USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 952 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 133 GLN : amide:sc= -1.51 K(o=-0.89,f=0.68) USER MOD Set 1.2: A 137 THR OG1 : rot 157:sc= 0.616 USER MOD Set 2.1: A 131 ASN : amide:sc= -4.54! K(o=-4.2!,f=-0.44) USER MOD Set 2.2: A 134 SER OG : rot 180:sc= 0.294 USER MOD Set 3.1: A 46 HIS : no HD1:sc= -2.74 K(o=-12,f=-21!) USER MOD Set 3.2: A 48 HIS : no HD1:sc= -1.13 K(o=-12,f=-12) USER MOD Set 3.3: A 63 HIS : no HE2:sc= -3.5 K(o=-12,f=-14) USER MOD Set 3.4: A 65 ASN : amide:sc= -0.185 K(o=-12,f=-11) USER MOD Set 3.5: A 71 HIS : no HD1:sc= -3.84! C(o=-12!,f=-19!) USER MOD Set 3.6: A 80 HIS : no HD1:sc= -0.77 K(o=-12,f=-13) USER MOD Set 3.7: A 120 HIS : no HE2:sc= 0.0704 K(o=-12,f=-17!) USER MOD Set 4.1: A 15 GLN : amide:sc= -0.121 K(o=0.075,f=-2.3) USER MOD Set 4.2: A 36 LYS NZ :NH3+ 157:sc= 0.196 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 138:sc= 1.04 (180deg=0.65) USER MOD Single : A 9 LYS NZ :NH3+ -163:sc= -0.249 (180deg=-0.844) USER MOD Single : A 19 ASN : amide:sc= 0.0959 X(o=0.096,f=-0.14) USER MOD Single : A 30 LYS NZ :NH3+ 158:sc= 1.1 (180deg=-0.137!) USER MOD Single : A 34 SER OG : rot 30:sc= 0.0497 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= -2.85! C(o=-1!,f=-12!) USER MOD Single : A 68 SER OG : rot -16:sc= 0.481 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= -0.285 K(o=-0.29,f=-1.6) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 133:sc= 1.21 (180deg=0.428) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -45:sc= 0.5 USER MOD Single : A 105 SER OG : rot 34:sc= 0.76 USER MOD Single : A 110 HIS : no HD1:sc=-0.000935 X(o=-0.00093,f=-0.009) USER MOD Single : A 111 SER OG : rot 80:sc= 0.888 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 7:sc= 0.957 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.32 K(o=-0.32,f=-1.2) USER MOD Single : A 142 SER OG : rot 180:sc= 0.0869 USER MOD Single : A 146 CYS SG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 27 N LYS A 3 12.842 6.797 11.242 1.00 0.00 N ATOM 28 CA LYS A 3 12.067 5.723 10.659 1.00 0.00 C ATOM 29 C LYS A 3 10.601 6.082 10.897 1.00 0.00 C ATOM 30 O LYS A 3 10.269 6.636 11.948 1.00 0.00 O ATOM 31 CB LYS A 3 12.494 4.380 11.279 1.00 0.00 C ATOM 32 CG LYS A 3 12.090 4.281 12.755 1.00 0.00 C ATOM 33 CD LYS A 3 12.973 3.324 13.564 1.00 0.00 C ATOM 34 CE LYS A 3 12.506 3.231 15.030 1.00 0.00 C ATOM 35 NZ LYS A 3 12.703 4.478 15.802 1.00 0.00 N ATOM 0 HA LYS A 3 12.230 5.606 9.588 1.00 0.00 H new ATOM 0 HB2 LYS A 3 12.039 3.561 10.722 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.574 4.265 11.189 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.136 5.273 13.204 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.054 3.949 12.819 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.950 2.333 13.110 1.00 0.00 H new ATOM 0 HD3 LYS A 3 14.008 3.666 13.531 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.449 2.967 15.048 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.045 2.421 15.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 11.867 4.655 16.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.543 4.382 16.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 12.837 5.274 15.147 1.00 0.00 H new ATOM 49 N ALA A 4 9.749 5.819 9.913 1.00 0.00 N ATOM 50 CA ALA A 4 8.318 6.046 9.980 1.00 0.00 C ATOM 51 C ALA A 4 7.602 4.717 10.159 1.00 0.00 C ATOM 52 O ALA A 4 8.185 3.657 9.933 1.00 0.00 O ATOM 53 CB ALA A 4 7.843 6.798 8.734 1.00 0.00 C ATOM 0 H ALA A 4 10.049 5.429 9.019 1.00 0.00 H new ATOM 0 HA ALA A 4 8.080 6.671 10.840 1.00 0.00 H new ATOM 0 HB1 ALA A 4 6.767 6.962 8.796 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.354 7.759 8.672 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.069 6.209 7.845 1.00 0.00 H new ATOM 59 N VAL A 5 6.340 4.792 10.574 1.00 0.00 N ATOM 60 CA VAL A 5 5.462 3.675 10.846 1.00 0.00 C ATOM 61 C VAL A 5 4.086 4.036 10.289 1.00 0.00 C ATOM 62 O VAL A 5 3.737 5.220 10.258 1.00 0.00 O ATOM 63 CB VAL A 5 5.447 3.400 12.366 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.882 4.580 13.166 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.682 2.126 12.745 1.00 0.00 C ATOM 0 H VAL A 5 5.884 5.690 10.736 1.00 0.00 H new ATOM 0 HA VAL A 5 5.798 2.755 10.368 1.00 0.00 H new ATOM 0 HB VAL A 5 6.495 3.257 12.629 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.893 4.337 14.229 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.493 5.465 12.990 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.858 4.777 12.849 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.711 1.993 13.826 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.646 2.213 12.417 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.145 1.266 12.261 1.00 0.00 H new ATOM 75 N ALA A 6 3.305 3.044 9.851 1.00 0.00 N ATOM 76 CA ALA A 6 1.884 3.249 9.599 1.00 0.00 C ATOM 77 C ALA A 6 1.104 2.080 10.186 1.00 0.00 C ATOM 78 O ALA A 6 1.246 0.949 9.724 1.00 0.00 O ATOM 79 CB ALA A 6 1.615 3.440 8.107 1.00 0.00 C ATOM 0 H ALA A 6 3.635 2.097 9.666 1.00 0.00 H new ATOM 0 HA ALA A 6 1.549 4.164 10.087 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.548 3.591 7.946 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.163 4.311 7.747 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.942 2.555 7.562 1.00 0.00 H new ATOM 85 N VAL A 7 0.319 2.346 11.232 1.00 0.00 N ATOM 86 CA VAL A 7 -0.466 1.344 11.915 1.00 0.00 C ATOM 87 C VAL A 7 -1.820 1.194 11.213 1.00 0.00 C ATOM 88 O VAL A 7 -2.777 1.914 11.487 1.00 0.00 O ATOM 89 CB VAL A 7 -0.528 1.659 13.420 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.886 1.857 13.983 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.388 2.869 13.820 1.00 0.00 C ATOM 0 H VAL A 7 0.217 3.281 11.626 1.00 0.00 H new ATOM 0 HA VAL A 7 0.001 0.361 11.857 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.021 0.787 13.850 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.826 2.079 15.048 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.468 0.947 13.834 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.371 2.686 13.467 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.357 2.995 14.902 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.999 3.767 13.339 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.418 2.704 13.503 1.00 0.00 H new ATOM 101 N LEU A 8 -1.894 0.252 10.275 1.00 0.00 N ATOM 102 CA LEU A 8 -3.137 -0.155 9.644 1.00 0.00 C ATOM 103 C LEU A 8 -4.114 -0.639 10.709 1.00 0.00 C ATOM 104 O LEU A 8 -3.691 -1.326 11.638 1.00 0.00 O ATOM 105 CB LEU A 8 -2.842 -1.255 8.605 1.00 0.00 C ATOM 106 CG LEU A 8 -2.838 -0.662 7.194 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.777 0.430 7.029 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.584 -1.786 6.187 1.00 0.00 C ATOM 0 H LEU A 8 -1.078 -0.254 9.931 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.594 0.689 9.128 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.877 -1.716 8.816 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.593 -2.042 8.675 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.809 -0.198 7.017 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.812 0.821 6.012 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.973 1.237 7.735 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.790 0.010 7.223 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.579 -1.376 5.177 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.620 -2.250 6.395 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.372 -2.534 6.270 1.00 0.00 H new ATOM 120 N LYS A 9 -5.400 -0.301 10.563 1.00 0.00 N ATOM 121 CA LYS A 9 -6.500 -0.804 11.370 1.00 0.00 C ATOM 122 C LYS A 9 -7.789 -0.733 10.542 1.00 0.00 C ATOM 123 O LYS A 9 -7.972 0.204 9.765 1.00 0.00 O ATOM 124 CB LYS A 9 -6.595 0.004 12.673 1.00 0.00 C ATOM 125 CG LYS A 9 -7.605 -0.603 13.663 1.00 0.00 C ATOM 126 CD LYS A 9 -7.003 -0.913 15.041 1.00 0.00 C ATOM 127 CE LYS A 9 -6.722 0.331 15.903 1.00 0.00 C ATOM 128 NZ LYS A 9 -5.509 1.069 15.494 1.00 0.00 N ATOM 0 H LYS A 9 -5.708 0.358 9.848 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.335 -1.845 11.649 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.612 0.050 13.142 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.886 1.029 12.442 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.439 0.087 13.787 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.011 -1.521 13.238 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.684 -1.570 15.583 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.072 -1.463 14.903 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.580 1.001 15.851 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.618 0.026 16.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.214 1.705 16.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.744 0.394 15.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.714 1.627 14.641 1.00 0.00 H new ATOM 142 N GLY A 10 -8.661 -1.734 10.657 1.00 0.00 N ATOM 143 CA GLY A 10 -9.938 -1.781 9.970 1.00 0.00 C ATOM 144 C GLY A 10 -11.085 -1.900 10.958 1.00 0.00 C ATOM 145 O GLY A 10 -10.930 -1.619 12.144 1.00 0.00 O ATOM 0 H GLY A 10 -8.489 -2.550 11.245 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.064 -0.881 9.368 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -9.955 -2.628 9.284 1.00 0.00 H new ATOM 149 N ASP A 11 -12.237 -2.327 10.438 1.00 0.00 N ATOM 150 CA ASP A 11 -13.450 -2.530 11.214 1.00 0.00 C ATOM 151 C ASP A 11 -13.253 -3.662 12.227 1.00 0.00 C ATOM 152 O ASP A 11 -13.707 -3.584 13.366 1.00 0.00 O ATOM 153 CB ASP A 11 -14.592 -2.843 10.238 1.00 0.00 C ATOM 154 CG ASP A 11 -15.947 -2.883 10.932 1.00 0.00 C ATOM 155 OD1 ASP A 11 -16.194 -1.976 11.754 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.723 -3.800 10.592 1.00 0.00 O ATOM 0 H ASP A 11 -12.350 -2.544 9.448 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.694 -1.632 11.782 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.611 -2.090 9.450 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.404 -3.803 9.757 1.00 0.00 H new ATOM 161 N GLY A 12 -12.545 -4.716 11.806 1.00 0.00 N ATOM 162 CA GLY A 12 -12.248 -5.875 12.625 1.00 0.00 C ATOM 163 C GLY A 12 -10.766 -5.873 13.000 1.00 0.00 C ATOM 164 O GLY A 12 -10.139 -4.816 13.056 1.00 0.00 O ATOM 0 H GLY A 12 -12.158 -4.779 10.864 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -12.861 -5.863 13.526 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.495 -6.788 12.084 1.00 0.00 H new ATOM 168 N PRO A 13 -10.174 -7.054 13.229 1.00 0.00 N ATOM 169 CA PRO A 13 -8.805 -7.169 13.698 1.00 0.00 C ATOM 170 C PRO A 13 -7.790 -6.865 12.597 1.00 0.00 C ATOM 171 O PRO A 13 -6.612 -6.738 12.914 1.00 0.00 O ATOM 172 CB PRO A 13 -8.673 -8.601 14.217 1.00 0.00 C ATOM 173 CG PRO A 13 -9.672 -9.378 13.358 1.00 0.00 C ATOM 174 CD PRO A 13 -10.781 -8.362 13.068 1.00 0.00 C ATOM 0 HA PRO A 13 -8.592 -6.439 14.479 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -7.658 -8.981 14.097 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -8.916 -8.669 15.277 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.211 -9.739 12.439 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.058 -10.250 13.885 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.173 -8.489 12.059 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.618 -8.491 13.754 1.00 0.00 H new ATOM 182 N VAL A 14 -8.241 -6.737 11.338 1.00 0.00 N ATOM 183 CA VAL A 14 -7.459 -6.251 10.208 1.00 0.00 C ATOM 184 C VAL A 14 -6.615 -5.068 10.661 1.00 0.00 C ATOM 185 O VAL A 14 -7.124 -3.957 10.795 1.00 0.00 O ATOM 186 CB VAL A 14 -8.374 -5.832 9.037 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.511 -5.669 7.781 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.499 -6.828 8.726 1.00 0.00 C ATOM 0 H VAL A 14 -9.197 -6.980 11.078 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.813 -7.055 9.855 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.857 -4.902 9.338 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -8.141 -5.373 6.942 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.756 -4.903 7.956 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.022 -6.615 7.551 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -10.093 -6.457 7.891 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.067 -7.794 8.463 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.136 -6.942 9.603 1.00 0.00 H new ATOM 198 N GLN A 15 -5.331 -5.312 10.910 1.00 0.00 N ATOM 199 CA GLN A 15 -4.418 -4.272 11.340 1.00 0.00 C ATOM 200 C GLN A 15 -3.029 -4.615 10.832 1.00 0.00 C ATOM 201 O GLN A 15 -2.801 -5.759 10.447 1.00 0.00 O ATOM 202 CB GLN A 15 -4.484 -4.125 12.873 1.00 0.00 C ATOM 203 CG GLN A 15 -3.769 -5.277 13.595 1.00 0.00 C ATOM 204 CD GLN A 15 -4.174 -5.436 15.061 1.00 0.00 C ATOM 205 OE1 GLN A 15 -4.139 -6.535 15.615 1.00 0.00 O ATOM 206 NE2 GLN A 15 -4.493 -4.333 15.734 1.00 0.00 N ATOM 0 H GLN A 15 -4.902 -6.233 10.818 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.695 -3.303 10.925 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.031 -3.178 13.166 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.527 -4.091 13.189 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.977 -6.208 13.068 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.693 -5.114 13.541 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -4.516 -3.432 15.256 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -4.714 -4.388 16.728 1.00 0.00 H new ATOM 215 N GLY A 16 -2.102 -3.657 10.823 1.00 0.00 N ATOM 216 CA GLY A 16 -0.747 -3.956 10.383 1.00 0.00 C ATOM 217 C GLY A 16 0.251 -2.857 10.703 1.00 0.00 C ATOM 218 O GLY A 16 0.009 -1.696 10.405 1.00 0.00 O ATOM 0 H GLY A 16 -2.262 -2.691 11.109 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.417 -4.883 10.852 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.753 -4.128 9.307 1.00 0.00 H new ATOM 222 N ILE A 17 1.386 -3.219 11.293 1.00 0.00 N ATOM 223 CA ILE A 17 2.455 -2.285 11.606 1.00 0.00 C ATOM 224 C ILE A 17 3.383 -2.173 10.388 1.00 0.00 C ATOM 225 O ILE A 17 4.310 -2.970 10.236 1.00 0.00 O ATOM 226 CB ILE A 17 3.163 -2.736 12.897 1.00 0.00 C ATOM 227 CG1 ILE A 17 2.166 -2.772 14.077 1.00 0.00 C ATOM 228 CG2 ILE A 17 4.301 -1.768 13.243 1.00 0.00 C ATOM 229 CD1 ILE A 17 1.685 -4.190 14.402 1.00 0.00 C ATOM 0 H ILE A 17 1.589 -4.180 11.569 1.00 0.00 H new ATOM 0 HA ILE A 17 2.073 -1.283 11.804 1.00 0.00 H new ATOM 0 HB ILE A 17 3.565 -3.735 12.730 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.639 -2.342 14.960 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.306 -2.146 13.839 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.794 -2.098 14.158 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.024 -1.750 12.428 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.895 -0.767 13.390 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.987 -4.155 15.239 1.00 0.00 H new ATOM 0 HD12 ILE A 17 1.186 -4.614 13.531 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.540 -4.812 14.668 1.00 0.00 H new ATOM 241 N ILE A 18 3.121 -1.195 9.512 1.00 0.00 N ATOM 242 CA ILE A 18 4.012 -0.854 8.405 1.00 0.00 C ATOM 243 C ILE A 18 5.124 0.036 8.931 1.00 0.00 C ATOM 244 O ILE A 18 4.930 0.713 9.935 1.00 0.00 O ATOM 245 CB ILE A 18 3.246 -0.139 7.281 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.987 -0.909 6.869 1.00 0.00 C ATOM 247 CG2 ILE A 18 4.138 0.126 6.055 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.306 -2.350 6.500 1.00 0.00 C ATOM 0 H ILE A 18 2.281 -0.618 9.555 1.00 0.00 H new ATOM 0 HA ILE A 18 4.432 -1.769 7.988 1.00 0.00 H new ATOM 0 HB ILE A 18 2.936 0.824 7.685 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.267 -0.893 7.687 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.517 -0.411 6.021 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.557 0.633 5.285 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.980 0.754 6.346 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.510 -0.821 5.664 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.388 -2.864 6.213 1.00 0.00 H new ATOM 0 HD12 ILE A 18 3.006 -2.365 5.665 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.752 -2.855 7.357 1.00 0.00 H new ATOM 260 N ASN A 19 6.269 0.032 8.250 1.00 0.00 N ATOM 261 CA ASN A 19 7.521 0.642 8.649 1.00 0.00 C ATOM 262 C ASN A 19 8.158 1.194 7.376 1.00 0.00 C ATOM 263 O ASN A 19 8.101 0.539 6.332 1.00 0.00 O ATOM 264 CB ASN A 19 8.460 -0.394 9.289 1.00 0.00 C ATOM 265 CG ASN A 19 7.747 -1.339 10.252 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.806 -1.176 11.466 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.049 -2.328 9.699 1.00 0.00 N ATOM 0 H ASN A 19 6.343 -0.431 7.344 1.00 0.00 H new ATOM 0 HA ASN A 19 7.346 1.424 9.388 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.935 -0.979 8.502 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.255 0.127 9.823 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.538 -2.984 10.290 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.025 -2.430 8.684 1.00 0.00 H new ATOM 274 N PHE A 20 8.732 2.393 7.470 1.00 0.00 N ATOM 275 CA PHE A 20 9.373 3.095 6.366 1.00 0.00 C ATOM 276 C PHE A 20 10.728 3.649 6.812 1.00 0.00 C ATOM 277 O PHE A 20 10.742 4.573 7.622 1.00 0.00 O ATOM 278 CB PHE A 20 8.471 4.249 5.922 1.00 0.00 C ATOM 279 CG PHE A 20 7.203 3.826 5.211 1.00 0.00 C ATOM 280 CD1 PHE A 20 7.218 3.702 3.813 1.00 0.00 C ATOM 281 CD2 PHE A 20 5.994 3.674 5.916 1.00 0.00 C ATOM 282 CE1 PHE A 20 6.030 3.440 3.112 1.00 0.00 C ATOM 283 CE2 PHE A 20 4.806 3.400 5.215 1.00 0.00 C ATOM 284 CZ PHE A 20 4.828 3.265 3.816 1.00 0.00 C ATOM 0 H PHE A 20 8.763 2.916 8.345 1.00 0.00 H new ATOM 0 HA PHE A 20 9.530 2.403 5.538 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.200 4.838 6.798 1.00 0.00 H new ATOM 0 HB3 PHE A 20 9.040 4.903 5.262 1.00 0.00 H new ATOM 0 HD1 PHE A 20 8.148 3.809 3.274 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.979 3.768 6.992 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.041 3.373 2.034 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.875 3.293 5.752 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.920 3.027 3.282 1.00 0.00 H new ATOM 294 N GLU A 21 11.850 3.139 6.290 1.00 0.00 N ATOM 295 CA GLU A 21 13.174 3.712 6.569 1.00 0.00 C ATOM 296 C GLU A 21 13.601 4.578 5.386 1.00 0.00 C ATOM 297 O GLU A 21 13.593 4.100 4.250 1.00 0.00 O ATOM 298 CB GLU A 21 14.199 2.606 6.861 1.00 0.00 C ATOM 299 CG GLU A 21 15.411 3.060 7.700 1.00 0.00 C ATOM 300 CD GLU A 21 16.437 3.938 6.984 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.515 3.895 5.737 1.00 0.00 O ATOM 302 OE2 GLU A 21 17.218 4.603 7.694 1.00 0.00 O ATOM 0 H GLU A 21 11.868 2.329 5.671 1.00 0.00 H new ATOM 0 HA GLU A 21 13.121 4.337 7.460 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.697 1.792 7.383 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.559 2.203 5.914 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.041 3.604 8.569 1.00 0.00 H new ATOM 0 HG3 GLU A 21 15.921 2.172 8.073 1.00 0.00 H new ATOM 395 N PRO A 28 16.448 5.941 -1.591 1.00 0.00 N ATOM 396 CA PRO A 28 15.455 4.892 -1.721 1.00 0.00 C ATOM 397 C PRO A 28 14.860 4.572 -0.349 1.00 0.00 C ATOM 398 O PRO A 28 15.578 4.159 0.560 1.00 0.00 O ATOM 399 CB PRO A 28 16.192 3.701 -2.340 1.00 0.00 C ATOM 400 CG PRO A 28 17.641 3.912 -1.900 1.00 0.00 C ATOM 401 CD PRO A 28 17.782 5.435 -1.868 1.00 0.00 C ATOM 0 HA PRO A 28 14.613 5.178 -2.352 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.797 2.752 -1.978 1.00 0.00 H new ATOM 0 HB3 PRO A 28 16.099 3.692 -3.426 1.00 0.00 H new ATOM 0 HG2 PRO A 28 17.833 3.470 -0.922 1.00 0.00 H new ATOM 0 HG3 PRO A 28 18.344 3.458 -2.599 1.00 0.00 H new ATOM 0 HD2 PRO A 28 18.488 5.748 -1.099 1.00 0.00 H new ATOM 0 HD3 PRO A 28 18.157 5.815 -2.819 1.00 0.00 H new ATOM 409 N VAL A 29 13.549 4.769 -0.188 1.00 0.00 N ATOM 410 CA VAL A 29 12.841 4.396 1.011 1.00 0.00 C ATOM 411 C VAL A 29 12.728 2.875 1.011 1.00 0.00 C ATOM 412 O VAL A 29 12.503 2.289 -0.044 1.00 0.00 O ATOM 413 CB VAL A 29 11.466 5.090 0.999 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.376 4.309 0.269 1.00 0.00 C ATOM 415 CG2 VAL A 29 10.962 5.381 2.408 1.00 0.00 C ATOM 0 H VAL A 29 12.956 5.196 -0.900 1.00 0.00 H new ATOM 0 HA VAL A 29 13.356 4.708 1.920 1.00 0.00 H new ATOM 0 HB VAL A 29 11.648 6.016 0.454 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.441 4.867 0.307 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.668 4.162 -0.771 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.240 3.340 0.748 1.00 0.00 H new ATOM 0 HG21 VAL A 29 9.990 5.871 2.353 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.867 4.446 2.961 1.00 0.00 H new ATOM 0 HG23 VAL A 29 11.669 6.035 2.919 1.00 0.00 H new ATOM 425 N LYS A 30 12.855 2.241 2.173 1.00 0.00 N ATOM 426 CA LYS A 30 12.554 0.838 2.381 1.00 0.00 C ATOM 427 C LYS A 30 11.187 0.756 3.051 1.00 0.00 C ATOM 428 O LYS A 30 11.037 1.271 4.158 1.00 0.00 O ATOM 429 CB LYS A 30 13.650 0.233 3.274 1.00 0.00 C ATOM 430 CG LYS A 30 14.796 -0.345 2.445 1.00 0.00 C ATOM 431 CD LYS A 30 14.405 -1.747 1.956 1.00 0.00 C ATOM 432 CE LYS A 30 15.357 -2.231 0.846 1.00 0.00 C ATOM 433 NZ LYS A 30 14.692 -3.139 -0.104 1.00 0.00 N ATOM 0 H LYS A 30 13.181 2.709 3.019 1.00 0.00 H new ATOM 0 HA LYS A 30 12.529 0.282 1.444 1.00 0.00 H new ATOM 0 HB2 LYS A 30 14.037 0.999 3.946 1.00 0.00 H new ATOM 0 HB3 LYS A 30 13.220 -0.551 3.898 1.00 0.00 H new ATOM 0 HG2 LYS A 30 15.010 0.304 1.595 1.00 0.00 H new ATOM 0 HG3 LYS A 30 15.705 -0.396 3.044 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.429 -2.447 2.791 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.382 -1.733 1.581 1.00 0.00 H new ATOM 0 HE2 LYS A 30 15.751 -1.369 0.307 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.208 -2.741 1.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 15.215 -3.144 -1.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 14.672 -4.101 0.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.719 -2.814 -0.272 1.00 0.00 H new ATOM 447 N VAL A 31 10.219 0.127 2.377 1.00 0.00 N ATOM 448 CA VAL A 31 8.862 -0.077 2.850 1.00 0.00 C ATOM 449 C VAL A 31 8.772 -1.513 3.335 1.00 0.00 C ATOM 450 O VAL A 31 9.157 -2.425 2.603 1.00 0.00 O ATOM 451 CB VAL A 31 7.880 0.110 1.685 1.00 0.00 C ATOM 452 CG1 VAL A 31 6.418 -0.029 2.128 1.00 0.00 C ATOM 453 CG2 VAL A 31 8.106 1.462 1.020 1.00 0.00 C ATOM 0 H VAL A 31 10.375 -0.267 1.449 1.00 0.00 H new ATOM 0 HA VAL A 31 8.618 0.631 3.642 1.00 0.00 H new ATOM 0 HB VAL A 31 8.074 -0.685 0.965 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.762 0.112 1.269 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.258 -1.022 2.548 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.193 0.725 2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 31 7.404 1.584 0.195 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.950 2.257 1.749 1.00 0.00 H new ATOM 0 HG23 VAL A 31 9.126 1.514 0.639 1.00 0.00 H new ATOM 463 N TRP A 32 8.232 -1.744 4.531 1.00 0.00 N ATOM 464 CA TRP A 32 8.003 -3.111 4.970 1.00 0.00 C ATOM 465 C TRP A 32 6.991 -3.151 6.097 1.00 0.00 C ATOM 466 O TRP A 32 6.821 -2.170 6.818 1.00 0.00 O ATOM 467 CB TRP A 32 9.310 -3.809 5.378 1.00 0.00 C ATOM 468 CG TRP A 32 9.872 -3.428 6.711 1.00 0.00 C ATOM 469 CD1 TRP A 32 9.519 -3.975 7.895 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.905 -2.447 7.014 1.00 0.00 C ATOM 471 NE1 TRP A 32 10.258 -3.405 8.908 1.00 0.00 N ATOM 472 CE2 TRP A 32 11.145 -2.466 8.421 1.00 0.00 C ATOM 473 CE3 TRP A 32 11.668 -1.546 6.245 1.00 0.00 C ATOM 474 CZ2 TRP A 32 12.098 -1.640 9.031 1.00 0.00 C ATOM 475 CZ3 TRP A 32 12.644 -0.730 6.842 1.00 0.00 C ATOM 476 CH2 TRP A 32 12.863 -0.778 8.231 1.00 0.00 C ATOM 0 H TRP A 32 7.953 -1.021 5.194 1.00 0.00 H new ATOM 0 HA TRP A 32 7.595 -3.662 4.122 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.140 -4.886 5.373 1.00 0.00 H new ATOM 0 HB3 TRP A 32 10.062 -3.601 4.617 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.771 -4.743 8.027 1.00 0.00 H new ATOM 0 HE1 TRP A 32 10.162 -3.646 9.894 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.500 -1.481 5.180 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.242 -1.666 10.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 13.231 -0.061 6.230 1.00 0.00 H new ATOM 0 HH2 TRP A 32 13.619 -0.152 8.681 1.00 0.00 H new ATOM 487 N GLY A 33 6.323 -4.281 6.279 1.00 0.00 N ATOM 488 CA GLY A 33 5.300 -4.366 7.304 1.00 0.00 C ATOM 489 C GLY A 33 4.774 -5.771 7.475 1.00 0.00 C ATOM 490 O GLY A 33 5.291 -6.692 6.851 1.00 0.00 O ATOM 0 H GLY A 33 6.468 -5.135 5.741 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.709 -4.016 8.252 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.476 -3.701 7.047 1.00 0.00 H new ATOM 494 N SER A 34 3.732 -5.902 8.298 1.00 0.00 N ATOM 495 CA SER A 34 3.118 -7.169 8.637 1.00 0.00 C ATOM 496 C SER A 34 1.684 -6.847 9.007 1.00 0.00 C ATOM 497 O SER A 34 1.430 -6.311 10.086 1.00 0.00 O ATOM 498 CB SER A 34 3.845 -7.840 9.809 1.00 0.00 C ATOM 499 OG SER A 34 4.914 -8.635 9.339 1.00 0.00 O ATOM 0 H SER A 34 3.287 -5.105 8.754 1.00 0.00 H new ATOM 0 HA SER A 34 3.170 -7.869 7.803 1.00 0.00 H new ATOM 0 HB2 SER A 34 4.223 -7.080 10.493 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.146 -8.457 10.373 1.00 0.00 H new ATOM 0 HG SER A 34 5.266 -8.252 8.508 1.00 0.00 H new ATOM 505 N ILE A 35 0.762 -7.141 8.095 1.00 0.00 N ATOM 506 CA ILE A 35 -0.649 -7.137 8.389 1.00 0.00 C ATOM 507 C ILE A 35 -0.947 -8.344 9.275 1.00 0.00 C ATOM 508 O ILE A 35 -0.159 -9.282 9.347 1.00 0.00 O ATOM 509 CB ILE A 35 -1.414 -7.100 7.050 1.00 0.00 C ATOM 510 CG1 ILE A 35 -1.951 -5.681 6.805 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.514 -8.155 6.910 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.073 -5.348 5.319 1.00 0.00 C ATOM 0 H ILE A 35 0.984 -7.388 7.131 1.00 0.00 H new ATOM 0 HA ILE A 35 -0.977 -6.261 8.949 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.695 -7.364 6.274 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -2.928 -5.579 7.278 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.289 -4.958 7.282 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -2.996 -8.052 5.938 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.077 -9.150 6.994 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.254 -8.016 7.698 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.457 -4.334 5.204 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.093 -5.421 4.848 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.757 -6.051 4.844 1.00 0.00 H new ATOM 524 N LYS A 36 -2.102 -8.328 9.924 1.00 0.00 N ATOM 525 CA LYS A 36 -2.708 -9.486 10.532 1.00 0.00 C ATOM 526 C LYS A 36 -4.205 -9.214 10.557 1.00 0.00 C ATOM 527 O LYS A 36 -4.678 -8.394 11.340 1.00 0.00 O ATOM 528 CB LYS A 36 -2.121 -9.777 11.920 1.00 0.00 C ATOM 529 CG LYS A 36 -1.864 -8.533 12.777 1.00 0.00 C ATOM 530 CD LYS A 36 -2.123 -8.894 14.243 1.00 0.00 C ATOM 531 CE LYS A 36 -1.453 -7.905 15.202 1.00 0.00 C ATOM 532 NZ LYS A 36 -1.854 -8.176 16.596 1.00 0.00 N ATOM 0 H LYS A 36 -2.654 -7.478 10.041 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.501 -10.392 9.962 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.802 -10.438 12.457 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.183 -10.318 11.797 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -0.838 -8.188 12.647 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.516 -7.717 12.466 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -3.197 -8.909 14.429 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.751 -9.899 14.440 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.369 -7.979 15.109 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.728 -6.886 14.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.137 -7.793 17.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.771 -7.724 16.