10.130 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -9.416 0.488 8.364 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -11.039 0.227 9.011 1.00 0.00 H new ATOM 819 N ASP A 55 -8.500 4.867 6.255 1.00 0.00 N ATOM 820 CA ASP A 55 -8.346 4.522 4.852 1.00 0.00 C ATOM 821 C ASP A 55 -6.926 4.869 4.399 1.00 0.00 C ATOM 822 O ASP A 55 -6.244 4.043 3.794 1.00 0.00 O ATOM 823 CB ASP A 55 -9.326 5.310 3.980 1.00 0.00 C ATOM 824 CG ASP A 55 -10.603 4.557 3.600 1.00 0.00 C ATOM 825 OD1 ASP A 55 -11.293 4.103 4.538 1.00 0.00 O ATOM 826 OD2 ASP A 55 -10.859 4.453 2.381 1.00 0.00 O ATOM 0 H ASP A 55 -9.361 5.365 6.480 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.544 3.456 4.743 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -9.604 6.223 4.506 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -8.814 5.612 3.066 1.00 0.00 H new ATOM 831 N GLU A 56 -6.523 6.093 4.709 1.00 0.00 N ATOM 832 CA GLU A 56 -5.197 6.559 4.341 1.00 0.00 C ATOM 833 C GLU A 56 -4.126 5.669 4.976 1.00 0.00 C ATOM 834 O GLU A 56 -3.188 5.245 4.303 1.00 0.00 O ATOM 835 CB GLU A 56 -5.000 8.023 4.740 1.00 0.00 C ATOM 836 CG GLU A 56 -5.828 8.951 3.849 1.00 0.00 C ATOM 837 CD GLU A 56 -5.016 9.418 2.639 1.00 0.00 C ATOM 838 OE1 GLU A 56 -3.938 10.006 2.873 1.00 0.00 O ATOM 839 OE2 GLU A 56 -5.491 9.176 1.509 1.00 0.00 O ATOM 0 H GLU A 56 -7.091 6.776 5.211 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.099 6.495 3.257 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.288 8.161 5.782 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -3.945 8.286 4.663 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.725 8.432 3.511 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.158 9.815 4.425 1.00 0.00 H new ATOM 846 N CYS A 57 -4.302 5.414 6.264 1.00 0.00 N ATOM 847 CA CYS A 57 -3.363 4.582 6.997 1.00 0.00 C ATOM 848 C CYS A 57 -3.310 3.209 6.324 1.00 0.00 C ATOM 849 O CYS A 57 -2.231 2.708 6.011 1.00 0.00 O ATOM 850 CB CYS A 57 -3.735 4.478 8.477 1.00 0.00 C ATOM 851 SG CYS A 57 -3.639 6.128 9.264 1.00 0.00 S ATOM 0 H CYS A 57 -5.081 5.769 6.819 1.00 0.00 H new ATOM 0 HA CYS A 57 -2.373 5.037 6.970 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -4.743 4.075 8.580 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -3.062 3.785 8.982 1.00 0.00 H new ATOM 0 HG CYS A 57 -4.809 6.458 9.725 1.00 0.00 H new ATOM 857 N VAL A 58 -4.489 2.639 6.121 1.00 0.00 N ATOM 858 CA VAL A 58 -4.591 1.334 5.491 1.00 0.00 C ATOM 859 C VAL A 58 -3.935 1.386 4.110 1.00 0.00 C ATOM 860 O VAL A 58 -3.319 0.415 3.674 1.00 0.00 O ATOM 861 CB VAL A 58 -6.055 0.890 5.441 1.00 0.00 C ATOM 862 CG1 VAL A 58 -6.211 -0.392 4.621 1.00 0.00 C ATOM 863 CG2 VAL A 58 -6.622 0.711 6.851 1.00 0.00 C ATOM 0 H VAL A 58 -5.382 3.057 6.382 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.058 0.585 6.076 1.00 0.00 H new ATOM 0 HB VAL A 58 -6.627 1.676 4.947 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.260 -0.686 4.601 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.864 -0.217 3.603 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.620 -1.188 5.074 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.663 0.395 6.787 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.045 -0.046 7.382 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.562 1.656 7.390 1.00 0.00 H new ATOM 873 N ILE A 59 -4.090 2.530 3.459 1.00 0.00 N ATOM 874 CA ILE A 59 -3.520 2.722 2.136 1.00 0.00 C ATOM 875 C ILE A 59 -2.000 2.849 2.254 1.00 0.00 C ATOM 876 O ILE A 59 -1.261 2.019 1.726 1.00 0.00 O ATOM 877 CB ILE A 59 -4.184 3.908 1.434 1.00 0.00 C ATOM 878 CG1 ILE A 59 -5.654 3.613 1.129 1.00 0.00 C ATOM 879 CG2 ILE A 59 -3.407 4.306 0.178 1.00 0.00 C ATOM 880 CD1 ILE A 59 -6.478 4.901 1.102 1.00 0.00 C ATOM 0 H ILE A 59 -4.602 3.333 3.823 1.00 0.00 H new ATOM 0 HA ILE A 59 -3.720 1.856 1.505 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.161 4.762 2.111 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.735 3.105 0.168 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.056 2.935 1.882 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -3.900 5.151 -0.302 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -2.390 4.587 0.453 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -3.376 3.464 -0.513 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.519 4.663 0.883 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.415 5.394 2.072 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.088 5.566 0.331 1.00 0.00 H new ATOM 892 N ALA A 60 -1.578 3.895 2.950 1.00 0.00 N ATOM 893 CA ALA A 60 -0.159 4.141 3.144 1.00 0.00 C ATOM 894 C ALA A 60 0.515 2.858 3.632 1.00 0.00 C ATOM 895 O ALA A 60 1.564 2.470 3.120 1.00 0.00 O ATOM 896 CB ALA A 60 0.029 5.305 4.118 1.00 0.00 C ATOM 0 H ALA A 60 -2.194 4.581 3.386 1.00 0.00 H new ATOM 0 HA ALA A 60 0.313 4.424 2.203 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.093 5.489 4.263 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.442 6.200 3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.430 5.057 5.075 1.00 0.00 H new ATOM 902 N LEU A 61 -0.115 2.233 4.616 1.00 0.00 N ATOM 903 CA LEU A 61 0.411 1.001 5.179 1.00 0.00 C ATOM 904 C LEU A 61 0.800 0.052 4.044 1.00 0.00 C ATOM 