USER MOD reduce.3.24.130724 H: found=0, std=0, add=1403, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1403 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: B 61 LYS NZ :NH3+ 143:sc= 1.23 (180deg=0) USER MOD Set 1.2: B 67 GLN : amide:sc= 1.31 K(o=2.5,f=-9!) USER MOD Set 2.1: A 85 LYS NZ :NH3+ -162:sc= 1.71 (180deg=0.301) USER MOD Set 2.2: B 74 ASN : amide:sc= -1.02 K(o=0.69,f=-11!) USER MOD Set 3.1: A 74 ASN : amide:sc=-0.000891 X(o=0.96,f=0.95) USER MOD Set 3.2: B 85 LYS NZ :NH3+ -138:sc= 0.958 (180deg=0.876) USER MOD Set 4.1: A 61 LYS NZ :NH3+ -165:sc= 1.23 (180deg=0) USER MOD Set 4.2: A 67 GLN : amide:sc= 0.707 K(o=1.9,f=-5) USER MOD Set 5.1: A 39 LYS NZ :NH3+ 162:sc= 2.23 (180deg=0.589) USER MOD Set 5.2: A 43 THR OG1 : rot 80:sc= 1.77 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.00172 USER MOD Single : A 12 SER OG : rot 70:sc= 1.25 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 84:sc= 1.24 USER MOD Single : A 22 THR OG1 : rot 35:sc= 1.04 USER MOD Single : A 26 GLN : amide:sc= 1.12 K(o=1.1,f=-2.5!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -150:sc= 1.07 USER MOD Single : A 36 ASN : amide:sc= 2.29 K(o=2.3,f=-0.26) USER MOD Single : A 44 GLN : amide:sc= -0.268 X(o=-0.27,f=0.012) USER MOD Single : A 45 GLN : amide:sc= -0.26 K(o=-0.26,f=-1.6) USER MOD Single : A 48 HIS : no HD1:sc= -0.0216 X(o=-0.022,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -28:sc= 1.22 USER MOD Single : A 59 LYS NZ :NH3+ 174:sc= -0.273! (180deg=-0.787!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.135 K(o=-0.13,f=-1) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot -130:sc= -0.201 USER MOD Single : A 89 LYS NZ :NH3+ -160:sc= 1.17 (180deg=0.652) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0.318 USER MOD Single : B 12 SER OG : rot -29:sc= 1.25 USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 83:sc= 1.19 USER MOD Single : B 22 THR OG1 : rot -3:sc= 0.254 USER MOD Single : B 26 GLN : amide:sc= 1.16 K(o=1.2,f=-0.1) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 47:sc= 0.137 USER MOD Single : B 34 SER OG : rot 145:sc= 1.3 USER MOD Single : B 36 ASN : amide:sc= 1.08 K(o=1.1,f=-0.12) USER MOD Single : B 39 LYS NZ :NH3+ 178:sc= 1.2 (180deg=1.05) USER MOD Single : B 43 THR OG1 : rot 88:sc= 0.326 USER MOD Single : B 44 GLN : amide:sc= -0.312 X(o=-0.31,f=-0.0012) USER MOD Single : B 45 GLN : amide:sc= 0.588 K(o=0.59,f=-2.4!) USER MOD Single : B 48 HIS : no HD1:sc= -0.0211 X(o=-0.021,f=0) USER MOD Single : B 51 LYS NZ :NH3+ -170:sc= 1.16 (180deg=0.568) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ -157:sc= 2.35 (180deg=2.3) USER MOD Single : B 60 MET CE :methyl -174:sc= -0.476 (180deg=-0.578) USER MOD Single : B 62 SER OG : rot 74:sc= 0.952 USER MOD Single : B 66 ASN : amide:sc= 0.53 K(o=0.53,f=-2.2) USER MOD Single : B 69 SER OG : rot 79:sc= 0.743 USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 89 LYS NZ :NH3+ 166:sc= -0.0122 (180deg=-0.185) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 4 7.880 -14.915 -17.048 1.00 2.23 N ATOM 41 CA GLU A 4 8.489 -15.410 -15.826 1.00 2.01 C ATOM 42 C GLU A 4 7.454 -15.436 -14.690 1.00 1.56 C ATOM 43 O GLU A 4 6.780 -14.430 -14.469 1.00 1.45 O ATOM 44 CB GLU A 4 9.695 -14.524 -15.489 1.00 2.65 C ATOM 45 CG GLU A 4 10.714 -14.530 -16.641 1.00 3.22 C ATOM 46 CD GLU A 4 11.929 -13.675 -16.314 1.00 4.38 C ATOM 47 OE1 GLU A 4 12.656 -14.064 -15.375 1.00 5.00 O ATOM 48 OE2 GLU A 4 12.103 -12.653 -17.011 1.00 5.51 O ATOM 0 HA GLU A 4 8.837 -16.434 -15.959 1.00 2.01 H new ATOM 0 HB2 GLU A 4 9.361 -13.504 -15.298 1.00 2.65 H new ATOM 0 HB3 GLU A 4 10.170 -14.880 -14.575 1.00 2.65 H new ATOM 0 HG2 GLU A 4 11.031 -15.553 -16.842 1.00 3.22 H new ATOM 0 HG3 GLU A 4 10.240 -14.159 -17.550 1.00 3.22 H new ATOM 55 N PRO A 5 7.292 -16.562 -13.976 1.00 1.71 N ATOM 56 CA PRO A 5 6.298 -16.694 -12.925 1.00 1.67 C ATOM 57 C PRO A 5 6.739 -15.930 -11.671 1.00 1.33 C ATOM 58 O PRO A 5 7.593 -16.398 -10.921 1.00 1.53 O ATOM 59 CB PRO A 5 6.174 -18.201 -12.674 1.00 2.36 C ATOM 60 CG PRO A 5 7.560 -18.735 -13.034 1.00 2.63 C ATOM 61 CD PRO A 5 7.999 -17.819 -14.176 1.00 2.33 C ATOM 0 HA PRO A 5 5.334 -16.268 -13.204 1.00 1.67 H new ATOM 0 HB2 PRO A 5 5.918 -18.416 -11.637 1.00 2.36 H new ATOM 0 HB3 PRO A 5 5.397 -18.649 -13.294 1.00 2.36 H new ATOM 0 HG2 PRO A 5 8.245 -18.681 -12.188 1.00 2.63 H new ATOM 0 HG3 PRO A 5 7.521 -19.779 -13.347 1.00 2.63 H new ATOM 0 HD2 PRO A 5 9.078 -17.666 -14.161 1.00 2.33 H new ATOM 0 HD3 PRO A 5 7.752 -18.256 -15.144 1.00 2.33 H new ATOM 69 N LEU A 6 6.145 -14.759 -11.437 1.00 1.05 N ATOM 70 CA LEU A 6 6.361 -13.988 -10.219 1.00 0.96 C ATOM 71 C LEU A 6 5.770 -14.713 -9.002 1.00 1.10 C ATOM 72 O LEU A 6 4.963 -15.634 -9.137 1.00 1.27 O ATOM 73 CB LEU A 6 5.739 -12.593 -10.376 1.00 1.09 C ATOM 74 CG LEU A 6 6.332 -11.770 -11.534 1.00 0.97 C ATOM 75 CD1 LEU A 6 5.542 -10.462 -11.661 1.00 1.29 C ATOM 76 CD2 LEU A 6 7.813 -11.442 -11.302 1.00 1.23 C ATOM 0 H LEU A 6 5.498 -14.320 -12.092 1.00 1.05 H new ATOM 0 HA LEU A 6 7.433 -13.882 -10.053 1.00 0.96 H new ATOM 0 HB2 LEU A 6 4.666 -12.701 -10.533 1.00 1.09 H new ATOM 0 HB3 LEU A 6 5.872 -12.040 -9.446 1.00 1.09 H new ATOM 0 HG LEU A 6 6.260 -12.362 -12.447 1.00 0.97 H new ATOM 0 HD11 LEU A 6 5.951 -9.868 -12.478 1.00 1.29 H new ATOM 0 HD12 LEU A 6 4.495 -10.687 -11.865 1.00 1.29 H new ATOM 0 HD13 LEU A 6 5.617 -9.900 -10.730 1.00 1.29 H new ATOM 0 HD21 LEU A 6 8.193 -10.861 -12.142 1.00 1.23 H new ATOM 0 HD22 LEU A 6 7.918 -10.864 -10.384 1.00 1.23 H new ATOM 0 HD23 LEU A 6 8.381 -12.368 -11.215 1.00 1.23 H new ATOM 88 N THR A 7 6.168 -14.278 -7.805 1.00 1.14 N ATOM 