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.938 -9.203 16.740 1.00 0.00 H new ATOM 546 N GLY A 37 -4.934 -9.861 9.650 1.00 0.00 N ATOM 547 CA GLY A 37 -6.389 -9.903 9.690 1.00 0.00 C ATOM 548 C GLY A 37 -7.040 -10.028 8.312 1.00 0.00 C ATOM 549 O GLY A 37 -8.252 -10.209 8.228 1.00 0.00 O ATOM 0 H GLY A 37 -4.528 -10.371 8.866 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.702 -10.745 10.307 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.756 -8.998 10.175 1.00 0.00 H new ATOM 553 N LEU A 38 -6.263 -9.925 7.227 1.00 0.00 N ATOM 554 CA LEU A 38 -6.755 -10.219 5.891 1.00 0.00 C ATOM 555 C LEU A 38 -7.030 -11.726 5.766 1.00 0.00 C ATOM 556 O LEU A 38 -6.848 -12.481 6.714 1.00 0.00 O ATOM 557 CB LEU A 38 -5.722 -9.727 4.853 1.00 0.00 C ATOM 558 CG LEU A 38 -5.904 -8.279 4.361 1.00 0.00 C ATOM 559 CD1 LEU A 38 -7.349 -7.962 3.964 1.00 0.00 C ATOM 560 CD2 LEU A 38 -5.444 -7.210 5.356 1.00 0.00 C ATOM 0 H LEU A 38 -5.285 -9.637 7.257 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.694 -9.698 5.703 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.726 -9.821 5.286 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.758 -10.391 3.990 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.257 -8.236 3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.415 -6.928 3.626 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.659 -8.628 3.159 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.002 -8.105 4.825 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -5.608 -6.221 4.929 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -6.013 -7.305 6.281 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.383 -7.342 5.568 1.00 0.00 H new ATOM 572 N THR A 39 -7.463 -12.171 4.584 1.00 0.00 N ATOM 573 CA THR A 39 -7.520 -13.585 4.217 1.00 0.00 C ATOM 574 C THR A 39 -6.447 -13.854 3.164 1.00 0.00 C ATOM 575 O THR A 39 -5.991 -12.906 2.518 1.00 0.00 O ATOM 576 CB THR A 39 -8.928 -13.946 3.724 1.00 0.00 C ATOM 577 OG1 THR A 39 -9.033 -15.341 3.531 1.00 0.00 O ATOM 578 CG2 THR A 39 -9.297 -13.238 2.415 1.00 0.00 C ATOM 0 H THR A 39 -7.789 -11.548 3.845 1.00 0.00 H new ATOM 0 HA THR A 39 -7.320 -14.218 5.082 1.00 0.00 H new ATOM 0 HB THR A 39 -9.622 -13.611 4.495 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.935 -15.561 3.218 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.303 -13.531 2.114 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.262 -12.159 2.563 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.589 -13.521 1.636 1.00 0.00 H new ATOM 586 N GLU A 40 -6.057 -15.119 3.011 1.00 0.00 N ATOM 587 CA GLU A 40 -4.985 -15.561 2.140 1.00 0.00 C ATOM 588 C GLU A 40 -5.185 -15.129 0.691 1.00 0.00 C ATOM 589 O GLU A 40 -6.315 -14.934 0.241 1.00 0.00 O ATOM 590 CB GLU A 40 -4.838 -17.084 2.240 1.00 0.00 C ATOM 591 CG GLU A 40 -6.135 -17.879 2.019 1.00 0.00 C ATOM 592 CD GLU A 40 -5.872 -19.379 2.087 1.00 0.00 C ATOM 593 OE1 GLU A 40 -5.557 -19.846 3.203 1.00 0.00 O ATOM 594 OE2 GLU A 40 -5.978 -20.024 1.023 1.00 0.00 O ATOM 0 H GLU A 40 -6.501 -15.888 3.513 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.067 -15.080 2.477 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.100 -17.411 1.508 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.441 -17.332 3.225 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.870 -17.600 2.774 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.562 -17.624 1.049 1.00 0.00 H new ATOM 601 N GLY A 41 -4.083 -14.987 -0.047 1.00 0.00 N ATOM 602 CA GLY A 41 -4.128 -14.665 -1.456 1.00 0.00 C ATOM 603 C GLY A 41 -3.480 -13.309 -1.541 1.00 0.00 C ATOM 604 O GLY A 41 -2.388 -13.156 -1.005 1.00 0.00 O ATOM 0 H GLY A 41 -3.139 -15.094 0.324 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.590 -15.403 -2.051 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.152 -14.642 -1.828 1.00 0.00 H new ATOM 608 N LEU A 42 -4.146 -12.319 -2.134 1.00 0.00 N ATOM 609 CA LEU A 42 -3.560 -11.007 -2.319 1.00 0.00 C ATOM 610 C LEU A 42 -4.594 -9.901 -2.146 1.00 0.00 C ATOM 611 O LEU A 42 -5.792 -10.135 -2.293 1.00 0.00 O ATOM 612 CB LEU A 42 -2.781 -10.942 -3.645 1.00 0.00 C ATOM 613 CG LEU A 42 -3.651 -10.835 -4.905 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.755 -10.896 -6.147 1.00 0.00 C ATOM 615 CD2 LEU A 42 -4.687 -11.963 -5.022 1.00 0.00 C ATOM 0 H LEU A 42 -5.096 -12.409 -2.494 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.827 -10.832 -1.531 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.109 -10.085 -3.612 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.158 -11.833 -3.727 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.186 -9.888 -4.831 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.370 -10.820 -7.044 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.044 -10.070 -6.124 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.212 -11.841 -6.158 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.269 -11.829 -5.934 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.175 -12.925 -5.056 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.353 -11.937 -4.159 1.00 0.00 H new ATOM 627 N HIS A 43 -4.121 -8.715 -1.760 1.00 0.00 N ATOM 628 CA HIS A 43 -4.944 -7.583 -1.369 1.00 0.00 C ATOM 629 C HIS A 43 -4.318 -6.313 -1.920 1.00 0.00 C ATOM 630 O HIS A 43 -3.124 -6.119 -1.712 1.00 0.00 O ATOM 631 CB HIS A 43 -4.975 -7.538 0.161 1.00 0.00 C ATOM 632 CG HIS A 43 -5.877 -8.604 0.713 1.00 0.00 C ATOM 633 ND1 HIS A 43 -7.248 -8.596 0.595 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.509 -9.810 1.239 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.722 -9.763 1.046 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.685 -10.498 1.473 1.00 0.00 N ATOM 0 H HIS A 43 -3.122 -8.516 -1.711 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.958 -7.674 -1.758 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.967 -7.671 0.553 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -5.319 -6.558 0.493 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.809 -7.829 0.225 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.504 -10.155 1.433 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.760 -10.061 1.063 1.00 0.00 H new ATOM 645 N GLY A 44 -5.089 -5.457 -2.605 1.00 0.00 N ATOM 646 CA GLY A 44 -4.569 -4.178 -3.071 1.00 0.00 C ATOM 647 C GLY A 44 -3.982 -3.408 -1.891 1.00 0.00 C ATOM 648 O GLY A 44 -4.515 -3.511 -0.788 1.00 0.00 O ATOM 0 H GLY A 44 -6.065 -5.631 -2.844 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.804 -4.339 -3.831 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.365 -3.598 -3.538 1.00 0.00 H new ATOM 652 N PHE A 45 -2.889 -2.674 -2.105 1.00 0.00 N ATOM 653 CA PHE A 45 -2.175 -1.945 -1.059 1.00 0.00 C ATOM 654 C PHE A 45 -1.755 -0.605 -1.636 1.00 0.00 C ATOM 655 O PHE A 45 -0.990 -0.589 -2.602 1.00 0.00 O ATOM 656 CB PHE A 45 -0.945 -2.754 -0.629 1.00 0.00 C ATOM 657 CG PHE A 45 -0.065 -2.092 0.423 1.00 0.00 C ATOM 658 CD1 PHE A 45 0.881 -1.123 0.039 1.00 0.00 C ATOM 659 CD2 PHE A 45 -0.102 -2.528 1.760 1.00 0.00 C ATOM 660 CE1 PHE A 45 1.824 -0.645 0.963 1.00 0.00 C ATOM 661 CE2 PHE A 45 0.835 -2.040 2.687 1.00 0.00 C ATOM 662 CZ PHE A 45 1.837 -1.147 2.272 1.00 0.00 C ATOM 0 H PHE A 45 -2.468 -2.568 -3.028 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.808 -1.791 -0.185 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -1.281 -3.717 -0.244 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -0.338 -2.957 -1.511 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.882 -0.745 -0.973 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.852 -3.239 2.075 1.00 0.00 H new ATOM 0 HE1 PHE A 45 2.538 0.108 0.666 1.00 0.00 H new ATOM 0 HE2 PHE A 45 0.785 -2.352 3.720 1.00 0.00 H new ATOM 0 HZ PHE A 45 2.615 -0.848 2.959 1.00 0.00 H new ATOM 672 N HIS A 46 -2.248 0.515 -1.097 1.00 0.00 N ATOM 673 CA HIS A 46 -1.903 1.811 -1.655 1.00 0.00 C ATOM 674 C HIS A 46 -2.052 2.874 -0.593 1.00 0.00 C ATOM 675 O HIS A 46 -2.616 2.633 0.472 1.00 0.00 O ATOM 676 CB HIS A 46 -2.782 2.195 -2.859 1.00 0.00 C ATOM 677 CG HIS A 46 -3.451 1.045 -3.543 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.735 0.561 -3.285 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.914 0.282 -4.531 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.930 -0.504 -4.089 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.849 -0.641 -4.855 1.00 0.00 N ATOM 0 H HIS A 46 -2.874 0.544 -0.292 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.872 1.741 -2.002 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.548 2.894 -2.523 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.166 2.723 -3.587 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -1.934 0.391 -4.971 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.807 -1.134 -4.108 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.741 -1.345 -5.585 1.00 0.00 H new ATOM 689 N VAL A 47 -1.592 4.072 -0.928 1.00 0.00 N ATOM 690 CA VAL A 47 -1.810 5.240 -0.111 1.00 0.00 C ATOM 691 C VAL A 47 -2.927 6.067 -0.748 1.00 0.00 C ATOM 692 O VAL A 47 -2.844 6.424 -1.925 1.00 0.00 O ATOM 693 CB VAL A 47 -0.461 5.943 0.089 1.00 0.00 C ATOM 694 CG1 VAL A 47 -0.107 6.901 -1.047 1.00 0.00 C ATOM 695 CG2 VAL A 47 -0.459 6.643 1.441 1.00 0.00 C ATOM 0 H VAL A 47 -1.057 4.253 -1.777 1.00 0.00 H new ATOM 0 HA VAL A 47 -2.164 5.017 0.896 1.00 0.00 H new ATOM 0 HB VAL A 47 0.320 5.183 0.072 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.858 7.365 -0.844 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.054 6.349 -1.985 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.872 7.674 -1.123 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.497 7.145 1.590 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.263 7.378 1.471 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.610 5.908 2.232 1.00 0.00 H new ATOM 705 N HIS A 48 -4.029 6.281 -0.025 1.00 0.00 N ATOM 706 CA HIS A 48 -5.100 7.147 -0.495 1.00 0.00 C ATOM 707 C HIS A 48 -4.853 8.581 -0.052 1.00 0.00 C ATOM 708 O HIS A 48 -3.922 8.846 0.711 1.00 0.00 O ATOM 709 CB HIS A 48 -6.441 6.632 0.022 1.00 0.00 C ATOM 710 CG HIS A 48 -6.893 5.384 -0.684 1.00 0.00 C ATOM 711 ND1 HIS A 48 -8.178 4.952 -0.727 1.00 0.00 N ATOM 712 CD2 HIS A 48 -6.082 4.466 -1.286 1.00 0.00 C ATOM 713 CE1 HIS A 48 -8.192 3.743 -1.285 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.927 3.418 -1.623 1.00 0.00 N ATOM 0 H HIS A 48 -4.198 5.863 0.890 1.00 0.00 H new ATOM 0 HA HIS A 48 -5.123 7.135 -1.585 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -6.361 6.432 1.090 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -7.196 7.408 -0.101 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -5.019 4.539 -1.461 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -9.066 3.128 -1.440 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -6.638 2.542 -2.057 1.00 0.00 H new ATOM 722 N GLU A 49 -5.688 9.494 -0.559 1.00 0.00 N ATOM 723 CA GLU A 49 -5.694 10.888 -0.138 1.00 0.00 C ATOM 724 C GLU A 49 -6.246 11.019 1.293 1.00 0.00 C ATOM 725 O GLU A 49 -5.956 10.153 2.114 1.00 0.00 O ATOM 726 CB GLU A 49 -6.410 11.728 -1.200 1.00 0.00 C ATOM 727 CG GLU A 49 -5.920 13.185 -1.179 1.00 0.00 C ATOM 728 CD GLU A 49 -7.096 14.140 -1.125 1.00 0.00 C ATOM 729 OE1 GLU A 49 -7.810 14.035 -0.106 1.00 0.00 O ATOM 730 OE2 GLU A 49 -7.273 14.904 -2.097 1.00 0.00 O ATOM 0 H GLU A 49 -6.380 9.280 -1.277 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.682 11.287 -0.073 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -6.236 11.297 -2.186 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -7.486 11.701 -1.025 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.274 13.345 -0.316 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.321 13.386 -2.067 1.00 0.00 H new ATOM 876 N PRO A 62 -10.168 8.411 -2.317 1.00 0.00 N ATOM 877 CA PRO A 62 -9.755 7.420 -3.284 1.00 0.00 C ATOM 878 C PRO A 62 -8.223 7.296 -3.344 1.00 0.00 C ATOM 879 O PRO A 62 -7.507 7.928 -2.563 1.00 0.00 O ATOM 880 CB PRO A 62 -10.377 7.894 -4.606 1.00 0.00 C ATOM 881 CG PRO A 62 -10.421 9.416 -4.450 1.00 0.00 C ATOM 882 CD PRO A 62 -10.701 9.601 -2.958 1.00 0.00 C ATOM 0 HA PRO A 62 -10.091 6.414 -3.030 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -9.775 7.595 -5.464 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -11.373 7.476 -4.755 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -9.479 9.879 -4.744 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -11.202 9.862 -5.066 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -10.220 10.502 -2.576 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.769 9.705 -2.768 1.00 0.00 H new ATOM 890 N HIS A 63 -7.719 6.476 -4.280 1.00 0.00 N ATOM 891 CA HIS A 63 -6.286 6.407 -4.576 1.00 0.00 C ATOM 892 C HIS A 63 -5.735 7.818 -4.755 1.00 0.00 C ATOM 893 O HIS A 63 -6.366 8.646 -5.409 1.00 0.00 O ATOM 894 CB HIS A 63 -5.995 5.613 -5.865 1.00 0.00 C ATOM 895 CG HIS A 63 -5.881 4.117 -5.697 1.00 0.00 C ATOM 896 ND1 HIS A 63 -5.038 3.232 -6.392 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.670 3.358 -4.886 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.380 1.971 -6.028 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.347 2.057 -5.102 1.00 0.00 N ATOM 0 H HIS A 63 -8.290 5.849 -4.846 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.809 5.898 -3.739 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -6.787 5.821 -6.585 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -5.066 5.984 -6.297 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -4.303 3.491 -7.050 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.416 3.724 -4.197 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.950 1.059 -6.415 1.00 0.00 H new ATOM 907 N PHE A 64 -4.542 8.068 -4.209 1.00 0.00 N ATOM 908 CA PHE A 64 -3.819 9.298 -4.493 1.00 0.00 C ATOM 909 C PHE A 64 -3.529 9.370 -6.000 1.00 0.00 C ATOM 910 O PHE A 64 -3.622 8.365 -6.704 1.00 0.00 O ATOM 911 CB PHE A 64 -2.529 9.338 -3.651 1.00 0.00 C ATOM 912 CG PHE A 64 -2.191 10.689 -3.044 1.00 0.00 C ATOM 913 CD1 PHE A 64 -1.741 11.761 -3.833 1.00 0.00 C ATOM 914 CD2 PHE A 64 -2.406 10.896 -1.669 1.00 0.00 C ATOM 915 CE1 PHE A 64 -1.659 13.056 -3.295 1.00 0.00 C ATOM 916 CE2 PHE A 64 -2.329 12.189 -1.130 1.00 0.00 C ATOM 917 CZ PHE A 64 -2.001 13.278 -1.952 1.00 0.00 C ATOM 0 H PHE A 64 -4.062 7.434 -3.570 1.00 0.00 H new ATOM 0 HA PHE A 64 -4.416 10.169 -4.223 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.618 8.608 -2.846 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.696 9.021 -4.278 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.456 11.588 -4.860 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.631 10.057 -1.027 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.333 13.879 -3.914 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.523 12.347 -0.079 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.012 14.282 -1.553 1.00 0.00 H new ATOM 927 N ASN A 65 -3.132 10.543 -6.490 1.00 0.00 N ATOM 928 CA ASN A 65 -2.696 10.797 -7.862 1.00 0.00 C ATOM 929 C ASN A 65 -1.481 11.737 -7.813 1.00 0.00 C ATOM 930 O ASN A 65 -1.540 12.719 -7.080 1.00 0.00 O ATOM 931 CB ASN A 65 -3.816 11.470 -8.665 1.00 0.00 C ATOM 932 CG ASN A 65 -4.870 10.493 -9.180 1.00 0.00 C ATOM 933 OD1 ASN A 65 -5.923 10.331 -8.576 1.00 0.00 O ATOM 934 ND2 ASN A 65 -4.631 9.857 -10.325 1.00 0.00 N ATOM 0 H ASN A 65 -3.104 11.383 -5.913 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.440 9.853 -8.343 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.301 12.218 -8.039 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.378 11.998 -9.512 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.330 9.223 -10.712 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -3.749 10.003 -10.815 1.00 0.00 H new ATOM 941 N PRO A 66 -0.383 11.467 -8.546 1.00 0.00 N ATOM 942 CA PRO A 66 0.807 12.303 -8.529 1.00 0.00 C ATOM 943 C PRO A 66 0.607 13.447 -9.515 1.00 0.00 C ATOM 944 O PRO A 66 0.471 14.600 -9.121 1.00 0.00 O ATOM 945 CB PRO A 66 1.972 11.389 -8.939 1.00 0.00 C ATOM 946 CG PRO A 66 1.324 10.238 -9.719 1.00 0.00 C ATOM 947 CD PRO A 66 -0.167 10.284 -9.353 1.00 0.00 C ATOM 0 HA PRO A 66 1.009 12.744 -7.553 1.00 0.00 H new ATOM 0 HB2 PRO A 66 2.695 11.924 -9.555 1.00 0.00 H new ATOM 0 HB3 PRO A 66 2.509 11.020 -8.065 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.469 10.361 -10.792 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.766 9.280 -9.445 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -0.781 10.317 -10.253 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.454 9.388 -8.803 1.00 0.00 H new ATOM 955 N LEU A 67 0.568 13.104 -10.805 1.00 0.00 N ATOM 956 CA LEU A 67 0.308 14.018 -11.906 1.00 0.00 C ATOM 957 C LEU A 67 -0.918 13.512 -12.670 1.00 0.00 C ATOM 958 O LEU A 67 -0.921 13.492 -13.896 1.00 0.00 O ATOM 959 CB LEU A 67 1.543 14.110 -12.820 1.00 0.00 C ATOM 960 CG LEU A 67 2.849 14.402 -12.057 1.00 0.00 C ATOM 961 CD1 LEU A 67 3.738 13.152 -12.026 1.00 0.00 C ATOM 962 CD2 LEU A 67 3.621 15.549 -12.716 1.00 0.00 C ATOM 0 H LEU A 67 0.723 12.145 -11.117 1.00 0.00 H new ATOM 0 HA LEU A 67 0.107 15.022 -11.531 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.652 13.173 -13.366 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.380 14.894 -13.560 1.00 0.00 H new ATOM 0 HG LEU A 67 2.584 14.689 -11.039 1.00 0.00 H new ATOM 0 HD11 LEU A 67 4.657 13.373 -11.484 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.208 12.341 -11.527 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.981 12.853 -13.046 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.539 15.737 -12.159 1.00 0.00 H new ATOM 0 HD22 LEU A 67 3.868 15.279 -13.743 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.006 16.449 -12.715 1.00 0.00 H new ATOM 974 N SER A 68 -1.925 13.028 -11.928 1.00 0.00 N ATOM 975 CA SER A 68 -3.200 12.561 -12.475 1.00 0.00 C ATOM 976 C SER A 68 -3.010 11.507 -13.571 1.00 0.00 C ATOM 977 O SER A 68 -3.732 11.503 -14.565 1.00 0.00 O ATOM 978 CB SER A 68 -4.092 13.739 -12.907 1.00 0.00 C ATOM 979 OG SER A 68 -3.664 14.311 -14.123 1.00 0.00 O ATOM 0 H SER A 68 -1.871 12.950 -10.912 1.00 0.00 H new ATOM 0 HA SER A 68 -3.735 12.051 -11.674 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.121 13.395 -13.011 1.00 0.00 H new ATOM 0 HB3 SER A 68 -4.088 14.501 -12.127 1.00 0.00 H new ATOM 0 HG SER A 68 -2.748 14.021 -14.317 1.00 0.00 H new ATOM 985 N ARG A 69 -2.045 10.607 -13.364 1.00 0.00 N ATOM 986 CA ARG A 69 -1.861 9.419 -14.186 1.00 0.00 C ATOM 987 C ARG A 69 -2.975 8.429 -13.828 1.00 0.00 C ATOM 988 O ARG A 69 -3.570 8.554 -12.753 1.00 0.00 O ATOM 989 CB ARG A 69 -0.474 8.817 -13.897 1.00 0.00 C ATOM 990 CG ARG A 69 0.656 9.850 -14.061 1.00 0.00 C ATOM 991 CD ARG A 69 2.034 9.241 -13.757 1.00 0.00 C ATOM 992 NE ARG A 69 2.477 8.295 -14.797 1.00 0.00 N ATOM 993 CZ ARG A 69 3.022 8.636 -15.977 1.00 0.00 C ATOM 994 NH1 ARG A 69 3.130 9.926 -16.315 1.00 0.00 N ATOM 995 NH2 ARG A 69 3.465 7.693 -16.811 1.00 0.00 N ATOM 0 H ARG A 69 -1.363 10.689 -12.610 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.913 9.657 -15.248 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.457 8.421 -12.882 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.297 7.978 -14.570 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.647 10.240 -15.079 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.477 10.694 -13.395 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.768 10.041 -13.662 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.996 8.728 -12.796 1.00 0.00 H new ATOM 0 HE ARG A 69 2.360 7.300 -14.605 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.799 10.650 -15.677 1.00 0.00 H new ATOM 0 HH12 ARG A 69 3.544 10.186 -17.210 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.391 6.709 -16.554 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.878 7.956 -17.706 1.00 0.00 H new ATOM 1009 N LYS A 70 -3.261 7.432 -14.671 1.00 0.00 N ATOM 1010 CA LYS A 70 -4.114 6.343 -14.267 1.00 0.00 C ATOM 1011 C LYS A 70 -3.435 5.501 -13.187 1.00 0.00 C ATOM 1012 O LYS A 70 -2.267 5.689 -12.840 1.00 0.00 O ATOM 1013 CB LYS A 70 -4.408 5.455 -15.469 1.00 0.00 C ATOM 1014 CG LYS A 70 -5.252 6.093 -16.574 1.00 0.00 C ATOM 1015 CD LYS A 70 -5.683 4.929 -17.473 1.00 0.00 C ATOM 1016 CE LYS A 70 -6.197 5.393 -18.836 1.00 0.00 C ATOM 1017 NZ LYS A 70 -6.495 4.230 -19.695 1.00 0.00 N ATOM 0 H LYS A 70 -2.911 7.369 -15.627 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.040 6.758 -13.868 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.460 5.134 -15.901 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.919 4.558 -15.119 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.117 6.611 -16.159 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.676 6.830 -17.133 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.838 4.256 -17.618 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.463 4.357 -16.971 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -7.095 5.998 -18.707 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.452 6.027 -19.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.843 4.560 -20.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -5.630 3.669 -19.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.222 3.641 -19.241 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.211 4.562 -12.652 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.744 3.575 -11.704 1.00 0.00 C ATOM 1033 C HIS A 71 -2.804 2.573 -12.372 1.00 0.00 C ATOM 1034 O HIS A 71 -2.824 2.427 -13.591 1.00 0.00 O ATOM 1035 CB HIS A 71 -4.980 2.844 -11.193 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.714 1.843 -10.117 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -4.000 2.048 -8.942 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -4.995 0.513 -10.176 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.648 0.846 -8.470 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.366 -0.058 -9.120 1.00 0.00 N ATOM 0 H HIS A 71 -5.202 4.471 -12.875 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.192 4.057 -10.897 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.691 3.580 -10.818 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.458 2.337 -12.031 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.599 0.012 -10.917 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.915 0.650 -7.702 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.435 -1.043 -8.863 1.00 0.00 H new ATOM 1048 N GLY A 72 -2.060 1.829 -11.552 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.372 0.625 -11.976 1.00 0.00 C ATOM 1050 C GLY A 72 -0.603 0.059 -10.793 1.00 0.00 C ATOM 1051 O GLY A 72 -1.049 0.190 -9.656 1.00 0.00 O ATOM 0 H GLY A 72 -1.922 2.054 -10.567 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -2.088 -0.108 -12.347 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.691 0.849 -12.797 1.00 0.00 H new ATOM 1055 N GLY A 73 0.553 -0.544 -11.052 1.00 0.00 N ATOM 1056 CA GLY A 73 1.466 -1.071 -10.049 1.00 0.00 C ATOM 1057 C GLY A 73 2.889 -0.578 -10.304 1.00 0.00 C ATOM 1058 O GLY A 73 3.137 0.153 -11.264 1.00 0.00 O ATOM 0 H GLY A 73 0.891 -0.683 -12.004 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.141 -0.762 -9.056 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.444 -2.161 -10.067 1.00 0.00 H new ATOM 1062 N PRO A 74 3.855 -1.001 -9.476 1.00 0.00 N ATOM 1063 CA PRO A 74 5.208 -0.471 -9.506 1.00 0.00 C ATOM 1064 C PRO A 74 5.950 -0.798 -10.804 1.00 0.00 C ATOM 1065 O PRO A 74 6.929 -0.125 -11.114 1.00 0.00 O ATOM 1066 CB PRO A 74 5.901 -1.027 -8.259 1.00 0.00 C ATOM 1067 CG PRO A 74 5.120 -2.300 -7.938 1.00 0.00 C ATOM 1068 CD PRO A 74 3.702 -1.979 -8.413 1.00 0.00 C ATOM 0 HA PRO A 74 5.200 0.619 -9.491 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.953 -1.241 -8.449 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.865 -0.317 -7.432 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.531 -3.165 -8.458 1.00 0.00 H new ATOM 0 HG3 PRO A 74 5.144 -2.528 -6.872 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.198 -2.875 -8.775 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.097 -1.580 -7.598 1.00 0.00 H new ATOM 1076 N LYS A 75 5.497 -1.798 -11.576 1.00 0.00 N ATOM 1077 CA LYS A 75 6.097 -2.091 -12.876 1.00 0.00 C ATOM 1078 C LYS A 75 5.345 -1.443 -14.043 1.00 0.00 C ATOM 1079 O LYS A 75 5.759 -1.640 -15.185 1.00 0.00 O ATOM 1080 CB LYS A 75 6.237 -3.606 -13.081 1.00 0.00 C ATOM 1081 CG LYS A 75 7.203 -4.235 -12.068 1.00 0.00 C ATOM 1082 CD LYS A 75 7.924 -5.430 -12.715 1.00 0.00 C ATOM 1083 CE LYS A 75 8.501 -6.402 -11.677 1.00 0.00 C ATOM 1084 NZ LYS A 75 7.454 -7.273 -11.102 1.00 0.00 N ATOM 0 H LYS A 75 4.722 -2.410 -11.320 1.00 0.00 H new ATOM 0 HA LYS A 75 7.092 -1.645 -12.869 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.258 -4.076 -12.989 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.592 -3.804 -14.092 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.931 -3.495 -11.736 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.656 -4.563 -11.184 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.227 -5.965 -13.360 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.729 -5.063 -13.351 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.271 -7.017 -12.143 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.984 -5.838 -10.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.881 -7.916 -10.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.732 -6.687 -10.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.011 -7.830 -11.860 1.00 0.00 H new ATOM 1098 N ASP A 76 4.276 -0.676 -13.800 1.00 0.00 N ATOM 1099 CA ASP A 76 3.475 -0.158 -14.889 1.00 0.00 C ATOM 1100 C ASP A 76 3.987 1.211 -15.323 1.00 0.00 C ATOM 1101 O ASP A 76 4.713 1.921 -14.611 1.00 0.00 O ATOM 1102 CB ASP A 76 1.993 -0.100 -14.502 1.00 0.00 C ATOM 1103 CG ASP A 76 1.377 -1.469 -14.253 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.921 -2.475 -14.755 1.00 0.00 O ATOM 1105 OD2 ASP A 76 0.372 -1.479 -13.514 1.00 0.00 O ATOM 0 H ASP A 76 3.957 -0.409 -12.869 1.00 0.00 H new ATOM 0 HA ASP A 76 3.566 -0.838 -15.736 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.884 0.508 -13.604 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.438 0.401 -15.295 1.00 0.00 H new ATOM 1110 N GLU A 77 3.570 1.574 -16.529 1.00 0.00 N ATOM 1111 CA GLU A 77 3.833 2.858 -17.150 1.00 0.00 C ATOM 1112 C GLU A 77 2.996 3.945 -16.477 1.00 0.00 C ATOM 1113 O GLU A 77 3.473 5.063 -16.266 1.00 0.00 O ATOM 1114 CB GLU A 77 3.563 2.739 -18.655 1.00 0.00 C ATOM 1115 CG GLU A 77 2.114 2.359 -19.005 1.00 0.00 C ATOM 1116 CD GLU A 77 2.065 1.624 -20.337 1.00 0.00 C ATOM 1117 OE1 GLU A 77 2.330 0.404 -20.304 1.00 0.00 O ATOM 1118 OE2 GLU A 77 1.799 2.298 -21.353 1.00 0.00 O ATOM 0 H GLU A 77 3.018 0.955 -17.122 1.00 0.00 H new ATOM 0 HA GLU A 77 4.876 3.148 -17.020 1.00 0.00 H new ATOM 0 HB2 GLU A 77 3.804 3.689 -19.133 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.235 1.991 -19.076 1.00 0.00 H new ATOM 0 HG2 GLU A 77 1.697 1.729 -18.219 1.00 0.00 H new ATOM 0 HG3 GLU A 77 1.498 3.257 -19.055 1.00 0.00 H new ATOM 1125 N GLU A 78 1.763 3.601 -16.104 1.00 0.00 N ATOM 1126 CA GLU A 78 0.865 4.457 -15.358 1.00 0.00 C ATOM 1127 C GLU A 78 0.725 3.824 -13.991 1.00 0.00 C ATOM 1128 O GLU A 78 0.441 2.639 -13.888 1.00 0.00 O ATOM 1129 CB GLU A 78 -0.494 4.584 -16.055 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.420 5.557 -17.237 1.00 0.00 C ATOM 1131 CD GLU A 78 -1.807 6.022 -17.652 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -2.489 5.285 -18.398 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -2.191 7.099 -17.146 1.00 0.00 O ATOM 0 H GLU A 78 1.358 2.691 -16.323 1.00 0.00 H new ATOM 0 HA GLU A 78 1.258 5.471 -15.285 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.819 3.605 -16.406 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.241 4.931 -15.341 1.00 0.00 H new ATOM 0 HG2 GLU A 78 0.189 6.419 -16.965 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.072 5.072 -18.080 1.00 0.00 H new ATOM 1140 N ARG A 79 0.994 4.604 -12.953 1.00 0.00 N ATOM 1141 CA ARG A 79 0.900 4.176 -11.575 1.00 0.00 C ATOM 1142 C ARG A 79 0.759 5.466 -10.774 1.00 0.00 C ATOM 1143 O ARG A 79 1.418 6.457 -11.099 1.00 0.00 O ATOM 1144 CB ARG A 79 2.133 3.339 -11.189 1.00 0.00 C ATOM 1145 CG ARG A 79 3.390 4.163 -10.884 1.00 0.00 C ATOM 1146 CD ARG A 79 4.631 3.267 -10.956 1.00 0.00 C ATOM 1147 NE ARG A 79 5.209 3.271 -12.308 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.090 4.167 -12.771 1.00 0.00 C ATOM 1149 NH1 ARG A 79 6.501 5.172 -11.985 1.00 0.00 N ATOM 1150 NH2 ARG A 79 6.535 4.045 -14.023 1.00 0.00 N ATOM 0 H ARG A 79 1.290 5.575 -13.055 1.00 0.00 H new ATOM 0 HA ARG A 79 0.052 3.520 -11.381 1.00 0.00 H new ATOM 0 HB2 ARG A 79 1.888 2.736 -10.315 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.356 2.647 -12.001 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.480 4.982 -11.597 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.311 4.610 -9.893 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.375 3.612 -10.238 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.365 2.248 -10.674 1.00 0.00 H new ATOM 0 HE ARG A 79 4.915 2.531 -12.945 1.00 0.00 H new ATOM 0 HH11 ARG A 79 6.143 5.255 -11.034 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.172 5.854 -12.338 1.00 0.00 H new ATOM 0 HH21 ARG A 79 6.204 3.279 -14.610 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.206 4.718 -14.393 1.00 0.00 H new ATOM 1164 N HIS A 80 -0.118 5.491 -9.777 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.228 6.638 -8.898 1.00 0.00 C ATOM 1166 C HIS A 80 0.922 6.651 -7.888 1.00 0.00 C ATOM 1167 O HIS A 80 1.643 5.663 -7.762 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.551 6.631 -8.137 1.00 0.00 C ATOM 1169 CG HIS A 80 -2.807 6.446 -8.948 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.847 5.555 -8.679 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -3.154 7.114 -10.085 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.857 5.858 -9.510 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -4.408 6.704 -10.433 1.00 0.00 N ATOM 0 H HIS A 80 -0.760 4.729 -9.561 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.183 7.530 -9.523 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.509 5.836 -7.392 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.634 7.573 -7.594 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.548 7.835 -10.613 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.866 5.478 -9.441 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -4.918 6.998 -11.266 1.00 0.00 H new ATOM 1181 N VAL A 81 1.046 7.756 -7.135 1.00 0.00 N ATOM 1182 CA VAL A 81 2.106 7.978 -6.148 1.00 0.00 C ATOM 1183 C VAL A 81 2.468 6.698 -5.390 1.00 0.00 C ATOM 1184 O VAL A 81 3.584 6.204 -5.509 1.00 0.00 O ATOM 1185 CB VAL A 81 1.754 9.103 -5.144 1.00 0.00 C ATOM 1186 CG1 VAL A 81 3.019 9.897 -4.808 1.00 0.00 C ATOM 1187 CG2 VAL A 81 0.710 10.101 -5.633 1.00 0.00 C ATOM 0 H VAL A 81 0.393 8.537 -7.200 1.00 0.00 H new ATOM 0 HA VAL A 81 2.977 8.296 -6.721 1.00 0.00 H new ATOM 0 HB VAL A 81 1.329 8.589 -4.282 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.774 10.690 -4.101 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.759 9.231 -4.364 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.426 10.336 -5.719 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.532 10.849 -4.860 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.071 10.592 -6.537 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -0.220 9.577 -5.852 1.00 0.00 H new ATOM 1197 N GLY A 82 1.514 6.165 -4.619 1.00 0.00 N ATOM 1198 CA GLY A 82 1.738 4.971 -3.810 1.00 0.00 C ATOM 1199 C GLY A 82 1.023 3.755 -4.386 1.00 0.00 C ATOM 1200 O GLY A 82 0.457 2.965 -3.632 1.00 0.00 O ATOM 0 H GLY A 82 0.572 6.549 -4.541 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.807 4.769 -3.749 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.389 5.150 -2.793 1.00 0.00 H new ATOM 1204 N ASP A 83 1.037 3.586 -5.710 1.00 0.00 