905 O LEU A 61 1.978 -0.248 3.857 1.00 0.00 O ATOM 906 CB LEU A 61 -0.585 0.398 6.171 1.00 0.00 C ATOM 907 CG LEU A 61 -0.081 -0.795 6.986 1.00 0.00 C ATOM 908 CD1 LEU A 61 1.357 -0.568 7.458 1.00 0.00 C ATOM 909 CD2 LEU A 61 -1.025 -1.103 8.150 1.00 0.00 C ATOM 0 H LEU A 61 -0.985 2.557 5.038 1.00 0.00 H new ATOM 0 HA LEU A 61 1.316 1.200 5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.897 1.180 6.863 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.473 0.087 5.620 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.073 -1.672 6.339 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.691 -1.430 8.035 1.00 0.00 H new ATOM 0 HD12 LEU A 61 2.007 -0.436 6.593 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.398 0.324 8.083 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.643 -1.955 8.713 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.089 -0.235 8.806 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -2.016 -1.339 7.762 1.00 0.00 H new ATOM 921 N HIS A 62 -0.213 -0.393 3.315 1.00 0.00 N ATOM 922 CA HIS A 62 0.008 -1.302 2.203 1.00 0.00 C ATOM 923 C HIS A 62 0.907 -0.631 1.162 1.00 0.00 C ATOM 924 O HIS A 62 1.942 -1.178 0.785 1.00 0.00 O ATOM 925 CB HIS A 62 -1.323 -1.779 1.618 1.00 0.00 C ATOM 926 CG HIS A 62 -1.214 -2.338 0.219 1.00 0.00 C ATOM 927 ND1 HIS A 62 -1.376 -3.682 -0.066 1.00 0.00 N ATOM 928 CD2 HIS A 62 -0.959 -1.720 -0.970 1.00 0.00 C ATOM 929 CE1 HIS A 62 -1.222 -3.855 -1.370 1.00 0.00 C ATOM 930 NE2 HIS A 62 -0.963 -2.638 -1.929 1.00 0.00 N ATOM 0 H HIS A 62 -1.189 -0.141 3.473 1.00 0.00 H new ATOM 0 HA HIS A 62 0.524 -2.195 2.556 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.742 -2.543 2.272 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.025 -0.945 1.611 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.784 -0.663 -1.108 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.290 -4.795 -1.898 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.799 -2.462 -2.920 1.00 0.00 H new ATOM 938 N ASP A 63 0.478 0.545 0.728 1.00 0.00 N ATOM 939 CA ASP A 63 1.231 1.297 -0.262 1.00 0.00 C ATOM 940 C ASP A 63 2.726 1.180 0.044 1.00 0.00 C ATOM 941 O ASP A 63 3.529 0.933 -0.854 1.00 0.00 O ATOM 942 CB ASP A 63 0.856 2.780 -0.229 1.00 0.00 C ATOM 943 CG ASP A 63 1.156 3.552 -1.516 1.00 0.00 C ATOM 944 OD1 ASP A 63 2.290 3.399 -2.018 1.00 0.00 O ATOM 945 OD2 ASP A 63 0.244 4.277 -1.968 1.00 0.00 O ATOM 0 H ASP A 63 -0.381 0.996 1.043 1.00 0.00 H new ATOM 0 HA ASP A 63 0.998 0.888 -1.245 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.209 2.865 -0.012 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.388 3.256 0.595 1.00 0.00 H new ATOM 950 N CYS A 64 3.054 1.364 1.314 1.00 0.00 N ATOM 951 CA CYS A 64 4.437 1.282 1.749 1.00 0.00 C ATOM 952 C CYS A 64 4.894 -0.173 1.626 1.00 0.00 C ATOM 953 O CYS A 64 5.708 -0.501 0.764 1.00 0.00 O ATOM 954 CB CYS A 64 4.616 1.818 3.171 1.00 0.00 C ATOM 955 SG CYS A 64 5.565 3.382 3.136 1.00 0.00 S ATOM 0 H CYS A 64 2.385 1.570 2.056 1.00 0.00 H new ATOM 0 HA CYS A 64 5.059 1.912 1.113 1.00 0.00 H new ATOM 0 HB2 CYS A 64 3.642 1.984 3.631 1.00 0.00 H new ATOM 0 HB3 CYS A 64 5.136 1.081 3.783 1.00 0.00 H new ATOM 0 HG CYS A 64 5.314 4.066 4.212 1.00 0.00 H new ATOM 961 N ASN A 65 4.351 -1.006 2.501 1.00 0.00 N ATOM 962 CA ASN A 65 4.693 -2.419 2.501 1.00 0.00 C ATOM 963 C ASN A 65 4.025 -3.101 3.697 1.00 0.00 C ATOM 964 O ASN A 65 4.628 -3.954 4.346 1.00 0.00 O ATOM 965 CB ASN A 65 6.205 -2.620 2.627 1.00 0.00 C ATOM 966 CG ASN A 65 6.562 -4.107 2.631 1.00 0.00 C ATOM 967 OD1 ASN A 65 6.075 -4.891 1.833 1.00 0.00 O ATOM 968 ND2 ASN A 65 7.436 -4.451 3.572 1.00 0.00 N ATOM 0 H ASN A 65 3.677 -0.730 3.215 1.00 0.00 H new ATOM 0 HA ASN A 65 4.349 -2.849 1.560 1.00 0.00 H new ATOM 0 HB2 ASN A 65 6.712 -2.123 1.800 1.00 0.00 H new ATOM 0 HB3 ASN A 65 6.562 -2.154 3.545 1.00 0.00 H new ATOM 0 HD21 ASN A 65 7.738 -5.422 3.658 1.00 0.00 H new ATOM 0 HD22 ASN A 65 7.805 -3.744 4.208 1.00 0.00 H new ATOM 975 N GLY A 66 2.788 -2.699 3.951 1.00 0.00 N ATOM 976 CA GLY A 66 2.032 -3.261 5.057 1.00 0.00 C ATOM 977 C GLY A 66 2.781 -3.085 6.380 1.00 0.00 C ATOM 978 O GLY A 66 2.467 -3.747 7.368 1.00 0.00 O ATOM 0 H GLY A 66 2.291 -1.991 3.410 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.058 -2.776 5.119 1.00 0.00 H new ATOM 0 HA3 GLY A 66 1.850 -4.320 4.876 1.00 0.00 H new ATOM 982 N ASP A 67 3.756 -2.188 6.355 1.00 0.00 N ATOM 983 CA ASP A 67 4.552 -1.916 7.540 1.00 0.00 C ATOM 984 C ASP A 67 4.050 -0.631 8.202 1.00 0.00 C ATOM 985 O ASP A 67 3.817 0.369 7.526 1.00 0.00 O ATOM 986 CB ASP A 67 6.026 -1.718 7.180 1.00 0.00 C ATOM 987 CG ASP A 67 6.979 -2.766 7.757 1.00 0.00 C ATOM 988 OD1 ASP A 67 7.004 -2.886 9.001 1.00 0.00 O ATOM 989 OD2 ASP A 67 7.661 -3.424 6.942 1.00 0.00 O ATOM 0 H ASP A 67 4.013 -1.641 5.533 1.00 0.00 H new ATOM 0 HA ASP A 67 4.457 -2.768 8.213 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.123 -1.720 6.094 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.340 -0.733 7.527 1.00 0.00 H new ATOM 994 N VAL A 68 3.900 -0.701 9.517 1.00 0.00 N ATOM 995 CA VAL A 68 3.430 0.444 10.278 1.00 0.00 C ATOM 996 C VAL A 68 4.503 1.535 10.264 1.00 0.00 C ATOM 997 O VAL A 68 4.185 2.722 