89 CA THR A 7 5.586 -14.728 -6.543 1.00 1.29 C ATOM 90 C THR A 7 4.316 -13.916 -6.272 1.00 1.13 C ATOM 91 O THR A 7 4.004 -12.985 -7.010 1.00 1.25 O ATOM 92 CB THR A 7 6.613 -14.611 -5.406 1.00 1.46 C ATOM 93 OG1 THR A 7 6.024 -14.944 -4.160 1.00 2.03 O ATOM 94 CG2 THR A 7 7.176 -13.195 -5.332 1.00 1.22 C ATOM 0 H THR A 7 6.915 -13.593 -7.685 1.00 1.14 H new ATOM 0 HA THR A 7 5.312 -15.781 -6.604 1.00 1.29 H new ATOM 0 HB THR A 7 7.422 -15.310 -5.618 1.00 1.46 H new ATOM 0 HG1 THR A 7 6.695 -14.865 -3.450 1.00 2.03 H new ATOM 0 HG21 THR A 7 7.901 -13.134 -4.520 1.00 1.22 H new ATOM 0 HG22 THR A 7 7.664 -12.948 -6.275 1.00 1.22 H new ATOM 0 HG23 THR A 7 6.365 -12.490 -5.148 1.00 1.22 H new ATOM 102 N GLU A 8 3.593 -14.247 -5.201 1.00 1.09 N ATOM 103 CA GLU A 8 2.248 -13.756 -4.957 1.00 1.10 C ATOM 104 C GLU A 8 2.309 -12.266 -4.637 1.00 0.95 C ATOM 105 O GLU A 8 1.587 -11.462 -5.221 1.00 0.91 O ATOM 106 CB GLU A 8 1.618 -14.599 -3.842 1.00 1.38 C ATOM 107 CG GLU A 8 0.128 -14.300 -3.638 1.00 1.43 C ATOM 108 CD GLU A 8 -0.495 -15.290 -2.657 1.00 1.83 C ATOM 109 OE1 GLU A 8 0.200 -15.621 -1.672 1.00 2.01 O ATOM 110 OE2 GLU A 8 -1.638 -15.718 -2.923 1.00 2.58 O ATOM 0 H GLU A 8 3.936 -14.873 -4.472 1.00 1.09 H new ATOM 0 HA GLU A 8 1.613 -13.858 -5.837 1.00 1.10 H new ATOM 0 HB2 GLU A 8 1.742 -15.656 -4.078 1.00 1.38 H new ATOM 0 HB3 GLU A 8 2.151 -14.416 -2.909 1.00 1.38 H new ATOM 0 HG2 GLU A 8 0.004 -13.284 -3.264 1.00 1.43 H new ATOM 0 HG3 GLU A 8 -0.392 -14.353 -4.594 1.00 1.43 H new ATOM 117 N LEU A 9 3.205 -11.884 -3.727 1.00 0.91 N ATOM 118 CA LEU A 9 3.388 -10.493 -3.360 1.00 0.85 C ATOM 119 C LEU A 9 3.855 -9.658 -4.561 1.00 0.77 C ATOM 120 O LEU A 9 3.233 -8.644 -4.868 1.00 0.74 O ATOM 121 CB LEU A 9 4.331 -10.386 -2.155 1.00 0.95 C ATOM 122 CG LEU A 9 3.660 -10.881 -0.858 1.00 1.20 C ATOM 123 CD1 LEU A 9 3.671 -12.400 -0.659 1.00 2.33 C ATOM 124 CD2 LEU A 9 4.331 -10.209 0.347 1.00 2.31 C ATOM 0 H LEU A 9 3.818 -12.531 -3.230 1.00 0.91 H new ATOM 0 HA LEU A 9 2.428 -10.074 -3.058 1.00 0.85 H new ATOM 0 HB2 LEU A 9 5.231 -10.971 -2.345 1.00 0.95 H new ATOM 0 HB3 LEU A 9 4.645 -9.350 -2.030 1.00 0.95 H new ATOM 0 HG LEU A 9 2.610 -10.603 -0.947 1.00 1.20 H new ATOM 0 HD11 LEU A 9 3.176 -12.647 0.280 1.00 2.33 H new ATOM 0 HD12 LEU A 9 3.144 -12.879 -1.484 1.00 2.33 H new ATOM 0 HD13 LEU A 9 4.701 -12.756 -0.631 1.00 2.33 H new ATOM 0 HD21 LEU A 9 3.860 -10.556 1.266 1.00 2.31 H new ATOM 0 HD22 LEU A 9 5.390 -10.465 0.363 1.00 2.31 H new ATOM 0 HD23 LEU A 9 4.220 -9.127 0.269 1.00 2.31 H new ATOM 136 N GLU A 10 4.927 -10.083 -5.242 1.00 0.75 N ATOM 137 CA GLU A 10 5.474 -9.409 -6.421 1.00 0.70 C ATOM 138 C GLU A 10 4.378 -9.224 -7.485 1.00 0.63 C ATOM 139 O GLU A 10 4.143 -8.115 -7.962 1.00 0.66 O ATOM 140 CB GLU A 10 6.718 -10.151 -6.955 1.00 0.74 C ATOM 