N ATOM 1205 CA ASP A 83 0.469 2.397 -6.330 1.00 0.00 C ATOM 1206 C ASP A 83 1.451 1.240 -6.264 1.00 0.00 C ATOM 1207 O ASP A 83 2.038 0.829 -7.262 1.00 0.00 O ATOM 1208 CB ASP A 83 0.031 2.709 -7.756 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.369 3.286 -7.798 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -2.012 3.445 -6.739 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.827 3.565 -8.920 1.00 0.00 O ATOM 0 H ASP A 83 1.435 4.257 -6.367 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.419 2.090 -5.777 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.729 3.415 -8.205 1.00 0.00 H new ATOM 0 HB3 ASP A 83 0.068 1.799 -8.355 1.00 0.00 H new ATOM 1216 N LEU A 84 1.554 0.660 -5.074 1.00 0.00 N ATOM 1217 CA LEU A 84 2.377 -0.507 -4.819 1.00 0.00 C ATOM 1218 C LEU A 84 1.506 -1.754 -4.994 1.00 0.00 C ATOM 1219 O LEU A 84 1.493 -2.639 -4.143 1.00 0.00 O ATOM 1220 CB LEU A 84 3.017 -0.372 -3.434 1.00 0.00 C ATOM 1221 CG LEU A 84 3.690 1.001 -3.231 1.00 0.00 C ATOM 1222 CD1 LEU A 84 4.375 1.049 -1.866 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.700 1.324 -4.336 1.00 0.00 C ATOM 0 H LEU A 84 1.058 0.996 -4.248 1.00 0.00 H new ATOM 0 HA LEU A 84 3.203 -0.597 -5.525 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.255 -0.517 -2.668 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.758 -1.160 -3.300 1.00 0.00 H new ATOM 0 HG LEU A 84 2.906 1.757 -3.278 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.848 2.022 -1.730 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.634 0.893 -1.082 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.132 0.267 -1.811 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.146 2.301 -4.147 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.482 0.564 -4.348 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.192 1.337 -5.300 1.00 0.00 H new ATOM 1235 N GLY A 85 0.780 -1.793 -6.120 1.00 0.00 N ATOM 1236 CA GLY A 85 -0.169 -2.824 -6.512 1.00 0.00 C ATOM 1237 C GLY A 85 -0.914 -3.460 -5.339 1.00 0.00 C ATOM 1238 O GLY A 85 -1.873 -2.897 -4.804 1.00 0.00 O ATOM 0 H GLY A 85 0.850 -1.055 -6.820 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.896 -2.392 -7.200 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.362 -3.604 -7.058 1.00 0.00 H new ATOM 1242 N ASN A 86 -0.481 -4.665 -4.974 1.00 0.00 N ATOM 1243 CA ASN A 86 -1.097 -5.510 -3.966 1.00 0.00 C ATOM 1244 C ASN A 86 -0.019 -6.194 -3.133 1.00 0.00 C ATOM 1245 O ASN A 86 1.154 -6.181 -3.503 1.00 0.00 O ATOM 1246 CB ASN A 86 -2.046 -6.521 -4.633 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.354 -7.410 -5.659 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -0.454 -8.170 -5.321 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -1.775 -7.348 -6.921 1.00 0.00 N ATOM 0 H ASN A 86 0.344 -5.093 -5.394 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.696 -4.900 -3.290 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.496 -7.148 -3.864 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.858 -5.981 -5.119 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.347 -7.942 -7.631 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.526 -6.707 -7.177 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.430 -6.770 -2.002 1.00 0.00 N ATOM 1257 CA VAL A 87 0.399 -7.563 -1.107 1.00 0.00 C ATOM 1258 C VAL A 87 -0.213 -8.954 -1.049 1.00 0.00 C ATOM 1259 O VAL A 87 -1.364 -9.116 -1.444 1.00 0.00 O ATOM 1260 CB VAL A 87 0.475 -6.934 0.296 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.198 -5.587 0.246 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.906 -6.794 0.949 1.00 0.00 C ATOM 0 H VAL A 87 -1.393 -6.690 -1.675 1.00 0.00 H new ATOM 0 HA VAL A 87 1.423 -7.606 -1.478 1.00 0.00 H new ATOM 0 HB VAL A 87 1.051 -7.615 0.922 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.241 -5.160 1.248 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.211 -5.731 -0.130 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.658 -4.909 -0.415 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.798 -6.345 1.936 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.539 -6.159 0.329 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.364 -7.778 1.046 1.00 0.00 H new ATOM 1272 N THR A 88 0.536 -9.927 -0.535 1.00 0.00 N ATOM 1273 CA THR A 88 0.173 -11.342 -0.514 1.00 0.00 C ATOM 1274 C THR A 88 0.009 -11.763 0.937 1.00 0.00 C ATOM 1275 O THR A 88 0.961 -11.643 1.700 1.00 0.00 O ATOM 1276 CB THR A 88 1.268 -12.157 -1.220 1.00 0.00 C ATOM 1277 OG1 THR A 88 1.608 -11.539 -2.447 1.00 0.00 O ATOM 1278 CG2 THR A 88 0.796 -13.579 -1.529 1.00 0.00 C ATOM 0 H THR A 88 1.444 -9.746 -0.107 1.00 0.00 H new ATOM 0 HA THR A 88 -0.764 -11.519 -1.042 1.00 0.00 H new ATOM 0 HB THR A 88 2.127 -12.198 -0.550 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.308 -12.061 -2.893 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.595 -14.127 -2.028 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.534 -14.085 -0.600 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.078 -13.539 -2.179 1.00 0.00 H new ATOM 1286 N ALA A 89 -1.190 -12.203 1.327 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.467 -12.660 2.679 1.00 0.00 C ATOM 1288 C ALA A 89 -1.333 -14.180 2.786 1.00 0.00 C ATOM 1289 O ALA A 89 -1.735 -14.905 1.874 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.860 -12.207 3.106 1.00 0.00 C ATOM 0 H ALA A 89 -1.997 -12.250 0.705 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.732 -12.217 3.351 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.060 -12.553 4.120 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.914 -11.119 3.077 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.603 -12.625 2.427 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.801 -14.628 3.928 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.669 -16.018 4.335 1.00 0.00 C ATOM 1298 C ASP A 90 -2.026 -16.630 4.658 1.00 0.00 C ATOM 1299 O ASP A 90 -3.023 -15.935 4.850 1.00 0.00 O ATOM 1300 CB ASP A 90 0.202 -16.114 5.607 1.00 0.00 C ATOM 1301 CG ASP A 90 1.693 -16.197 5.329 1.00 0.00 C ATOM 1302 OD1 ASP A 90 2.051 -16.972 4.416 1.00 0.00 O ATOM 1303 OD2 ASP A 90 2.442 -15.552 6.092 1.00 0.00 O ATOM 0 H ASP A 90 -0.431 -13.987 4.630 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.211 -16.557 3.506 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.008 -15.244 6.235 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -0.101 -16.993 6.177 1.00 0.00 H new ATOM 1308 N LYS A 91 -2.004 -17.946 4.871 1.00 0.00 N ATOM 1309 CA LYS A 91 -3.081 -18.760 5.400 1.00 0.00 C ATOM 1310 C LYS A 91 -3.519 -18.335 6.802 1.00 0.00 C ATOM 1311 O LYS A 91 -4.537 -18.828 7.287 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.625 -20.224 5.370 1.00 0.00 C ATOM 1313 CG LYS A 91 -1.405 -20.528 6.259 1.00 0.00 C ATOM 1314 CD LYS A 91 -1.662 -21.611 7.321 1.00 0.00 C ATOM 1315 CE LYS A 91 -2.490 -21.120 8.521 1.00 0.00 C ATOM 1316 NZ LYS A 91 -3.953 -21.190 8.327 1.00 0.00 N ATOM 0 H LYS A 91 -1.175 -18.502 4.662 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.964 -18.625 4.776 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.455 -20.857 5.684 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.387 -20.497 4.342 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.576 -20.844 5.626 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.094 -19.610 6.758 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -2.179 -22.449 6.854 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.705 -21.987 7.682 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -2.224 -21.712 9.396 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -2.214 -20.088 8.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -4.394 -21.622 9.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -4.332 -20.231 8.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -4.165 -21.767 7.488 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.726 -17.499 7.480 1.00 0.00 N ATOM 1331 CA ASP A 92 -3.032 -16.942 8.793 1.00 0.00 C ATOM 1332 C ASP A 92 -3.547 -15.506 8.654 1.00 0.00 C ATOM 1333 O ASP A 92 -3.887 -14.863 9.644 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.782 -17.015 9.688 1.00 0.00 C ATOM 1335 CG ASP A 92 -2.050 -17.819 10.954 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -2.296 -19.038 10.807 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -2.011 -17.209 12.042 1.00 0.00 O ATOM 0 H ASP A 92 -1.827 -17.184 7.115 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.822 -17.527 9.264 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.962 -17.470 9.133 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.465 -16.007 9.956 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.610 -14.988 7.422 1.00 0.00 N ATOM 1343 CA GLY A 93 -4.167 -13.674 7.154 1.00 0.00 C ATOM 1344 C GLY A 93 -3.174 -12.544 7.412 1.00 0.00 C ATOM 1345 O GLY A 93 -3.576 -11.403 7.663 1.00 0.00 O ATOM 0 H GLY A 93 -3.275 -15.473 6.590 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.498 -13.630 6.116 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.049 -13.525 7.777 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.879 -12.864 7.332 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.767 -11.948 7.532 1.00 0.00 C ATOM 1351 C VAL A 94 -0.151 -11.669 6.167 1.00 0.00 C ATOM 1352 O VAL A 94 0.293 -12.606 5.514 1.00 0.00 O ATOM 1353 CB VAL A 94 0.263 -12.586 8.483 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.541 -11.736 8.617 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.359 -12.824 9.865 1.00 0.00 C ATOM 0 H VAL A 94 -1.570 -13.812 7.116 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.102 -11.014 7.983 1.00 0.00 H new ATOM 0 HB VAL A 94 0.552 -13.542 8.046 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.236 -12.228 9.298 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.009 -11.626 7.639 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.284 -10.752 9.010 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.382 -13.275 10.525 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.687 -11.873 10.285 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.214 -13.493 9.769 1.00 0.00 H new ATOM 1365 N ALA A 95 -0.136 -10.409 5.725 1.00 0.00 N ATOM 1366 CA ALA A 95 0.612 -9.988 4.549 1.00 0.00 C ATOM 1367 C ALA A 95 1.855 -9.270 5.044 1.00 0.00 C ATOM 1368 O ALA A 95 1.744 -8.187 5.622 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.240 -9.094 3.633 1.00 0.00 C ATOM 0 H ALA A 95 -0.647 -9.652 6.179 1.00 0.00 H new ATOM 0 HA ALA A 95 0.893 -10.850 3.943 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.348 -8.797 2.765 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.121 -9.645 3.304 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.552 -8.205 4.181 1.00 0.00 H new ATOM 1375 N ASP A 96 3.022 -9.882 4.844 1.00 0.00 N ATOM 1376 CA ASP A 96 4.303 -9.245 5.046 1.00 0.00 C ATOM 1377 C ASP A 96 4.574 -8.361 3.829 1.00 0.00 C ATOM 1378 O ASP A 96 4.448 -8.792 2.685 1.00 0.00 O ATOM 1379 CB ASP A 96 5.394 -10.300 5.266 1.00 0.00 C ATOM 1380 CG ASP A 96 5.552 -11.235 4.076 1.00 0.00 C ATOM 1381 OD1 ASP A 96 4.505 -11.783 3.659 1.00 0.00 O ATOM 1382 OD2 ASP A 96 6.705 -11.385 3.619 1.00 0.00 O ATOM 0 H ASP A 96 3.094 -10.850 4.532 1.00 0.00 H new ATOM 0 HA ASP A 96 4.301 -8.623 5.941 1.00 0.00 H new ATOM 0 HB2 ASP A 96 6.343 -9.801 5.460 1.00 0.00 H new ATOM 0 HB3 ASP A 96 5.155 -10.885 6.154 1.00 0.00 H new ATOM 1387 N VAL A 97 4.889 -7.090 4.072 1.00 0.00 N ATOM 1388 CA VAL A 97 5.258 -6.149 3.026 1.00 0.00 C ATOM 1389 C VAL A 97 6.773 -6.027 3.070 1.00 0.00 C ATOM 1390 O VAL A 97 7.343 -6.016 4.160 1.00 0.00 O ATOM 1391 CB VAL A 97 4.565 -4.789 3.229 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.659 -3.942 1.953 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.096 -4.981 3.616 1.00 0.00 C ATOM 0 H VAL A 97 4.894 -6.685 5.008 1.00 0.00 H new ATOM 0 HA VAL A 97 4.932 -6.501 2.047 1.00 0.00 H new ATOM 0 HB VAL A 97 5.076 -4.269 4.039 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.164 -2.984 2.115 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.707 -3.772 1.706 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.173 -4.467 1.131 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.626 -4.007 3.754 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.579 -5.524 2.825 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.036 -5.548 4.545 1.00 0.00 H new ATOM 1403 N SER A 98 7.412 -5.936 1.903 1.00 0.00 N ATOM 1404 CA SER A 98 8.847 -5.759 1.766 1.00 0.00 C ATOM 1405 C SER A 98 9.126 -5.245 0.354 1.00 0.00 C ATOM 1406 O SER A 98 9.084 -6.019 -0.601 1.00 0.00 O ATOM 1407 CB SER A 98 9.568 -7.087 2.039 1.00 0.00 C ATOM 1408 OG SER A 98 10.965 -6.873 2.148 1.00 0.00 O ATOM 0 H SER A 98 6.927 -5.985 1.007 1.00 0.00 H new ATOM 0 HA SER A 98 9.221 -5.036 2.491 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.188 -7.533 2.958 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.363 -7.793 1.234 1.00 0.00 H new ATOM 0 HG SER A 98 11.414 -7.726 2.324 1.00 0.00 H new ATOM 1414 N ILE A 99 9.367 -3.941 0.205 1.00 0.00 N ATOM 1415 CA ILE A 99 9.709 -3.311 -1.065 1.00 0.00 C ATOM 1416 C ILE A 99 10.535 -2.052 -0.774 1.00 0.00 C ATOM 1417 O ILE A 99 10.820 -1.752 0.385 1.00 0.00 O ATOM 1418 CB ILE A 99 8.421 -3.083 -1.893 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.713 -2.630 -3.332 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.445 -2.104 -1.229 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.600 -3.012 -4.314 1.00 0.00 C ATOM 0 H ILE A 99 9.328 -3.282 0.983 1.00 0.00 H new ATOM 0 HA ILE A 99 10.336 -3.948 -1.689 1.00 0.00 H new ATOM 0 HB ILE A 99 7.941 -4.061 -1.932 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.849 -1.549 -3.347 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.652 -3.073 -3.664 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.563 -1.987 -1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.147 -2.492 -0.255 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.931 -1.137 -1.101 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.862 -2.666 -5.314 1.00 0.00 H new ATOM 0 HD12 ILE A 99 7.480 -4.095 -4.325 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.665 -2.547 -4.003 1.00 0.00 H new ATOM 1433 N GLU A 100 10.973 -1.337 -1.804 1.00 0.00 N ATOM 1434 CA GLU A 100 11.623 -0.055 -1.700 1.00 0.00 C ATOM 1435 C GLU A 100 11.197 0.767 -2.906 1.00 0.00 C ATOM 1436 O GLU A 100 10.954 0.187 -3.964 1.00 0.00 O ATOM 1437 CB GLU A 100 13.150 -0.256 -1.681 1.00 0.00 C ATOM 1438 CG GLU A 100 13.671 -1.236 -2.751 1.00 0.00 C ATOM 1439 CD GLU A 100 15.185 -1.307 -2.746 1.00 0.00 C ATOM 1440 OE1 GLU A 100 15.813 -0.299 -3.117 1.00 0.00 O ATOM 1441 OE2 GLU A 100 15.684 -2.367 -2.314 1.00 0.00 O ATOM 0 H GLU A 100 10.877 -1.655 -2.768 1.00 0.00 H new ATOM 0 HA GLU A 100 11.343 0.461 -0.782 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.634 0.710 -1.823 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.445 -0.619 -0.697 1.00 0.00 H new ATOM 0 HG2 GLU A 100 13.258 -2.228 -2.569 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.323 -0.921 -3.735 1.00 0.00 H new ATOM 1448 N ASP A 101 11.108 2.086 -2.747 1.00 0.00 N ATOM 1449 CA ASP A 101 10.856 3.009 -3.844 1.00 0.00 C ATOM 1450 C ASP A 101 11.830 4.174 -3.711 1.00 0.00 C ATOM 1451 O ASP A 101 12.251 4.502 -2.606 1.00 0.00 O ATOM 1452 CB ASP A 101 9.424 3.547 -3.777 1.00 0.00 C ATOM 1453 CG ASP A 101 8.375 2.512 -4.155 1.00 0.00 C ATOM 1454 OD1 ASP A 101 8.054 2.465 -5.362 1.00 0.00 O ATOM 1455 OD2 ASP A 101 7.890 1.822 -3.233 1.00 0.00 O ATOM 0 H ASP A 101 11.210 2.546 -1.842 1.00 0.00 H new ATOM 0 HA ASP A 101 10.988 2.492 -4.794 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.224 3.905 -2.767 1.00 0.00 H new ATOM 0 HB3 ASP A 101 9.334 4.405 -4.443 1.00 0.00 H new ATOM 1460 N SER A 102 12.157 4.822 -4.832 1.00 0.00 N ATOM 1461 CA SER A 102 12.961 6.033 -4.851 1.00 0.00 C ATOM 1462 C SER A 102 12.128 7.254 -5.234 1.00 0.00 C ATOM 1463 O SER A 102 12.706 8.273 -5.610 1.00 0.00 O ATOM 1464 CB SER A 102 14.158 5.847 -5.790 1.00 0.00 C ATOM 1465 OG SER A 102 15.104 6.875 -5.571 1.00 0.00 O ATOM 0 H SER A 102 11.865 4.512 -5.759 1.00 0.00 H new ATOM 0 HA SER A 102 13.337 6.216 -3.844 1.00 0.00 H new ATOM 0 HB2 SER A 102 14.619 4.874 -5.618 1.00 0.00 H new ATOM 0 HB3 SER A 102 13.824 5.863 -6.827 1.00 0.00 H new ATOM 0 HG SER A 102 14.641 7.736 -5.504 1.00 0.00 H new ATOM 1471 N VAL A 103 10.796 7.144 -5.166 1.00 0.00 N ATOM 1472 CA VAL A 103 9.870 8.226 -5.482 1.00 0.00 C ATOM 1473 C VAL A 103 9.064 8.599 -4.234 1.00 0.00 C ATOM 1474 O VAL A 103 9.167 9.726 -3.758 1.00 0.00 O ATOM 1475 CB VAL A 103 9.043 7.881 -6.738 1.00 0.00 C ATOM 1476 CG1 VAL A 103 8.028 6.745 -6.565 1.00 0.00 C ATOM 1477 CG2 VAL A 103 8.328 9.123 -7.283 1.00 0.00 C ATOM 0 H VAL A 103 10.328 6.283 -4.884 1.00 0.00 H new ATOM 0 HA VAL A 103 10.408 9.134 -5.755 1.00 0.00 H new ATOM 0 HB VAL A 103 9.782 7.516 -7.451 1.00 0.00 H new ATOM 0 HG11 VAL A 103 7.500 6.582 -7.505 1.00 0.00 H new ATOM 0 HG12 VAL A 103 8.549 5.832 -6.279 1.00 0.00 H new ATOM 0 HG13 VAL A 103 7.312 7.012 -5.788 1.00 0.00 H new ATOM 0 HG21 VAL A 103 7.752 8.852 -8.168 1.00 0.00 H new ATOM 0 HG22 VAL A 103 7.657 9.520 -6.521 1.00 0.00 H new ATOM 0 HG23 VAL A 103 9.066 9.881 -7.548 1.00 0.00 H new ATOM 1487 N ILE A 104 8.298 7.668 -3.655 1.00 0.00 N ATOM 1488 CA ILE A 104 7.671 7.889 -2.374 1.00 0.00 C ATOM 1489 C ILE A 104 8.746 7.759 -1.296 1.00 0.00 C ATOM 1490 O ILE A 104 9.695 6.991 -1.449 1.00 0.00 O ATOM 1491 CB ILE A 104 6.448 6.966 -2.224 1.00 0.00 C ATOM 1492 CG1 ILE A 104 6.679 5.452 -2.377 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.394 7.403 -3.238 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.099 4.826 -1.051 1.00 0.00 C ATOM 0 H ILE A 104 8.105 6.755 -4.066 1.00 0.00 H new ATOM 0 HA ILE A 104 7.259 8.893 -2.273 1.00 0.00 H new ATOM 0 HB ILE A 104 6.141 7.084 -1.185 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.766 4.976 -2.735 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.448 5.272 -3.128 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.517 6.762 -3.150 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.109 8.437 -3.044 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.803 7.322 -4.245 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.256 3.756 -1.187 1.00 0.00 H new ATOM 0 HD12 ILE A 104 8.025 5.288 -0.708 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.317 4.987 -0.309 1.00 0.00 H new ATOM 1506 N SER A 105 8.659 8.587 -0.257 1.00 0.00 N ATOM 1507 CA SER A 105 9.735 8.909 0.656 1.00 0.00 C ATOM 1508 C SER A 105 9.075 9.711 1.773 1.00 0.00 C ATOM 1509 O SER A 105 7.990 10.240 1.549 1.00 0.00 O ATOM 1510 CB SER A 105 10.766 9.733 -0.128 1.00 0.00 C ATOM 1511 OG SER A 105 11.616 8.862 -0.850 1.00 0.00 O ATOM 0 H SER A 105 7.792 9.071 -0.025 1.00 0.00 H new ATOM 0 HA SER A 105 10.253 8.047 1.076 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.259 10.413 -0.812 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.353 10.347 0.556 1.00 0.00 H new ATOM 0 HG SER A 105 11.109 8.075 -1.138 1.00 0.00 H new ATOM 1517 N LEU A 106 9.681 9.817 2.957 1.00 0.00 N ATOM 1518 CA LEU A 106 9.137 10.610 4.065 1.00 0.00 C ATOM 1519 C LEU A 106 9.644 12.052 3.989 1.00 0.00 C ATOM 1520 O LEU A 106 9.438 12.844 4.907 1.00 0.00 O ATOM 1521 CB LEU A 106 9.371 9.952 5.444 1.00 0.00 C ATOM 1522 CG LEU A 106 10.630 9.085 5.610 1.00 0.00 C ATOM 1523 CD1 LEU A 106 11.117 9.134 7.064 1.00 0.00 C ATOM 1524 CD2 LEU A 106 10.309 7.625 5.263 1.00 0.00 C ATOM 0 H LEU A 106 10.564 9.356 3.177 1.00 0.00 H new ATOM 0 HA LEU A 106 8.053 10.640 3.954 1.00 0.00 H new ATOM 0 HB2 LEU A 106 9.406 10.743 6.193 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.503 9.333 5.674 1.00 0.00 H new ATOM 0 HG LEU A 106 11.401 9.471 4.944 1.00 0.00 H new ATOM 0 HD11 LEU A 106 12.009 8.517 7.170 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.354 10.163 7.334 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.335 8.757 7.723 1.00 0.00 H new ATOM 0 HD21 LEU A 106 11.206 7.017 5.383 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.529 7.256 5.929 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.964 7.564 4.231 1.00 0.00 H new ATOM 1566 N HIS A 110 7.561 14.070 -1.985 1.00 0.00 N ATOM 1567 CA HIS A 110 6.412 13.192 -1.827 1.00 0.00 C ATOM 1568 C HIS A 110 6.135 12.734 -0.384 1.00 0.00 C ATOM 1569 O HIS A 110 5.227 11.914 -0.227 1.00 0.00 O ATOM 1570 CB HIS A 110 6.566 11.990 -2.773 1.00 0.00 C ATOM 1571 CG HIS A 110 6.328 12.327 -4.224 1.00 0.00 C ATOM 1572 ND1 HIS A 110 5.174 12.871 -4.742 1.00 0.00 N ATOM 1573 CD2 HIS A 110 7.156 12.041 -5.277 1.00 0.00 C ATOM 1574 CE1 HIS A 110 5.308 12.910 -6.079 1.00 0.00 C ATOM 1575 NE2 HIS A 110 6.489 12.399 -6.455 1.00 0.00 N ATOM 0 HA HIS A 110 5.534 13.781 -2.091 1.00 0.00 H new ATOM 0 HB2 HIS A 110 7.570 11.579 -2.664 1.00 0.00 H new ATOM 0 HB3 HIS A 110 5.868 11.209 -2.471 1.00 0.00 H new ATOM 0 HD2 HIS A 110 8.146 11.615 -5.211 1.00 0.00 H new ATOM 0 HE1 HIS A 110 4.565 13.300 -6.758 1.00 0.00 H new ATOM 0 HE2 HIS A 110 6.833 12.292 -7.409 1.00 0.00 H new ATOM 1583 N SER A 111 6.830 13.285 0.625 1.00 0.00 N ATOM 1584 CA SER A 111 6.705 13.011 2.058 1.00 0.00 C ATOM 1585 C SER A 111 5.420 12.261 2.421 1.00 0.00 C ATOM 1586 O SER A 111 4.332 12.834 2.460 1.00 0.00 O ATOM 1587 CB SER A 111 6.826 14.299 2.881 1.00 0.00 C ATOM 1588 OG SER A 111 6.965 13.982 4.258 1.00 0.00 O ATOM 0 H SER A 111 7.547 13.986 0.441 1.00 0.00 H new ATOM 0 HA SER A 111 7.535 12.350 2.310 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.686 14.877 2.543 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.944 14.922 2.730 1.00 0.00 H new ATOM 0 HG SER A 111 7.892 13.723 4.442 1.00 0.00 H new ATOM 1594 N ILE A 112 5.554 10.962 2.674 1.00 0.00 N ATOM 1595 CA ILE A 112 4.459 10.096 3.075 1.00 0.00 C ATOM 1596 C ILE A 112 3.985 10.389 4.498 1.00 0.00 C ATOM 1597 O ILE A 112 2.920 9.926 4.894 1.00 0.00 O ATOM 1598 CB ILE A 112 4.865 8.626 2.901 1.00 0.00 C ATOM 1599 CG1 ILE A 112 6.055 8.251 3.801 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.145 8.362 1.420 1.00 0.00 C ATOM 1601 CD1 ILE A 112 6.354 6.756 3.775 1.00 0.00 C ATOM 0 H ILE A 112 6.448 10.476 2.603 1.00 0.00 H new ATOM 0 HA ILE A 112 3.609 10.300 2.424 1.00 0.00 H new ATOM 0 HB ILE A 112 4.044 7.984 3.221 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.939 8.801 3.478 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.844 8.559 4.825 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.435 7.320 1.285 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.247 8.568 0.838 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.953 9.010 1.081 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.202 6.543 4.426 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.481 6.204 4.124 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.593 6.450 2.756 1.00 0.00 H new ATOM 1613 N ILE A 113 4.768 11.141 5.270 1.00 0.00 N ATOM 1614 CA ILE A 113 4.421 11.532 6.623 1.00 0.00 C ATOM 1615 C ILE A 113 3.142 12.353 6.536 1.00 0.00 C ATOM 1616 O ILE A 113 3.143 13.439 5.960 1.00 0.00 O ATOM 1617 CB ILE A 113 5.563 12.348 7.259 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.900 11.593 7.271 1.00 0.00 C ATOM 1619 CG2 ILE A 113 5.196 12.816 8.674 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.887 10.292 8.079 1.00 0.00 C ATOM 0 H ILE A 113 5.673 11.498 4.963 1.00 0.00 H new ATOM 0 HA ILE A 113 4.268 10.657 7.255 1.00 0.00 H new ATOM 0 HB ILE A 113 5.697 13.225 6.626 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.183 11.365 6.243 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.670 12.250 7.676 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.023 13.389 9.094 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.306 13.443 8.630 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.998 11.949 9.304 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.871 9.825 8.033 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.637 10.511 9.117 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.143 9.613 7.663 1.00 0.00 H new ATOM 1632 N GLY A 114 2.052 11.814 7.074 1.00 0.00 N ATOM 1633 CA GLY A 114 0.746 12.432 7.008 1.00 0.00 C ATOM 1634 C GLY A 114 -0.221 11.622 6.149 1.00 0.00 C ATOM 1635 O GLY A 114 -1.426 11.696 6.357 1.00 0.00 O ATOM 0 H GLY A 114 2.059 10.924 7.573 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.341 12.533 8.015 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.840 13.438 6.599 1.00 0.00 H new ATOM 1639 N ARG A 115 0.286 10.860 5.175 1.00 0.00 N ATOM 1640 CA ARG A 115 -0.558 10.156 4.222 1.00 0.00 C ATOM 1641 C ARG A 115 -1.318 8.995 4.859 1.00 0.00 C ATOM 1642 O ARG A 115 -0.932 8.474 5.905 1.00 0.00 O ATOM 1643 CB ARG A 115 0.237 9.734 2.984 1.00 0.00 C ATOM 1644 CG ARG A 115 0.819 10.928 2.224 1.00 0.00 C ATOM 1645 CD ARG A 115 1.363 10.453 0.875 1.00 0.00 C ATOM 1646 NE ARG A 115 2.316 11.411 0.296 1.00 0.00 N ATOM 1647 CZ ARG A 115 1.994 12.447 -0.493 1.00 0.00 C ATOM 1648 NH1 ARG A 115 0.760 12.922 -0.587 1.00 0.00 N ATOM 1649 NH2 ARG A 115 2.967 12.998 -1.219 1.00 0.00 N ATOM 0 H ARG A 115 1.286 10.718 5.031 1.00 0.00 H new ATOM 0 HA ARG A 115 -1.322 10.857 3.887 1.00 0.00 H new ATOM 0 HB2 ARG A 115 1.047 9.070 3.286 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -0.411 9.164 2.318 1.00 0.00 H new ATOM 0 HG2 ARG A 115 0.051 11.687 2.073 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.615 11.392 2.807 1.00 0.00 H new ATOM 0 HD2 ARG A 115 1.852 9.487 1.001 1.00 0.00 H new ATOM 0 HD3 ARG A 115 0.535 10.303 0.183 1.00 0.00 H new ATOM 0 HE ARG A 115 3.304 11.277 0.512 1.00 0.00 H new ATOM 0 HH11 ARG A 115 0.007 12.497 -0.045 1.00 0.00 H new ATOM 0 HH12 ARG A 115 0.563 13.712 -1.201 1.00 0.00 H new ATOM 0 HH21 ARG A 115 3.917 12.630 -1.162 1.00 0.00 H new ATOM 0 HH22 ARG A 115 2.762 13.788 -1.831 1.00 0.00 H new ATOM 1663 N THR A 116 -2.410 8.603 4.199 1.00 0.00 N ATOM 1664 CA THR A 116 -3.328 7.567 4.613 1.00 0.00 C ATOM 1665 C THR A 116 -3.039 6.283 3.828 1.00 0.00 C ATOM 1666 O THR A 116 -3.407 6.166 2.660 1.00 0.00 O ATOM 1667 CB THR A 116 -4.754 8.091 4.410 1.00 0.00 C ATOM 1668 OG1 THR A 116 -5.071 8.980 5.460 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.827 7.001 4.397 1.00 0.00 C ATOM 0 H THR A 116 -2.683 9.030 3.314 1.00 0.00 H new ATOM 0 HA THR A 116 -3.208 7.317 5.667 1.00 0.00 H new ATOM 0 HB THR A 116 -4.759 8.570 3.431 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.981 9.321 5.336 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.806 7.456 4.249 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.625 6.302 3.586 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.815 6.467 5.347 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.380 5.313 4.463 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.088 4.017 3.872 1.00 0.00 C ATOM 1679 C LEU A 117 -3.276 3.089 4.095 1.00 0.00 C ATOM 1680 O LEU A 117 -3.804 3.037 5.207 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.827 3.436 4.508 1.00 0.00 C ATOM 1682 CG LEU A 117 -0.195 2.369 3.599 1.00 0.00 C ATOM 1683 CD1 LEU A 117 1.004 2.961 2.856 1.00 0.00 C ATOM 1684 CD2 LEU A 117 0.272 1.181 4.434 1.00 0.00 C ATOM 0 H LEU A 117 -2.031 5.412 5.416 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.917 4.125 2.801 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.108 4.234 4.693 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.072 2.997 5.475 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.943 2.036 2.880 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.447 2.199 2.214 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.675 3.803 2.247 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.746 3.303 3.577 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.718 0.431 3.781 1.00 0.00 H new ATOM 0 HD22 LEU A 117 1.012 1.516 5.161 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.580 0.747 4.957 1.00 0.00 H new ATOM 1696 N VAL A 118 -3.715 2.368 3.061 1.00 0.00 N ATOM 1697 CA VAL A 118 -4.870 1.492 3.149 1.00 0.00 C ATOM 1698 C VAL A 118 -4.630 0.224 2.325 1.00 0.00 C ATOM 1699 O VAL A 118 -3.836 0.231 1.381 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.153 2.247 2.735 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -6.192 3.717 3.172 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.420 2.190 1.232 1.00 0.00 C ATOM 0 H VAL A 118 -3.275 2.380 2.141 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.015 1.178 4.183 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.936 1.710 3.271 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.126 4.170 2.841 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -6.126 3.776 4.258 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -5.352 4.251 2.728 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.334 2.738 1.004 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -5.584 2.640 0.697 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -6.533 1.151 0.922 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.334 -0.856 2.678 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.372 -2.083 1.883 1.00 0.00 C ATOM 1714 C VAL A 119 -6.731 -2.250 1.236 1.00 0.00 C ATOM 1715 O VAL A 119 -7.601 -1.410 1.429 1.00 0.00 O ATOM 1716 CB VAL A 119 -5.035 -3.334 2.710 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -3.551 -3.625 2.583 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -5.528 -3.241 4.152 1.00 0.00 C ATOM 0 H VAL A 119 -5.896 -0.902 3.528 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.606 -1.983 1.114 1.00 0.00 H new ATOM 0 HB VAL A 119 -5.580 -4.188 2.307 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.303 -4.511 3.167 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.303 -3.799 1.536 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.980 -2.774 2.955 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -5.262 -4.152 4.687 