10.204 1.00 0.00 O ATOM 998 CB VAL A 68 3.039 0.008 11.692 1.00 0.00 C ATOM 999 CG1 VAL A 68 3.095 1.188 12.664 1.00 0.00 C ATOM 1000 CG2 VAL A 68 1.656 -0.646 11.701 1.00 0.00 C ATOM 0 H VAL A 68 4.096 -1.533 10.074 1.00 0.00 H new ATOM 0 HA VAL A 68 2.533 0.864 9.822 1.00 0.00 H new ATOM 0 HB VAL A 68 3.763 -0.735 12.026 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.813 0.851 13.662 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.108 1.590 12.690 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.404 1.964 12.334 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.402 -0.947 12.718 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.915 0.066 11.337 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.664 -1.524 11.055 1.00 0.00 H new ATOM 1010 N ASN A 69 5.751 1.094 10.320 1.00 0.00 N ATOM 1011 CA ASN A 69 6.872 2.018 10.314 1.00 0.00 C ATOM 1012 C ASN A 69 6.962 2.696 8.945 1.00 0.00 C ATOM 1013 O ASN A 69 6.782 3.908 8.836 1.00 0.00 O ATOM 1014 CB ASN A 69 8.191 1.285 10.565 1.00 0.00 C ATOM 1015 CG ASN A 69 9.087 2.079 11.518 1.00 0.00 C ATOM 1016 OD1 ASN A 69 10.191 2.479 11.185 1.00 0.00 O ATOM 1017 ND2 ASN A 69 8.553 2.284 12.718 1.00 0.00 N ATOM 0 H ASN A 69 6.011 0.109 10.370 1.00 0.00 H new ATOM 0 HA ASN A 69 6.709 2.750 11.105 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.989 0.300 10.986 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.709 1.128 9.619 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.073 2.804 13.425 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.624 1.922 12.931 1.00 0.00 H new ATOM 1024 N ARG A 70 7.239 1.885 7.935 1.00 0.00 N ATOM 1025 CA ARG A 70 7.354 2.391 6.578 1.00 0.00 C ATOM 1026 C ARG A 70 6.233 3.391 6.288 1.00 0.00 C ATOM 1027 O ARG A 70 6.446 4.384 5.594 1.00 0.00 O ATOM 1028 CB ARG A 70 7.290 1.253 5.558 1.00 0.00 C ATOM 1029 CG ARG A 70 8.671 0.629 5.346 1.00 0.00 C ATOM 1030 CD ARG A 70 9.044 0.615 3.862 1.00 0.00 C ATOM 1031 NE ARG A 70 9.846 -0.591 3.554 1.00 0.00 N ATOM 1032 CZ ARG A 70 11.161 -0.699 3.787 1.00 0.00 C ATOM 1033 NH1 ARG A 70 11.831 0.325 4.333 1.00 0.00 N ATOM 1034 NH2 ARG A 70 11.806 -1.831 3.475 1.00 0.00 N ATOM 0 H ARG A 70 7.387 0.880 8.029 1.00 0.00 H new ATOM 0 HA ARG A 70 8.320 2.888 6.490 1.00 0.00 H new ATOM 0 HB2 ARG A 70 6.591 0.490 5.902 1.00 0.00 H new ATOM 0 HB3 ARG A 70 6.908 1.631 4.610 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.418 1.191 5.907 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.678 -0.389 5.736 1.00 0.00 H new ATOM 0 HD2 ARG A 70 8.141 0.627 3.251 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.610 1.512 3.612 1.00 0.00 H new ATOM 0 HE ARG A 70 9.367 -1.390 3.138 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.340 1.187 4.571 1.00 0.00 H new ATOM 0 HH12 ARG A 70 12.832 0.243 4.510 1.00 0.00 H new ATOM 0 HH21 ARG A 70 11.296 -2.611 3.060 1.00 0.00 H new ATOM 0 HH22 ARG A 70 12.807 -1.913 3.652 1.00 0.00 H new ATOM 1048 N ALA A 71 5.062 3.093 6.833 1.00 0.00 N ATOM 1049 CA ALA A 71 3.907 3.953 6.641 1.00 0.00 C ATOM 1050 C ALA A 71 4.166 5.305 7.310 1.00 0.00 C ATOM 1051 O ALA A 71 4.124 6.344 6.654 1.00 0.00 O ATOM 1052 CB ALA A 71 2.658 3.261 7.189 1.00 0.00 C ATOM 0 H ALA A 71 4.889 2.268 7.407 1.00 0.00 H new ATOM 0 HA ALA A 71 3.738 4.137 5.580 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.792 3.906 7.045 1.00 0.00 H new ATOM 0 HB2 ALA A 71 2.502 2.320 6.661 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.789 3.062 8.253 1.00 0.00 H new ATOM 1058 N ILE A 72 4.428 5.246 8.608 1.00 0.00 N ATOM 1059 CA ILE A 72 4.693 6.452 9.373 1.00 0.00 C ATOM 1060 C ILE A 72 5.584 7.387 8.551 1.00 0.00 C ATOM 1061 O ILE A 72 5.383 8.600 8.551 1.00 0.00 O ATOM 1062 CB ILE A 72 5.272 6.100 10.745 1.00 0.00 C ATOM 1063 CG1 ILE A 72 4.210 5.455 11.638 1.00 0.00 C ATOM 1064 CG2 ILE A 72 5.907 7.327 11.403 1.00 0.00 C ATOM 1065 CD1 ILE A 72 4.854 4.537 12.679 1.00 0.00 C ATOM 0 H ILE A 72 4.462 4.382 9.149 1.00 0.00 H new ATOM 0 HA ILE A 72 3.765 6.988 9.572 1.00 0.00 H new ATOM 0 HB ILE A 72 6.064 5.365 10.604 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.632 6.231 12.140 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.513 4.883 11.025 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.311 7.050 12.377 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.711 7.704 10.771 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.152 8.103 11.531 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.078 4.091 13.301 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.412 3.748 12.174 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.532 5.117 13.305 1.00 0.00 H new ATOM 1077 N ASN A 73 6.548 6.785 7.870 1.00 0.00 N ATOM 1078 CA ASN A 73 7.470 7.549 7.046 1.00 0.00 C ATOM 1079 C ASN A 73 6.675 8.411 6.064 1.00 0.00 C ATOM 1080 O ASN A 73 6.924 9.610 5.942 1.00 0.00 O ATOM 1081 CB ASN A 73 8.378 6.623 6.234 1.00 0.00 C ATOM 1082 CG ASN A 73 9.847 6.827 6.612 1.00 0.00 C ATOM 1083 OD1 ASN A 73 10.560 7.627 6.028 1.00 0.00 O ATOM 1084 ND2 ASN A 73 10.258 6.061 7.618 1.00 0.00 N ATOM 0 H ASN A 73 6.711 5.778 7.872 1.00 0.00 H new ATOM 0 HA ASN A 73 8.080 8.166 7.705 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.095 