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.064 -2.384 4.641 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -6.611 -3.120 4.159 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.899 -3.342 0.483 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.135 -3.697 -0.193 1.00 0.00 C ATOM 1730 C HIS A 120 -8.558 -5.152 -0.086 1.00 0.00 C ATOM 1731 O HIS A 120 -7.754 -6.028 0.220 1.00 0.00 O ATOM 1732 CB HIS A 120 -8.079 -3.316 -1.662 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.139 -1.849 -1.869 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.236 -1.112 -2.205 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -7.039 -1.072 -1.785 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.824 0.147 -2.375 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.492 0.191 -2.138 1.00 0.00 N ATOM 0 H HIS A 120 -6.152 -4.019 0.327 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.891 -3.123 0.343 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.160 -3.705 -2.100 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.908 -3.789 -2.189 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.190 -1.457 -2.307 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.037 -1.365 -1.507 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.446 0.985 -2.653 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.839 -5.397 -0.370 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.444 -6.715 -0.315 1.00 0.00 C ATOM 1747 C GLU A 121 -9.905 -7.624 -1.417 1.00 0.00 C ATOM 1748 O GLU A 121 -9.213 -8.595 -1.132 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.970 -6.580 -0.406 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.662 -7.913 -0.092 1.00 0.00 C ATOM 1751 CD GLU A 121 -14.163 -7.739 0.093 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.669 -6.675 -0.330 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -14.769 -8.679 0.645 1.00 0.00 O ATOM 0 H GLU A 121 -10.492 -4.665 -0.650 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.183 -7.180 0.636 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.313 -5.816 0.291 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.250 -6.248 -1.406 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -12.475 -8.620 -0.901 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.231 -8.342 0.813 1.00 0.00 H new ATOM 1760 N LYS A 122 -10.230 -7.324 -2.669 1.00 0.00 N ATOM 1761 CA LYS A 122 -9.775 -8.087 -3.817 1.00 0.00 C ATOM 1762 C LYS A 122 -8.327 -7.691 -4.155 1.00 0.00 C ATOM 1763 O LYS A 122 -7.720 -6.820 -3.521 1.00 0.00 O ATOM 1764 CB LYS A 122 -10.721 -7.833 -5.004 1.00 0.00 C ATOM 1765 CG LYS A 122 -12.215 -8.100 -4.759 1.00 0.00 C ATOM 1766 CD LYS A 122 -12.612 -9.563 -5.003 1.00 0.00 C ATOM 1767 CE LYS A 122 -14.129 -9.642 -5.247 1.00 0.00 C ATOM 1768 NZ LYS A 122 -14.587 -11.018 -5.529 1.00 0.00 N ATOM 0 H LYS A 122 -10.825 -6.533 -2.915 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.789 -9.153 -3.592 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.606 -6.795 -5.316 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -10.396 -8.454 -5.839 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.463 -7.828 -3.733 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.805 -7.456 -5.411 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.072 -9.960 -5.863 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.337 -10.175 -4.144 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -14.655 -9.260 -4.372 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -14.393 -8.996 -6.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -15.615 -11.016 -5.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -14.108 -11.376 -6.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -14.361 -11.632 -4.720 1.00 0.00 H new ATOM 1782 N ALA A 123 -7.785 -8.338 -5.187 1.00 0.00 N ATOM 1783 CA ALA A 123 -6.496 -8.008 -5.763 1.00 0.00 C ATOM 1784 C ALA A 123 -6.583 -6.685 -6.517 1.00 0.00 C ATOM 1785 O ALA A 123 -7.640 -6.336 -7.036 1.00 0.00 O ATOM 1786 CB ALA A 123 -6.102 -9.107 -6.749 1.00 0.00 C ATOM 0 H ALA A 123 -8.245 -9.121 -5.650 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.757 -7.923 -4.966 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -5.133 -8.870 -7.190 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -6.039 -10.061 -6.225 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.852 -9.175 -7.537 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.455 -5.983 -6.614 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.294 -4.868 -7.520 1.00 0.00 C ATOM 1794 C ASP A 124 -5.264 -5.356 -8.974 1.00 0.00 C ATOM 1795 O ASP A 124 -4.532 -6.294 -9.291 1.00 0.00 O ATOM 1796 CB ASP A 124 -3.984 -4.175 -7.169 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.970 -2.836 -7.846 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -3.841 -2.781 -9.081 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -4.207 -1.837 -7.144 1.00 0.00 O ATOM 0 H ASP A 124 -4.624 -6.181 -6.056 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.131 -4.177 -7.421 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -3.893 -4.057 -6.089 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.136 -4.776 -7.496 1.00 0.00 H new ATOM 1804 N ASP A 125 -6.038 -4.704 -9.843 1.00 0.00 N ATOM 1805 CA ASP A 125 -6.172 -4.982 -11.271 1.00 0.00 C ATOM 1806 C ASP A 125 -4.965 -4.497 -12.088 1.00 0.00 C ATOM 1807 O ASP A 125 -5.007 -4.529 -13.315 1.00 0.00 O ATOM 1808 CB ASP A 125 -7.468 -4.319 -11.783 1.00 0.00 C ATOM 1809 CG ASP A 125 -8.220 -5.128 -12.830 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -7.564 -5.780 -13.668 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -9.467 -5.051 -12.774 1.00 0.00 O ATOM 0 H ASP A 125 -6.622 -3.921 -9.550 1.00 0.00 H new ATOM 0 HA ASP A 125 -6.215 -6.063 -11.402 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -8.130 -4.141 -10.935 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.221 -3.344 -12.204 1.00 0.00 H new ATOM 1816 N LEU A 126 -3.911 -3.967 -11.451 1.00 0.00 N ATOM 1817 CA LEU A 126 -2.763 -3.372 -12.130 1.00 0.00 C ATOM 1818 C LEU A 126 -3.248 -2.385 -13.198 1.00 0.00 C ATOM 1819 O LEU A 126 -2.730 -2.304 -14.307 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.830 -4.483 -12.647 1.00 0.00 C ATOM 1821 CG LEU A 126 -0.746 -4.916 -11.640 1.00 0.00 C ATOM 1822 CD1 LEU A 126 0.447 -3.980 -11.740 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -1.179 -4.979 -10.167 1.00 0.00 C ATOM 0 H LEU A 126 -3.836 -3.942 -10.434 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.159 -2.782 -11.440 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.431 -5.352 -12.913 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.345 -4.139 -13.561 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.507 -5.940 -11.927 1.00 0.00 H new ATOM 0 HD11 LEU A 126 1.212 -4.288 -11.027 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.856 -4.018 -12.750 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.130 -2.962 -11.515 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.336 -5.295 -9.553 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.514 -3.993 -9.844 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.995 -5.694 -10.058 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.298 -1.642 -12.839 1.00 0.00 N ATOM 1836 CA GLY A 127 -4.863 -0.580 -13.650 1.00 0.00 C ATOM 1837 C GLY A 127 -5.308 -1.010 -15.045 1.00 0.00 C ATOM 1838 O GLY A 127 -5.450 -0.143 -15.906 1.00 0.00 O ATOM 0 H GLY A 127 -4.785 -1.772 -11.952 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -5.719 -0.157 -13.125 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -4.124 0.216 -13.748 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.564 -2.305 -15.284 1.00 0.00 N ATOM 1843 CA LYS A 128 -5.849 -2.802 -16.629 1.00 0.00 C ATOM 1844 C LYS A 128 -7.189 -3.538 -16.730 1.00 0.00 C ATOM 1845 O LYS A 128 -7.410 -4.263 -17.697 1.00 0.00 O ATOM 1846 CB LYS A 128 -4.670 -3.647 -17.137 1.00 0.00 C ATOM 1847 CG LYS A 128 -4.330 -4.793 -16.180 1.00 0.00 C ATOM 1848 CD LYS A 128 -3.583 -5.913 -16.901 1.00 0.00 C ATOM 1849 CE LYS A 128 -3.180 -6.977 -15.871 1.00 0.00 C ATOM 1850 NZ LYS A 128 -2.658 -8.197 -16.517 1.00 0.00 N ATOM 0 H LYS A 128 -5.578 -3.023 -14.560 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.959 -1.938 -17.284 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -4.913 -4.054 -18.118 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -3.795 -3.009 -17.264 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.720 -4.416 -15.359 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -5.246 -5.188 -15.741 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -4.215 -6.354 -17.672 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -2.699 -5.517 -17.401 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -2.422 -6.567 -15.203 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -4.043 -7.232 -15.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -2.397 -8.891 -15.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -3.389 -8.603 -17.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -1.819 -7.958 -17.084 1.00 0.00 H new ATOM 1864 N GLY A 129 -8.117 -3.317 -15.793 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.433 -3.943 -15.876 1.00 0.00 C ATOM 1866 C GLY A 129 -10.323 -3.303 -16.945 1.00 0.00 C ATOM 1867 O GLY A 129 -11.381 -3.835 -17.268 1.00 0.00 O ATOM 0 H GLY A 129 -7.981 -2.717 -14.980 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -9.313 -5.004 -16.096 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -9.927 -3.872 -14.907 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.920 -2.147 -17.485 1.00 0.00 N ATOM 1872 CA GLY A 130 -10.625 -1.498 -18.582 1.00 0.00 C ATOM 1873 C GLY A 130 -11.919 -0.821 -18.133 1.00 0.00 C ATOM 1874 O GLY A 130 -12.879 -0.747 -18.895 1.00 0.00 O ATOM 0 H GLY A 130 -9.094 -1.639 -17.169 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -9.971 -0.756 -19.040 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -10.854 -2.238 -19.349 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.943 -0.299 -16.905 1.00 0.00 N ATOM 1879 CA ASN A 131 -13.080 0.399 -16.332 1.00 0.00 C ATOM 1880 C ASN A 131 -12.547 1.395 -15.320 1.00 0.00 C ATOM 1881 O ASN A 131 -11.697 0.988 -14.534 1.00 0.00 O ATOM 1882 CB ASN A 131 -14.056 -0.637 -15.746 1.00 0.00 C ATOM 1883 CG ASN A 131 -14.826 -0.089 -14.556 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -16.012 0.208 -14.625 1.00 0.00 O ATOM 1885 ND2 ASN A 131 -14.106 0.086 -13.459 1.00 0.00 N ATOM 0 H ASN A 131 -11.147 -0.355 -16.270 1.00 0.00 H new ATOM 0 HA ASN A 131 -13.647 0.963 -17.073 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.758 -0.950 -16.519 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -13.502 -1.524 -15.441 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.537 0.483 -12.624 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -13.120 -0.177 -13.449 1.00 0.00 H new ATOM 1892 N GLU A 132 -13.066 2.636 -15.311 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.687 3.716 -14.403 1.00 0.00 C ATOM 1894 C GLU A 132 -12.208 3.187 -13.062 1.00 0.00 C ATOM 1895 O GLU A 132 -11.015 3.272 -12.788 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.851 4.682 -14.176 1.00 0.00 C ATOM 1897 CG GLU A 132 -14.017 5.675 -15.328 1.00 0.00 C ATOM 1898 CD GLU A 132 -15.080 6.716 -14.995 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -15.195 7.043 -13.792 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -15.750 7.162 -15.949 1.00 0.00 O ATOM 0 H GLU A 132 -13.793 2.919 -15.969 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.864 4.248 -14.881 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.773 4.114 -14.054 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.689 5.230 -13.248 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.067 6.170 -15.528 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.296 5.142 -16.237 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.136 2.624 -12.278 1.00 0.00 N ATOM 1908 CA GLN A 133 -12.886 1.957 -11.007 1.00 0.00 C ATOM 1909 C GLN A 133 -11.610 1.110 -11.116 1.00 0.00 C ATOM 1910 O GLN A 133 -10.573 1.576 -10.719 1.00 0.00 O ATOM 1911 CB GLN A 133 -14.159 1.220 -10.532 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.560 1.527 -9.083 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.631 0.979 -8.019 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.709 1.381 -6.864 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -12.723 0.096 -8.393 1.00 0.00 N ATOM 0 H GLN A 133 -14.124 2.624 -12.530 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.680 2.672 -10.210 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -14.986 1.486 -11.190 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.003 0.146 -10.634 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -14.623 2.609 -8.963 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.559 1.128 -8.909 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -12.686 -0.218 -9.363 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -12.059 -0.272 -7.712 1.00 0.00 H new ATOM 1924 N SER A 134 -11.591 -0.089 -11.673 1.00 0.00 N ATOM 1925 CA SER A 134 -10.416 -0.844 -12.092 1.00 0.00 C ATOM 1926 C SER A 134 -9.169 -0.038 -12.495 1.00 0.00 C ATOM 1927 O SER A 134 -8.069 -0.377 -12.068 1.00 0.00 O ATOM 1928 CB SER A 134 -10.862 -1.825 -13.175 1.00 0.00 C ATOM 1929 OG SER A 134 -12.229 -2.155 -12.967 1.00 0.00 O ATOM 0 H SER A 134 -12.455 -0.598 -11.858 1.00 0.00 H new ATOM 0 HA SER A 134 -10.044 -1.361 -11.207 1.00 0.00 H new ATOM 0 HB2 SER A 134 -10.728 -1.383 -14.162 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.248 -2.725 -13.143 1.00 0.00 H new ATOM 0 HG SER A 134 -12.523 -2.783 -13.659 1.00 0.00 H new ATOM 1935 N THR A 135 -9.314 1.027 -13.285 1.00 0.00 N ATOM 1936 CA THR A 135 -8.196 1.824 -13.795 1.00 0.00 C ATOM 1937 C THR A 135 -7.823 2.988 -12.857 1.00 0.00 C ATOM 1938 O THR A 135 -6.965 3.811 -13.184 1.00 0.00 O ATOM 1939 CB THR A 135 -8.514 2.294 -15.220 1.00 0.00 C ATOM 1940 OG1 THR A 135 -9.701 3.053 -15.248 1.00 0.00 O ATOM 1941 CG2 THR A 135 -8.689 1.110 -16.179 1.00 0.00 C ATOM 0 H THR A 135 -10.225 1.366 -13.594 1.00 0.00 H new ATOM 0 HA THR A 135 -7.308 1.193 -13.829 1.00 0.00 H new ATOM 0 HB THR A 135 -7.669 2.903 -15.540 1.00 0.00 H new ATOM 0 HG1 THR A 135 -10.009 3.212 -14.331 1.00 0.00 H new ATOM 0 HG21 THR A 135 -8.913 1.482 -17.179 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.769 0.525 -16.207 1.00 0.00 H new ATOM 0 HG23 THR A 135 -9.509 0.480 -15.834 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.453 3.036 -11.681 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.319 4.022 -10.629 1.00 0.00 C ATOM 1951 C LYS A 136 -7.996 3.307 -9.307 1.00 0.00 C ATOM 1952 O LYS A 136 -7.044 3.696 -8.641 1.00 0.00 O ATOM 1953 CB LYS A 136 -9.639 4.793 -10.536 1.00 0.00 C ATOM 1954 CG LYS A 136 -9.591 5.914 -9.495 1.00 0.00 C ATOM 1955 CD LYS A 136 -10.930 6.662 -9.443 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.025 5.867 -8.705 1.00 0.00 C ATOM 1957 NZ LYS A 136 -13.336 6.545 -8.789 1.00 0.00 N ATOM 0 H LYS A 136 -9.129 2.316 -11.427 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.510 4.721 -10.840 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -9.878 5.217 -11.511 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.443 4.102 -10.284 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -9.363 5.497 -8.514 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -8.789 6.610 -9.739 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -10.787 7.622 -8.947 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.263 6.875 -10.459 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.103 4.868 -9.134 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -11.744 5.744 -7.