5.585 6.408 1.00 0.00 H new ATOM 0 HB3 ASN A 73 8.242 6.816 5.170 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.222 6.122 7.945 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.609 5.412 8.063 1.00 0.00 H new ATOM 1091 N VAL A 74 5.733 7.768 5.389 1.00 0.00 N ATOM 1092 CA VAL A 74 4.900 8.462 4.421 1.00 0.00 C ATOM 1093 C VAL A 74 3.813 9.245 5.160 1.00 0.00 C ATOM 1094 O VAL A 74 3.628 10.437 4.918 1.00 0.00 O ATOM 1095 CB VAL A 74 4.335 7.465 3.407 1.00 0.00 C ATOM 1096 CG1 VAL A 74 3.495 8.179 2.347 1.00 0.00 C ATOM 1097 CG2 VAL A 74 5.455 6.647 2.761 1.00 0.00 C ATOM 0 H VAL A 74 5.528 6.774 5.493 1.00 0.00 H new ATOM 0 HA VAL A 74 5.491 9.182 3.854 1.00 0.00 H new ATOM 0 HB VAL A 74 3.683 6.775 3.942 1.00 0.00 H new ATOM 0 HG11 VAL A 74 3.105 7.448 1.639 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.665 8.696 2.828 1.00 0.00 H new ATOM 0 HG13 VAL A 74 4.115 8.902 1.818 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.027 5.946 2.044 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.144 7.317 2.246 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.993 6.095 3.531 1.00 0.00 H new ATOM 1107 N LEU A 75 3.121 8.543 6.046 1.00 0.00 N ATOM 1108 CA LEU A 75 2.057 9.157 6.821 1.00 0.00 C ATOM 1109 C LEU A 75 2.536 10.507 7.357 1.00 0.00 C ATOM 1110 O LEU A 75 1.958 11.546 7.040 1.00 0.00 O ATOM 1111 CB LEU A 75 1.568 8.201 7.911 1.00 0.00 C ATOM 1112 CG LEU A 75 0.360 7.334 7.550 1.00 0.00 C ATOM 1113 CD1 LEU A 75 0.162 6.216 8.576 1.00 0.00 C ATOM 1114 CD2 LEU A 75 -0.898 8.188 7.382 1.00 0.00 C ATOM 0 H LEU A 75 3.277 7.555 6.244 1.00 0.00 H new ATOM 0 HA LEU A 75 1.191 9.354 6.190 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.393 7.544 8.187 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.318 8.787 8.795 1.00 0.00 H new ATOM 0 HG LEU A 75 0.556 6.858 6.589 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.703 5.614 8.296 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.050 5.585 8.602 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -0.002 6.652 9.562 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.741 7.547 7.126 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.110 8.711 8.315 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.740 8.916 6.586 1.00 0.00 H new ATOM 1126 N LEU A 76 3.589 10.449 8.160 1.00 0.00 N ATOM 1127 CA LEU A 76 4.152 11.655 8.743 1.00 0.00 C ATOM 1128 C LEU A 76 4.308 12.718 7.655 1.00 0.00 C ATOM 1129 O LEU A 76 3.701 13.786 7.733 1.00 0.00 O ATOM 1130 CB LEU A 76 5.454 11.335 9.481 1.00 0.00 C ATOM 1131 CG LEU A 76 5.303 10.684 10.857 1.00 0.00 C ATOM 1132 CD1 LEU A 76 6.658 10.222 11.397 1.00 0.00 C ATOM 1133 CD2 LEU A 76 4.587 11.622 11.832 1.00 0.00 C ATOM 0 H LEU A 76 4.067 9.586 8.420 1.00 0.00 H new ATOM 0 HA LEU A 76 3.478 12.065 9.495 1.00 0.00 H new ATOM 0 HB2 LEU A 76 6.052 10.675 8.852 1.00 0.00 H new ATOM 0 HB3 LEU A 76 6.018 12.260 9.599 1.00 0.00 H new ATOM 0 HG LEU A 76 4.680 9.796 10.748 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.522 9.763 12.376 1.00 0.00 H new ATOM 0 HD12 LEU A 76 7.094 9.494 10.712 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.325 11.079 11.488 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.493 11.135 12.803 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.163 12.541 11.942 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.595 11.859 11.447 1.00 0.00 H new ATOM 1145 N GLU A 77 5.124 12.390 6.664 1.00 0.00 N ATOM 1146 CA GLU A 77 5.367 13.304 5.560 1.00 0.00 C ATOM 1147 C GLU A 77 4.051 13.927 5.087 1.00 0.00 C ATOM 1148 O GLU A 77 3.901 15.147 5.093 1.00 0.00 O ATOM 1149 CB GLU A 77 6.083 12.595 4.409 1.00 0.00 C ATOM 1150 CG GLU A 77 7.450 13.228 4.142 1.00 0.00 C ATOM 1151 CD GLU A 77 7.302 14.567 3.417 1.00 0.00 C ATOM 1152 OE1 GLU A 77 6.839 14.536 2.256 1.00 0.00 O ATOM 1153 OE2 GLU A 77 7.656 15.592 4.040 1.00 0.00 O ATOM 0 H GLU A 77 5.625 11.504 6.602 1.00 0.00 H new ATOM 0 HA GLU A 77 6.019 14.103 5.912 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.208 11.539 4.649 1.00 0.00 H new ATOM 0 HB3 GLU A 77 5.472 12.647 3.508 1.00 0.00 H new ATOM 0 HG2 GLU A 77 7.976 13.377 5.085 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.057 12.551 3.542 1.00 0.00 H new ATOM 1160 N GLY A 78 3.132 13.059 4.690 1.00 0.00 N ATOM 1161 CA GLY A 78 1.835 13.508 4.215 1.00 0.00 C ATOM 1162 C GLY A 78 1.965 14.250 2.883 1.00 0.00 C ATOM 1163 O GLY A 78 2.264 15.443 2.860 1.00 0.00 O ATOM 0 H GLY A 78 3.260 12.047 4.688 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.171 12.652 4.095 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.379 14.163 4.957 1.00 0.00 H new ATOM 1167 N ASN A 79 1.734 13.513 1.807 1.00 0.00 N ATOM 1168 CA ASN A 79 1.822 14.086 0.474 1.00 0.00 C ATOM 1169 C ASN A 79 0.482 13.909 -0.242 1.00 0.00 C ATOM 1170 O ASN A 79 -0.100 12.826 -0.219 1.00 0.00 O ATOM 1171 CB ASN A 79 2.899 13.385 -0.357 1.00 0.00 C ATOM 1172 CG ASN A 79 4.280 13.557 0.278 1.00 0.00 C ATOM 1173 OD1 ASN A 79 4.668 12.840 1.186 1.00 0.00 O ATOM 1174 ND2 ASN A 79 4.999 14.544 -0.248 1.00 0.00 N ATOM 0 H ASN A 79 1.486 12.524 1.831 1.00 0.00 H new ATOM 0 HA ASN A 79 2.076 15.141 0.577 1.00 0.00 H new ATOM 0 HB2 ASN A 79 