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.050 5.984 -8.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.267 7.489 -8.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -13.614 6.640 -9.787 1.00 0.00 H new ATOM 1971 N THR A 137 -8.772 2.297 -8.887 1.00 0.00 N ATOM 1972 CA THR A 137 -8.552 1.665 -7.583 1.00 0.00 C ATOM 1973 C THR A 137 -7.826 0.330 -7.693 1.00 0.00 C ATOM 1974 O THR A 137 -7.353 -0.203 -6.689 1.00 0.00 O ATOM 1975 CB THR A 137 -9.839 1.494 -6.772 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.431 0.231 -6.992 1.00 0.00 O ATOM 1977 CG2 THR A 137 -10.830 2.639 -6.996 1.00 0.00 C ATOM 0 H THR A 137 -9.546 1.906 -9.424 1.00 0.00 H new ATOM 0 HA THR A 137 -7.909 2.361 -7.043 1.00 0.00 H new ATOM 0 HB THR A 137 -9.554 1.538 -5.721 1.00 0.00 H new ATOM 0 HG1 THR A 137 -11.004 0.001 -6.231 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.725 2.468 -6.398 1.00 0.00 H new ATOM 0 HG22 THR A 137 -10.370 3.582 -6.700 1.00 0.00 H new ATOM 0 HG23 THR A 137 -11.102 2.684 -8.051 1.00 0.00 H new ATOM 1985 N GLY A 138 -7.859 -0.257 -8.887 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.419 -1.608 -9.138 1.00 0.00 C ATOM 1987 C GLY A 138 -8.561 -2.579 -8.885 1.00 0.00 C ATOM 1988 O GLY A 138 -8.293 -3.736 -8.593 1.00 0.00 O ATOM 0 H GLY A 138 -8.204 0.215 -9.723 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.072 -1.701 -10.167 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.574 -1.850 -8.493 1.00 0.00 H new ATOM 1992 N ASN A 139 -9.825 -2.134 -8.954 1.00 0.00 N ATOM 1993 CA ASN A 139 -10.993 -3.000 -8.802 1.00 0.00 C ATOM 1994 C ASN A 139 -10.950 -3.780 -7.491 1.00 0.00 C ATOM 1995 O ASN A 139 -11.615 -4.801 -7.333 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.149 -3.964 -9.989 1.00 0.00 C ATOM 1997 CG ASN A 139 -12.550 -4.568 -10.037 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -13.534 -3.884 -9.775 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -12.663 -5.846 -10.390 1.00 0.00 N ATOM 0 H ASN A 139 -10.062 -1.156 -9.118 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.864 -2.345 -8.781 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -10.948 -3.433 -10.919 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -10.410 -4.761 -9.911 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -13.584 -6.280 -10.448 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -11.828 -6.392 -10.603 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.160 -3.294 -6.534 1.00 0.00 N ATOM 2007 CA ALA A 140 -9.760 -4.100 -5.406 1.00 0.00 C ATOM 2008 C ALA A 140 -10.880 -4.163 -4.359 1.00 0.00 C ATOM 2009 O ALA A 140 -10.698 -4.711 -3.276 1.00 0.00 O ATOM 2010 CB ALA A 140 -8.422 -3.579 -4.885 1.00 0.00 C ATOM 0 H ALA A 140 -9.790 -2.344 -6.527 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.601 -5.138 -5.698 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -8.106 -4.178 -4.031 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -7.673 -3.647 -5.674 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.531 -2.539 -4.578 1.00 0.00 H new ATOM 2016 N GLY A 141 -12.057 -3.612 -4.661 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.160 -3.574 -3.728 1.00 0.00 C ATOM 2018 C GLY A 141 -12.839 -2.595 -2.607 1.00 0.00 C ATOM 2019 O GLY A 141 -11.925 -1.769 -2.725 1.00 0.00 O ATOM 0 H GLY A 141 -12.262 -3.182 -5.563 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.074 -3.271 -4.240 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.339 -4.568 -3.318 1.00 0.00 H new ATOM 2023 N SER A 142 -13.603 -2.673 -1.519 1.00 0.00 N ATOM 2024 CA SER A 142 -13.415 -1.752 -0.417 1.00 0.00 C ATOM 2025 C SER A 142 -12.078 -2.002 0.280 1.00 0.00 C ATOM 2026 O SER A 142 -11.350 -2.953 -0.020 1.00 0.00 O ATOM 2027 CB SER A 142 -14.581 -1.817 0.574 1.00 0.00 C ATOM 2028 OG SER A 142 -14.549 -0.658 1.393 1.00 0.00 O ATOM 0 H SER A 142 -14.347 -3.358 -1.384 1.00 0.00 H new ATOM 0 HA SER A 142 -13.395 -0.742 -0.827 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.529 -1.875 0.039 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.506 -2.715 1.187 1.00 0.00 H new ATOM 0 HG SER A 142 -15.292 -0.688 2.031 1.00 0.00 H new ATOM 2034 N ARG A 143 -11.783 -1.104 1.217 1.00 0.00 N ATOM 2035 CA ARG A 143 -10.560 -1.086 1.992 1.00 0.00 C ATOM 2036 C ARG A 143 -10.773 -1.720 3.363 1.00 0.00 C ATOM 2037 O ARG A 143 -11.314 -1.078 4.264 1.00 0.00 O ATOM 2038 CB ARG A 143 -9.913 0.312 2.015 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.844 1.466 2.406 1.00 0.00 C ATOM 2040 CD ARG A 143 -10.525 2.015 3.801 1.00 0.00 C ATOM 2041 NE ARG A 143 -11.651 2.802 4.331 1.00 0.00 N ATOM 2042 CZ ARG A 143 -12.723 2.293 4.964 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -12.856 0.971 5.123 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -13.662 3.117 5.447 1.00 0.00 N ATOM 0 H ARG A 143 -12.418 -0.344 1.461 1.00 0.00 H new ATOM 0 HA ARG A 143 -9.820 -1.714 1.496 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -9.075 0.293 2.711 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -9.502 0.519 1.027 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -10.756 2.267 1.672 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -11.878 1.122 2.380 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -10.303 1.190 4.478 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -9.632 2.638 3.755 1.00 0.00 H new ATOM 0 HE ARG A 143 -11.615 3.814 4.208 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -12.141 0.339 4.763 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -13.673 0.595 5.605 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -13.562 4.126 5.334 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -14.477 2.736 5.928 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.342 -2.982 3.499 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.422 -3.779 4.723 1.00 0.00 C ATOM 2060 C LEU A 144 -9.853 -3.001 5.916 1.00 0.00 C ATOM 2061 O LEU A 144 -10.404 -3.094 7.010 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.685 -5.130 4.549 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.449 -6.291 3.868 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -11.300 -7.052 4.890 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.389 -5.790 2.774 1.00 0.00 C ATOM 0 H LEU A 144 -9.912 -3.492 2.727 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.473 -3.989 4.923 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.778 -4.944 3.974 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.372 -5.470 5.536 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.691 -6.942 3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.829 -7.864 4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.655 -7.463 5.667 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -12.022 -6.372 5.341 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.905 -6.637 2.322 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.121 -5.108 3.207 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.813 -5.267 2.011 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.767 -2.242 5.721 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.147 -1.441 6.769 1.00 0.00 C ATOM 2079 C ALA A 145 -7.474 -0.204 6.182 1.00 0.00 C ATOM 2080 O ALA A 145 -7.140 -0.184 4.993 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.136 -2.281 7.554 1.00 0.00 C ATOM 0 H ALA A 145 -8.294 -2.170 4.820 1.00 0.00 H new ATOM 0 HA ALA A 145 -8.929 -1.109 7.452 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.681 -1.669 8.333 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.645 -3.130 8.010 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.361 -2.643 6.878 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.294 0.808 7.037 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.713 2.109 6.753 1.00 0.00 C ATOM 2089 C CYS A 146 -5.827 2.497 7.934 1.00 0.00 C ATOM 2090 O CYS A 146 -5.992 1.975 9.034 1.00 0.00 O ATOM 2091 CB CYS A 146 -7.827 3.143 6.541 1.00 0.00 C ATOM 2092 SG CYS A 146 -8.765 3.600 8.037 1.00 0.00 S ATOM 0 H CYS A 146 -7.573 0.725 8.015 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.115 2.073 5.842 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.386 4.046 6.119 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.525 2.753 5.800 1.00 0.00 H new ATOM 0 HG CYS A 146 -9.672 4.479 7.729 1.00 0.00 H new ATOM 2097 N GLY A 147 -4.858 3.381 7.723 1.00 0.00 N ATOM 2098 CA GLY A 147 -3.988 3.869 8.779 1.00 0.00 C ATOM 2099 C GLY A 147 -3.255 5.115 8.300 1.00 0.00 C ATOM 2100 O GLY A 147 -3.080 5.298 7.098 1.00 0.00 O ATOM 0 H GLY A 147 -4.655 3.780 6.806 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.573 4.098 9.670 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.271 3.098 9.059 1.00 0.00 H new ATOM 2104 N VAL A 148 -2.835 5.971 9.230 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.078 7.177 8.927 1.00 0.00 C ATOM 2106 C VAL A 148 -0.590 6.866 9.104 1.00 0.00 C ATOM 2107 O VAL A 148 -0.213 6.126 10.012 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.567 8.337 9.814 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -1.694 9.589 9.651 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -4.013 8.699 9.441 1.00 0.00 C ATOM 0 H VAL A 148 -3.015 5.842 10.226 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.232 7.496 7.896 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.506 8.003 10.850 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -2.073 10.383 10.294 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -0.667 9.355 9.931 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -1.721 9.919 8.612 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -4.356 9.520 10.070 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -4.054 9.002 8.395 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -4.656 7.832 9.593 1.00 0.00 H new ATOM 2120 N ILE A 149 0.243 7.404 8.212 1.00 0.00 N ATOM 2121 CA ILE A 149 1.686 7.225 8.205 1.00 0.00 C ATOM 2122 C ILE A 149 2.313 8.367 9.007 1.00 0.00 C ATOM 2123 O ILE A 149 2.010 9.531 8.743 1.00 0.00 O ATOM 2124 CB ILE A 149 2.177 7.252 6.748 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.562 6.134 5.885 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.708 7.140 6.689 1.00 0.00 C ATOM 2127 CD1 ILE A 149 1.469 6.563 4.422 1.00 0.00 C ATOM 0 H ILE A 149 -0.086 7.997 7.450 1.00 0.00 H new ATOM 0 HA ILE A 149 1.969 6.273 8.654 1.00 0.00 H new ATOM 0 HB ILE A 149 1.851 8.208 6.339 1.00 0.00 H new ATOM 0 HG12 ILE A 149 2.168 5.232 5.966 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.569 5.885 6.259 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.035 7.161 5.649 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.155 7.976 7.227 1.00 0.00 H new ATOM 0 HG23 ILE A 149 4.022 6.203 7.149 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.032 5.757 3.833 1.00 0.00 H new ATOM 0 HD12 ILE A 149 0.842 7.451 4.342 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.467 6.788 4.045 1.00 0.00 H new ATOM 2139 N GLY A 150 3.197 8.061 9.961 1.00 0.00 N ATOM 2140 CA GLY A 150 3.859 9.063 10.780 1.00 0.00 C ATOM 2141 C GLY A 150 5.241 8.573 11.197 1.00 0.00 C ATOM 2142 O GLY A 150 5.649 7.474 10.834 1.00 0.00 O ATOM 0 H GLY A 150 3.470 7.104 10.183 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.949 9.996 10.224 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.258 9.275 11.664 1.00 0.00 H new ATOM 2146 N ILE A 151 5.970 9.395 11.948 1.00 0.00 N ATOM 2147 CA ILE A 151 7.265 9.058 12.504 1.00 0.00 C ATOM 2148 C ILE A 151 7.067 7.968 13.558 1.00 0.00 C ATOM 2149 O ILE A 151 6.091 7.998 14.307 1.00 0.00 O ATOM 2150 CB ILE A 151 7.932 10.309 13.108 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.816 11.540 12.184 1.00 0.00 C ATOM 2152 CG2 ILE A 151 9.417 10.013 13.361 1.00 0.00 C ATOM 2153 CD1 ILE A 151 6.745 12.536 12.644 1.00 0.00 C ATOM 0 H ILE A 151 5.663 10.337 12.189 1.00 0.00 H new ATOM 0 HA ILE A 151 7.927 8.686 11.722 1.00 0.00 H new ATOM 0 HB ILE A 151 7.414 10.542 14.038 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.780 12.046 12.140 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.584 11.207 11.172 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.896 10.894 13.789 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.508 9.177 14.055 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.903 9.757 12.419 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.712 13.379 11.954 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.773 12.043 12.661 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.988 12.895 13.644 1.00 0.00 H new ATOM 2165 N ALA A 152 7.979 7.000 13.603 1.00 0.00 N ATOM 2166 CA ALA A 152 7.952 5.935 14.595 1.00 0.00 C ATOM 2167 C ALA A 152 8.608 6.372 15.897 1.00 0.00 C ATOM 2168 O ALA A 152 9.301 7.387 15.950 1.00 0.00 O ATOM 2169 CB ALA A 152 8.657 4.698 14.049 1.00 0.00 C ATOM 0 H ALA A 152 8.759 6.934 12.949 1.00 0.00 H new ATOM 0 HA ALA A 152 6.909 5.698 14.806 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.633 3.905 14.797 1.00 0.00 H new ATOM 0 HB2 ALA A 152 8.150 4.360 13.145 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.693 4.943 13.814 1.00 0.00 H new ATOM 2175 N GLN A 153 8.392 5.564 16.932 1.00 0.00 N ATOM 2176 CA GLN A 153 8.957 5.776 18.248 1.00 0.00 C ATOM 2177 C GLN A 153 10.423 5.328 18.240 1.00 0.00 C ATOM 2178 O GLN A 153 11.227 5.915 18.987 1.00 0.00 O ATOM 2179 CB GLN A 153 8.104 5.004 19.265 1.00 0.00 C ATOM 2180 CG GLN A 153 8.145 5.627 20.665 1.00 0.00 C ATOM 2181 CD GLN A 153 7.007 5.084 21.526 1.00 0.00 C ATOM 2182 OE1 GLN A 153 5.861 5.492 21.375 1.00 0.00 O ATOM 2183 NE2 GLN A 153 7.296 4.157 22.435 1.00 0.00 N ATOM 2184 OXT GLN A 153 10.740 4.409 17.449 1.00 0.00 O ATOM 0 H GLN A 153 7.808 4.730 16.871 1.00 0.00 H new ATOM 0 HA GLN A 153 8.945 6.829 18.530 1.00 0.00 H new ATOM 0 HB2 GLN A 153 7.072 4.971 18.917 1.00 0.00 H new ATOM 0 HB3 GLN A 153 8.455 3.974 19.320 1.00 0.00 H new ATOM 0 HG2 GLN A 153 9.103 5.409 21.138 1.00 0.00 H new ATOM 0 HG3 GLN A 153 8.066 6.711 20.589 1.00 0.00 H new ATOM 0 HE21 GLN A 153 8.257 3.832 22.544 1.00 0.00 H new ATOM 0 HE22 GLN A 153 6.557 3.771 23.023 1.00 0.00 H new