2.664 12.324 -0.443 1.00 0.00 H new ATOM 0 HB3 ASN A 79 2.906 13.793 -1.368 1.00 0.00 H new ATOM 0 HD21 ASN A 79 5.935 14.738 0.107 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.614 15.107 -1.007 1.00 0.00 H new ATOM 1181 N PRO A 80 0.019 15.018 -0.878 1.00 0.00 N ATOM 1182 CA PRO A 80 -1.241 14.996 -1.600 1.00 0.00 C ATOM 1183 C PRO A 80 -1.099 14.250 -2.929 1.00 0.00 C ATOM 1184 O PRO A 80 -1.400 14.800 -3.988 1.00 0.00 O ATOM 1185 CB PRO A 80 -1.620 16.457 -1.776 1.00 0.00 C ATOM 1186 CG PRO A 80 -0.340 17.248 -1.562 1.00 0.00 C ATOM 1187 CD PRO A 80 0.682 16.318 -0.928 1.00 0.00 C ATOM 0 HA PRO A 80 -2.023 14.458 -1.064 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -2.029 16.637 -2.770 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -2.386 16.751 -1.058 1.00 0.00 H new ATOM 0 HG2 PRO A 80 0.033 17.635 -2.510 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -0.526 18.107 -0.918 1.00 0.00 H new ATOM 0 HD2 PRO A 80 1.597 16.273 -1.519 1.00 0.00 H new ATOM 0 HD3 PRO A 80 0.962 16.658 0.069 1.00 0.00 H new ATOM 1195 N ASP A 81 -0.641 13.011 -2.830 1.00 0.00 N ATOM 1196 CA ASP A 81 -0.456 12.185 -4.010 1.00 0.00 C ATOM 1197 C ASP A 81 0.618 12.812 -4.902 1.00 0.00 C ATOM 1198 O ASP A 81 0.301 13.524 -5.854 1.00 0.00 O ATOM 1199 CB ASP A 81 -1.748 12.088 -4.823 1.00 0.00 C ATOM 1200 CG ASP A 81 -1.881 10.826 -5.679 1.00 0.00 C ATOM 1201 OD1 ASP A 81 -1.131 10.734 -6.674 1.00 0.00 O ATOM 1202 OD2 ASP A 81 -2.730 9.983 -5.318 1.00 0.00 O ATOM 0 H ASP A 81 -0.392 12.559 -1.950 1.00 0.00 H new ATOM 0 HA ASP A 81 -0.162 11.188 -3.681 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -2.595 12.135 -4.138 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.816 12.959 -5.474 1.00 0.00 H new ATOM 1207 N THR A 82 1.866 12.524 -4.563 1.00 0.00 N ATOM 1208 CA THR A 82 2.988 13.051 -5.321 1.00 0.00 C ATOM 1209 C THR A 82 4.115 12.019 -5.391 1.00 0.00 C ATOM 1210 O THR A 82 5.129 12.155 -4.707 1.00 0.00 O ATOM 1211 CB THR A 82 3.413 14.373 -4.680 1.00 0.00 C ATOM 1212 OG1 THR A 82 2.543 15.339 -5.266 1.00 0.00 O ATOM 1213 CG2 THR A 82 4.810 14.815 -5.120 1.00 0.00 C ATOM 0 H THR A 82 2.125 11.932 -3.773 1.00 0.00 H new ATOM 0 HA THR A 82 2.708 13.251 -6.355 1.00 0.00 H new ATOM 0 HB THR A 82 3.389 14.274 -3.595 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.773 14.885 -5.667 1.00 0.00 H new ATOM 0 HG21 THR A 82 5.062 15.758 -4.636 1.00 0.00 H new ATOM 0 HG22 THR A 82 5.538 14.055 -4.836 1.00 0.00 H new ATOM 0 HG23 THR A 82 4.826 14.947 -6.202 1.00 0.00 H new ATOM 1221 N HIS A 83 3.901 11.011 -6.223 1.00 0.00 N ATOM 1222 CA HIS A 83 4.887 9.956 -6.390 1.00 0.00 C ATOM 1223 C HIS A 83 5.236 9.812 -7.873 1.00 0.00 C ATOM 1224 O HIS A 83 4.384 9.452 -8.683 1.00 0.00 O ATOM 1225 CB HIS A 83 4.395 8.649 -5.767 1.00 0.00 C ATOM 1226 CG HIS A 83 3.771 8.815 -4.402 1.00 0.00 C ATOM 1227 ND1 HIS A 83 2.540 9.419 -4.209 1.00 0.00 N ATOM 1228 CD2 HIS A 83 4.219 8.451 -3.166 1.00 0.00 C ATOM 1229 CE1 HIS A 83 2.271 9.413 -2.912 1.00 0.00 C ATOM 1230 NE2 HIS A 83 3.313 8.813 -2.267 1.00 0.00 N ATOM 0 H HIS A 83 3.060 10.902 -6.789 1.00 0.00 H new ATOM 0 HA HIS A 83 5.802 10.220 -5.860 1.00 0.00 H new ATOM 0 HB2 HIS A 83 3.665 8.192 -6.435 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.234 7.957 -5.690 1.00 0.00 H new ATOM 0 HD2 HIS A 83 5.153 7.952 -2.955 1.00 0.00 H new ATOM 0 HE1 HIS A 83 1.382 9.813 -2.446 1.00 0.00 H new ATOM 0 HE2 HIS A 83 3.384 8.667 -1.260 1.00 0.00 H new ATOM 1238 N SER A 84 6.492 10.100 -8.183 1.00 0.00 N ATOM 1239 CA SER A 84 6.965 10.006 -9.553 1.00 0.00 C ATOM 1240 C SER A 84 6.853 8.563 -10.048 1.00 0.00 C ATOM 1241 O SER A 84 7.700 7.728 -9.735 1.00 0.00 O ATOM 1242 CB SER A 84 8.409 10.498 -9.673 1.00 0.00 C ATOM 1243 OG SER A 84 8.552 11.845 -9.231 1.00 0.00 O ATOM 0 H SER A 84 7.196 10.399 -7.508 1.00 0.00 H new ATOM 0 HA SER A 84 6.339 10.646 -10.175 1.00 0.00 H new ATOM 0 HB2 SER A 84 9.062 9.852 -9.086 1.00 0.00 H new ATOM 0 HB3 SER A 84 8.733 10.420 -10.711 1.00 0.00 H new ATOM 0 HG SER A 84 9.488 12.121 -9.322 1.00 0.00 H new ATOM 1249 N TRP A 85 5.800 8.313 -10.813 1.00 0.00 N ATOM 1250 CA TRP A 85 5.567 6.985 -11.354 1.00 0.00 C ATOM 1251 C TRP A 85 6.880 6.482 -11.957 1.00 0.00 C ATOM 1252 O TRP A 85 7.782 7.272 -12.235 1.00 0.00 O ATOM 1253 CB TRP A 85 4.414 6.998 -12.360 1.00 0.00 C ATOM 1254 CG TRP A 85 3.159 6.267 -11.878 1.00 0.00 C ATOM 1255 CD1 TRP A 85 2.101 6.781 -11.237 1.00 0.00 C ATOM 1256 CD2 TRP A 85 2.874 4.860 -12.025 1.00 0.00 C ATOM 1257 NE1 TRP A 85 1.157 5.812 -10.962 1.00 0.00 N ATOM 1258 CE2 TRP A 85 1.642 4.607 -11.456 1.00 0.00 C ATOM 1259 CE3 TRP A 85 3.631 3.835 -12.619 1.00 0.00 C ATOM 1260 CZ2 TRP A 85 1.059 3.335 -11.425 1.00 0.00 C ATOM 1261 CZ3 TRP A 85 3.034 2.570 -12.580 1.00 0.00 C ATOM 1262 CH2 TRP A 85 1.795 2.298 -12.011 1.00 0.00 C ATOM 0 H TRP A 85 5.099 9.008 -11.071 1.00 0.00 H new ATOM 0 HA TRP A 85 5.260 6.297 -10.567 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.155 8.032 -12.587 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.752 6.543 -13.291 1.00 0.00 H new ATOM 0 HD1 TRP A 85 1.999 7.822 -10.969 1.00 0.00 H new ATOM 0 HE1 TRP A 85 0.267 5.954 -10.484 1.00 0.00 H new ATOM 0 HE3 TRP A 85 4.597 4.010 -13.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 0.093 3.163 -10.973 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 3.574 1.747 -13.023 1.00 0.00 H new ATOM 0 HH2 TRP A 85 1.402 1.292 -12.021 1.00 0.00 H new ATOM 1273 N GLU A 86 6.947 5.172 -12.141 1.00 0.00 N ATOM 1274 CA GLU A 86 8.135 4.555 -12.705 1.00 0.00 C ATOM 1275 C GLU A 86 9.391 5.094 -12.018 1.00 0.00 C ATOM 1276 O GLU A 86 10.128 5.890 -12.598 1.00 0.00 O ATOM 1277 CB GLU A 86 8.201 4.775 -14.218 1.00 0.00 C ATOM 1278 CG GLU A 86 8.098 3.446 -14.970 1.00 0.00 C ATOM 1279 CD GLU A 86 6.703 3.264 -15.571 1.00 0.00 C ATOM 1280 OE1 GLU A 86 6.359 4.070 -16.462 1.00 0.00 O ATOM 1281 OE2 GLU A 86 6.012 2.322 -15.126 1.00 0.00 O ATOM 0 H GLU A 86 6.197 4.520 -11.909 1.00 0.00 H new ATOM 0 HA GLU A 86 8.081 3.481 -12.528 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.392 5.436 -14.529 1.00 0.00 H new ATOM 0 HB3 GLU A 86 9.136 5.272 -14.476 1.00 0.00 H new ATOM 0 HG2 GLU A 86 8.846 3.413 -15.762 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.316 2.622 -14.291 1.00 0.00 H new ATOM 1288 N MET A 87 9.596 4.639 -10.790 1.00 0.00 N ATOM 1289 CA MET A 87 10.750 5.066 -10.017 1.00 0.00 C ATOM 1290 C MET A 87 10.881 4.249 -8.730 1.00 0.00 C ATOM 1291 O MET A 87 10.168 4.496 -7.759 1.00 0.00 O ATOM 1292 CB MET A 87 10.611 6.549 -9.669 1.00 0.00 C ATOM 1293 CG MET A 87 11.867 7.326 -10.070 1.00 0.00 C ATOM 1294 SD MET A 87 12.564 8.139 -8.642 1.00 0.00 S ATOM 1295 CE MET A 87 13.243 9.597 -9.416 1.00 0.00 C ATOM 0 H MET A 87 8.983 3.979 -10.312 1.00 0.00 H new ATOM 0 HA MET A 87 11.645 4.907 -10.618 1.00 0.00 H new ATOM 0 HB2 MET A 87 9.743 6.966 -10.179 1.00 0.00 H new ATOM 0 HB3 MET A 87 10.436 6.660 -8.599 1.00 0.00 H new ATOM 0 HG2 MET A 87 12.600 6.648 -10.507 1.00 0.00 H new ATOM 0 HG3 MET A 87 11.620 8.063 -10.834 1.00 0.00 H new ATOM 0 HE1 MET A 87 13.720 10.221 -8.660 1.00 0.00 H new ATOM 0 HE2 MET A 87 13.981 9.303 -10.162 1.00 0.00 H new ATOM 0 HE3 MET A 87 12.443 10.159 -9.899 1.00 0.00 H new ATOM 1305 N VAL A 88 11.796 3.292 -8.765 1.00 0.00 N ATOM 1306 CA VAL A 88 12.029 2.437 -7.613 1.00 0.00 C ATOM 1307 C VAL A 88 13.536 2.291 -7.388 1.00 0.00 C ATOM 1308 O VAL A 88 14.264 1.875 -8.288 1.00 0.00 O ATOM 1309 CB VAL A 88 11.321 1.094 -7.806 1.00 0.00 C ATOM 1310 CG1 VAL A 88 11.981 0.282 -8.922 1.00 0.00 C ATOM 1311 CG2 VAL A 88 11.284 0.301 -6.498 1.00 0.00 C ATOM 0 H VAL A 88 12.385 3.089 -9.573 1.00 0.00 H new ATOM 0 HA VAL A 88 11.607 2.885 -6.713 1.00 0.00 H new ATOM 0 HB VAL A 88 10.292 1.297 -8.103 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.459 -0.668 -9.039 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.931 0.841 -9.857 1.00 0.00 H new ATOM 0 HG13 VAL A 88 13.024 0.094 -8.667 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.776 -0.649 -6.663 1.00 0.00 H new ATOM 0 HG22 VAL A 88 12.302 0.113 -6.157 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.748 0.873 -5.741 1.00 0.00 H new ATOM 1321 N GLY A 89 13.958 2.641 -6.182 1.00 0.00 N ATOM 1322 CA GLY A 89 15.365 2.554 -5.828 1.00 0.00 C ATOM 1323 C GLY A 89 16.211 3.469 -6.715 1.00 0.00 C ATOM 1324 O GLY A 89 16.203 4.687 -6.544 1.00 0.00 O ATOM 0 H GLY A 89 13.351 2.985 -5.438 1.00 0.00 H new ATOM 0 HA2 GLY A 89 15.498 2.831 -4.782 1.00 0.00 H new ATOM 0 HA3 GLY A 89 15.707 1.524 -5.931 1.00 0.00 H new ATOM 1328 N LYS A 90 16.921 2.846 -7.644 1.00 0.00 N ATOM 1329 CA LYS A 90 17.772 3.589 -8.559 1.00 0.00 C ATOM 1330 C LYS A 90 18.341 2.633 -9.610 1.00 0.00 C ATOM 1331 O LYS A 90 18.845 1.563 -9.272 1.00 0.00 O ATOM 1332 CB LYS A 90 18.843 4.362 -7.787 1.00 0.00 C ATOM 1333 CG LYS A 90 19.423 5.493 -8.638 1.00 0.00 C ATOM 1334 CD LYS A 90 19.370 6.826 -7.888 1.00 0.00 C ATOM 1335 CE LYS A 90 18.341 7.768 -8.516 1.00 0.00 C ATOM 1336 NZ LYS A 90 17.133 7.857 -7.666 1.00 0.00 N ATOM 0 H LYS A 90 16.925 1.836 -7.783 1.00 0.00 H new ATOM 0 HA LYS A 90 17.191 4.341 -9.093 1.00 0.00 H new ATOM 0 HB2 LYS A 90 18.413 4.773 -6.874 1.00 0.00 H new ATOM 0 HB3 LYS A 90 19.641 3.683 -7.486 1.00 0.00 H new ATOM 0 HG2 LYS A 90 20.455 5.261 -8.903 1.00 0.00 H new ATOM 0 HG3 LYS A 90 18.865 5.574 -9.571 1.00 0.00 H new ATOM 0 HD2 LYS A 90 19.116 6.649 -6.843 1.00 0.00 H new ATOM 0 HD3 LYS A 90 20.354 7.295 -7.902 1.00 0.00 H new ATOM 0 HE2 LYS A 90 18.777 8.759 -8.644 1.00 0.00 H new ATOM 0 HE3 LYS A 90 18.069 7.409 -9.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.445 8.500 -8.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 16.709 6.913 -7.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 17.395 8.221 -6.728 1.00 0.00 H new ATOM 1350 N LYS A 91 18.240 3.054 -10.862 1.00 0.00 N ATOM 1351 CA LYS A 91 18.739 2.249 -11.964 1.00 0.00 C ATOM 1352 C LYS A 91 17.983 0.919 -12.001 1.00 0.00 C ATOM 1353 O LYS A 91 18.346 -0.025 -11.300 1.00 0.00 O ATOM 1354 CB LYS A 91 20.258 2.091 -11.868 1.00 0.00 C ATOM 1355 CG LYS A 91 20.973 3.169 -12.684 1.00 0.00 C ATOM 1356 CD LYS A 91 22.453 3.251 -12.305 1.00 0.00 C ATOM 1357 CE LYS A 91 22.689 4.331 -11.247 1.00 0.00 C ATOM 1358 NZ LYS A 91 24.138 4.575 -11.068 1.00 0.00 N ATOM 0 H LYS A 91 17.820 3.942 -11.138 1.00 0.00 H new ATOM 0 HA LYS A 91 18.554 2.748 -12.915 1.00 0.00 H new ATOM 0 HB2 LYS A 91 20.569 2.153 -10.825 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.548 1.104 -12.229 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.878 2.949 -13.747 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.496 4.135 -12.515 1.00 0.00 H new ATOM 0 HD2 LYS A 91 22.789 2.286 -11.926 1.00 0.00 H new ATOM 0 HD3 LYS A 91 23.048 3.470 -13.192 1.00 0.00 H new ATOM 0 HE2 LYS A 91 22.193 5.255 -11.545 1.00 0.00 H new ATOM 0 HE3 LYS A 91 22.247 4.023 -10.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 24.280 5.311 -10.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 24.603 3.696 -10.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 24.551 4.890 -11.969 1.00 0.00 H new ATOM 1372 N LYS A 92 16.946 0.886 -12.824 1.00 0.00 N ATOM 1373 CA LYS A 92 16.136 -0.312 -12.961 1.00 0.00 C ATOM 1374 C LYS A 92 15.969 -0.643 -14.446 1.00 0.00 C ATOM 1375 O LYS A 92 15.928 0.256 -15.285 1.00 0.00 O ATOM 1376 CB LYS A 92 14.810 -0.152 -12.214 1.00 0.00 C ATOM 1377 CG LYS A 92 14.507 -1.387 -11.364 1.00 0.00 C ATOM 1378 CD LYS A 92 13.915 -2.509 -12.219 1.00 0.00 C ATOM 1379 CE LYS A 92 14.658 -3.826 -11.985 1.00 0.00 C ATOM 1380 NZ LYS A 92 14.436 -4.754 -13.117 1.00 0.00 N ATOM 0 H LYS A 92 16.648 1.671 -13.403 1.00 0.00 H new ATOM 0 HA LYS A 92 16.635 -1.163 -12.498 1.00 0.00 H new ATOM 0 HB2 LYS A 92 14.852 0.731 -11.577 1.00 0.00 H new ATOM 0 HB3 LYS A 92 14.003 0.009 -12.929 1.00 0.00 H new ATOM 0 HG2 LYS A 92 15.421 -1.735 -10.883 1.00 0.00 H new ATOM 0 HG3 LYS A 92 13.809 -1.124 -10.569 1.00 0.00 H new ATOM 0 HD2 LYS A 92 12.859 -2.635 -11.979 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.972 -2.237 -13.273 1.00 0.00 H new ATOM 0 HE2 LYS A 92 15.724 -3.633 -11.869 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.314 -4.285 -11.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.982 -5.623 -12.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 13.821 -4.300 -13.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.349 -4.992 -13.555 1.00 0.00 H new ATOM 1394 N GLY A 93 15.877 -1.935 -14.725 1.00 0.00 N ATOM 1395 CA GLY A 93 15.716 -2.395 -16.093 1.00 0.00 C ATOM 1396 C GLY A 93 14.511 -3.330 -16.219 1.00 0.00 C ATOM 1397 O GLY A 93 13.442 -3.046 -15.681 1.00 0.00 O ATOM 0 H GLY A 93 15.911 -2.678 -14.026 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.587 -1.539 -16.756 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.619 -2.914 -16.415 1.00 0.00 H new ATOM 1401 N VAL A 94 14.724 -4.425 -16.933 1.00 0.00 N ATOM 1402 CA VAL A 94 13.669 -5.404 -17.136 1.00 0.00 C ATOM 1403 C VAL A 94 12.348 -4.676 -17.394 1.00 0.00 C ATOM 1404 O VAL A 94 11.572 -4.445 -16.468 1.00 0.00 O ATOM 1405 CB VAL A 94 13.603 -6.358 -15.941 1.00 0.00 C ATOM 1406 CG1 VAL A 94 12.619 -7.499 -16.205 1.00 0.00 C ATOM 1407 CG2 VAL A 94 14.992 -6.900 -15.595 1.00 0.00 C ATOM 0 H VAL A 94 15.612 -4.656 -17.379 1.00 0.00 H new ATOM 0 HA VAL A 94 13.879 -6.017 -18.012 1.00 0.00 H new ATOM 0 HB VAL A 94 13.240 -5.795 -15.081 1.00 0.00 H new ATOM 0 HG11 VAL A 94 12.591 -8.163 -15.341 1.00 0.00 H new ATOM 0 HG12 VAL A 94 11.624 -7.089 -16.380 1.00 0.00 H new ATOM 0 HG13 VAL A 94 12.940 -8.060 -17.083 1.00 0.00 H new ATOM 0 HG21 VAL A 94 14.917 -7.575 -14.743 1.00 0.00 H new ATOM 0 HG22 VAL A 94 15.396 -7.440 -16.451 1.00 0.00 H new ATOM 0 HG23 VAL A 94 15.654 -6.071 -15.344 1.00 0.00 H new ATOM 1417 N SER A 95 12.133 -4.336 -18.656 1.00 0.00 N ATOM 1418 CA SER A 95 10.920 -3.640 -19.047 1.00 0.00 C ATOM 1419 C SER A 95 10.786 -3.638 -20.571 1.00 0.00 C ATOM 1420 O SER A 95 11.226 -2.700 -21.235 1.00 0.00 O ATOM 1421 CB SER A 95 10.910 -2.207 -18.511 1.00 0.00 C ATOM 1422 OG SER A 95 10.174 -2.096 -17.296 1.00 0.00 O ATOM 0 H SER A 95 12.779 -4.530 -19.421 1.00 0.00 H new ATOM 0 HA SER A 95 10.069 -4.166 -18.615 1.00 0.00 H new ATOM 0 HB2 SER A 95 11.935 -1.875 -18.346 1.00 0.00 H new ATOM 0 HB3 SER A 95 10.477 -1.543 -19.259 1.00 0.00 H new ATOM 0 HG SER A 95 10.424 -2.828 -16.694 1.00 0.00 H new ATOM 1428 N GLY A 96 10.176 -4.698 -21.081 1.00 0.00 N ATOM 1429 CA GLY A 96 9.979 -4.830 -22.515 1.00 0.00 C ATOM 1430 C GLY A 96 8.727 -4.076 -22.968 1.00 0.00 C ATOM 1431 O GLY A 96 8.822 -3.084 -23.688 1.00 0.00 O ATOM 0 H GLY A 96 9.812 -5.473 -20.527 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.851 -4.444 -23.043 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.888 -5.884 -22.778 1.00 0.00 H new ATOM 1435 N GLN A 97 7.582 -4.577 -22.527 1.00 0.00 N ATOM 1436 CA GLN A 97 6.313 -3.963 -22.877 1.00 0.00 C ATOM 1437 C GLN A 97 5.284 -4.202 -21.770 1.00 0.00 C ATOM 1438 O GLN A 97 4.755 -3.252 -21.194 1.00 0.00 O ATOM 1439 CB GLN A 97 5.803 -4.487 -24.222 1.00 0.00 C ATOM 1440 CG GLN A 97 5.886 -3.404 -25.299 1.00 0.00 C ATOM 1441 CD GLN A 97 5.645 -3.994 -26.690 1.00 0.00 C ATOM 1442 OE1 GLN A 97 4.945 -4.979 -26.862 1.00 0.00 O ATOM 1443 NE2 GLN A 97 6.262 -3.340 -27.670 1.00 0.00 N ATOM 0 H GLN A 97 7.507 -5.401 -21.931 1.00 0.00 H new ATOM 0 HA GLN A 97 6.467 -2.889 -22.977 1.00 0.00 H new ATOM 0 HB2 GLN A 97 6.391 -5.353 -24.526 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.771 -4.823 -24.118 1.00 0.00 H new ATOM 0 HG2 GLN A 97 5.148 -2.628 -25.097 1.00 0.00 H new ATOM 0 HG3 GLN A 97 6.866 -2.928 -25.267 1.00 0.00 H new ATOM 0 HE21 GLN A 97 6.833 -2.522 -27.457 1.00 0.00 H new ATOM 0 HE22 GLN A 97 6.164 -3.656 -28.635 1.00 0.00 H new ATOM 1452 N LYS A 98 5.031 -5.475 -21.506 1.00 0.00 N ATOM 1453 CA LYS A 98 4.075 -5.851 -20.479 1.00 0.00 C ATOM 1454 C LYS A 98 2.671 -5.430 -20.916 1.00 0.00 C ATOM 1455 O LYS A 98 2.291 -4.269 -20.765 1.00 0.00 O ATOM 1456 CB LYS A 98 4.494 -5.280 -19.123 1.00 0.00 C ATOM 1457 CG LYS A 98 4.342 -6.326 -18.016 1.00 0.00 C ATOM 1458 CD LYS A 98 3.797 -5.693 -16.734 1.00 0.00 C ATOM 1459 CE LYS A 98 2.267 -5.701 -16.726 1.00 0.00 C ATOM 1460 NZ LYS A 98 1.760 -6.665 -15.724 1.00 0.00 N ATOM 0 H LYS A 98 5.472 -6.260 -21.986 1.00 0.00 H new ATOM 0 HA LYS A 98 4.058 -6.933 -20.352 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.530 -4.944 -19.171 1.00 0.00 H new ATOM 0 HB3 LYS A 98 3.886 -4.406 -18.889 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.671 -7.118 -18.349 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.307 -6.790 -17.815 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.172 -6.238 -15.867 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.159 -4.669 -16.647 1.00 0.00 H new ATOM 0 HE2 LYS A 98 1.893 -4.702 -16.500 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.893 -5.965 -17.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.720 -6.658 -15.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 2.102 -7.619 -15.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.101 -6.396 -14.779 1.00 0.00 H new ATOM 1474 N SER A 99 1.937 -6.395 -21.450 1.00 0.00 N ATOM 1475 CA SER A 99 0.583 -6.139 -21.911 1.00 0.00 C ATOM 1476 C SER A 99 0.612 -5.563 -23.328 1.00 0.00 C ATOM 1477 O SER A 99 -0.044 -6.085 -24.228 1.00 0.00 O ATOM 1478 CB SER A 99 -0.149 -5.184 -20.965 1.00 0.00 C ATOM 1479 OG SER A 99 -1.554 -5.422 -20.949 1.00 0.00 O ATOM 0 H SER A 99 2.255 -7.356 -21.574 1.00 0.00 H new ATOM 0 HA SER A 99 0.041 -7.085 -21.921 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.249 -5.296 -19.957 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.041 -4.155 -21.270 1.00 0.00 H new ATOM 0 HG SER A 99 -1.985 -4.794 -20.333 1.00 0.00 H new ATOM 1485 N GLY A 100 1.381 -4.495 -23.483 1.00 0.00 N ATOM 1486 CA GLY A 100 1.504 -3.843 -24.775 1.00 0.00 C ATOM 1487 C GLY A 100 0.498 -2.699 -24.911 1.00 0.00 C ATOM 1488 O GLY A 100 -0.523 -2.680 -24.224 1.00 0.00 O ATOM 0 H GLY A 100 1.925 -4.065 -22.735 1.00 0.00 H new ATOM 0 HA2 GLY A 100 2.516 -3.458 -24.897 1.00 0.00 H new ATOM 0 HA3 GLY A 100 1.342 -4.571 -25.570 1.00 0.00 H new ATOM 1492 N PRO A 101 0.828 -1.747 -25.824 1.00 0.00 N ATOM 1493 CA PRO A 101 -0.035 -0.602 -26.059 1.00 0.00 C ATOM 1494 C PRO A 101 -1.269 -1.003 -26.871 1.00 0.00 C ATOM 1495 O PRO A 101 -1.378 -2.143 -27.318 1.00 0.00 O ATOM 1496 CB PRO A 101 0.842 0.413 -26.773 1.00 0.00 C ATOM 1497 CG PRO A 101 2.022 -0.371 -27.325 1.00 0.00 C ATOM 1498 CD PRO A 101 2.028 -1.736 -26.656 1.00 0.00 C ATOM 0 HA PRO A 101 -0.436 -0.182 -25.137 1.00 0.00 H new ATOM 0 HB2 PRO A 101 0.293 0.908 -27.574 1.00 0.00 H new ATOM 0 HB3 PRO A 101 1.177 1.191 -26.087 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.938 -0.476 -28.407 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.956 0.155 -27.128 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.006 -2.538 -27.393 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.927 -1.879 -26.056 1.00 0.00 H new ATOM 1506 N SER A 102 -2.166 -0.042 -27.037 1.00 0.00 N ATOM 1507 CA SER A 102 -3.387 -0.280 -27.787 1.00 0.00 C ATOM 1508 C SER A 102 -3.366 0.521 -29.090 1.00 0.00 C ATOM 1509 O SER A 102 -2.540 1.417 -29.258 1.00 0.00 O ATOM 1510 CB SER A 102 -4.622 0.084 -26.960 1.00 0.00 C ATOM 1511 OG SER A 102 -5.422 -1.057 -26.664 1.00 0.00 O ATOM 0 H SER A 102 -2.071 0.903 -26.665 1.00 0.00 H new ATOM 0 HA SER A 102 -3.441 -1.343 -28.022 1.00 0.00 H new ATOM 0 HB2 SER A 102 -4.309 0.558 -26.030 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.220 0.815 -27.504 1.00 0.00 H new ATOM 0 HG SER A 102 -6.199 -0.783 -26.134 1.00 0.00 H new ATOM 1517 N SER A 103 -4.284 0.170 -29.978 1.00 0.00 N ATOM 1518 CA SER A 103 -4.380 0.846 -31.261 1.00 0.00 C ATOM 1519 C SER A 103 -4.834 2.293 -31.058 1.00 0.00 C ATOM 1520 O SER A 103 -6.007 2.548 -30.792 1.00 0.00 O ATOM 1521 CB SER A 103 -5.344 0.115 -32.198 1.00 0.00 C ATOM 1522 OG SER A 103 -4.818 -0.007 -33.516 1.00 0.00 O ATOM 0 H SER A 103 -4.968 -0.573 -29.835 1.00 0.00 H new ATOM 0 HA SER A 103 -3.393 0.843 -31.723 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.555 -0.877 -31.799 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.292 0.652 -32.234 1.00 0.00 H new ATOM 0 HG SER A 103 -5.462 -0.481 -34.083 1.00 0.00 H new ATOM 1528 N GLY A 104 -3.880 3.203 -31.190 1.00 0.00 N ATOM 1529 CA GLY A 104 -4.167 4.617 -31.024 1.00 0.00 C ATOM 1530 C GLY A 104 -4.603 5.248 -32.348 1.00 0.00 C ATOM 1531 O GLY A 104 -3.800 5.878 -33.034 1.00 0.00 O ATOM 0 H GLY A 104 -2.907 2.988 -31.410 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -4.952 4.747 -30.279 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -3.282 5.129 -30.647 1.00 0.00 H new TER 1535 GLY A 104