141 CG GLU A 10 7.876 -10.112 -5.934 1.00 1.58 C ATOM 142 CD GLU A 10 9.183 -10.777 -6.391 1.00 1.63 C ATOM 143 OE1 GLU A 10 9.161 -11.343 -7.505 1.00 1.76 O ATOM 144 OE2 GLU A 10 10.177 -10.731 -5.621 1.00 2.89 O ATOM 0 H GLU A 10 5.447 -10.921 -4.982 1.00 0.75 H new ATOM 0 HA GLU A 10 5.814 -8.412 -6.139 1.00 0.70 H new ATOM 0 HB2 GLU A 10 6.459 -11.187 -7.175 1.00 0.74 H new ATOM 0 HB3 GLU A 10 7.041 -9.697 -7.892 1.00 0.74 H new ATOM 0 HG2 GLU A 10 8.085 -9.071 -5.688 1.00 1.58 H new ATOM 0 HG3 GLU A 10 7.544 -10.596 -5.016 1.00 1.58 H new ATOM 151 N GLU A 11 3.668 -10.307 -7.808 1.00 0.61 N ATOM 152 CA GLU A 11 2.495 -10.292 -8.671 1.00 0.59 C ATOM 153 C GLU A 11 1.492 -9.229 -8.201 1.00 0.59 C ATOM 154 O GLU A 11 1.118 -8.339 -8.962 1.00 0.61 O ATOM 155 CB GLU A 11 1.908 -11.712 -8.675 1.00 0.66 C ATOM 156 CG GLU A 11 0.557 -11.867 -9.374 1.00 1.77 C ATOM 157 CD GLU A 11 0.582 -11.393 -10.820 1.00 2.24 C ATOM 158 OE1 GLU A 11 1.515 -11.815 -11.536 1.00 2.12 O ATOM 159 OE2 GLU A 11 -0.335 -10.623 -11.178 1.00 3.58 O ATOM 0 H GLU A 11 3.902 -11.239 -7.466 1.00 0.61 H new ATOM 0 HA GLU A 11 2.757 -10.016 -9.692 1.00 0.59 H new ATOM 0 HB2 GLU A 11 2.624 -12.380 -9.154 1.00 0.66 H new ATOM 0 HB3 GLU A 11 1.803 -12.045 -7.643 1.00 0.66 H new ATOM 0 HG2 GLU A 11 0.256 -12.914 -9.345 1.00 1.77 H new ATOM 0 HG3 GLU A 11 -0.198 -11.304 -8.825 1.00 1.77 H new ATOM 166 N SER A 12 1.076 -9.294 -6.932 1.00 0.63 N ATOM 167 CA SER A 12 0.102 -8.368 -6.370 1.00 0.67 C ATOM 168 C SER A 12 0.540 -6.912 -6.546 1.00 0.64 C ATOM 169 O SER A 12 -0.246 -6.085 -7.007 1.00 0.68 O ATOM 170 CB SER A 12 -0.167 -8.678 -4.894 1.00 0.74 C ATOM 171 OG SER A 12 -0.676 -9.987 -4.742 1.00 2.23 O ATOM 0 H SER A 12 1.409 -9.994 -6.269 1.00 0.63 H new ATOM 0 HA SER A 12 -0.828 -8.503 -6.922 1.00 0.67 H new ATOM 0 HB2 SER A 12 0.755 -8.572 -4.322 1.00 0.74 H new ATOM 0 HB3 SER A 12 -0.878 -7.957 -4.490 1.00 0.74 H new ATOM 0 HG SER A 12 0.030 -10.637 -4.938 1.00 2.23 H new ATOM 177 N ILE A 13 1.782 -6.573 -6.178 1.00 0.61 N ATOM 178 CA ILE A 13 2.246 -5.204 -6.371 1.00 0.61 C ATOM 179 C ILE A 13 2.255 -4.851 -7.858 1.00 0.60 C ATOM 180 O ILE A 13 1.862 -3.739 -8.208 1.00 0.61 O ATOM 181 CB ILE A 13 3.520 -4.851 -5.570 1.00 0.62 C ATOM 182 CG1 ILE A 13 4.730 -5.761 -5.790 1.00 0.64 C ATOM 183 CG2 ILE A 13 3.150 -4.886 -4.078 1.00 0.67 C ATOM 184 CD1 ILE A 13 5.564 -5.387 -7.012 1.00 0.63 C ATOM 0 H ILE A 13 2.461 -7.208 -5.759 1.00 0.61 H new ATOM 0 HA ILE A 13 1.523 -4.527 -5.916 1.00 0.61 H new ATOM 0 HB ILE A 13 3.837 -3.871 -5.927 1.00 0.62 H new ATOM 0 HG12 ILE A 13 5.364 -5.728 -4.904 1.00 0.64 H new ATOM 0 HG13 ILE A 13 4.385 -6.790 -5.897 1.00 0.64 H new ATOM 0 HG21 ILE A 13 4.028 -4.641 -3.480 1.00 0.67 H new ATOM 0 HG22 ILE A 13 2.362 -4.159 -3.881 1.00 0.67 H new ATOM 0 HG23 ILE A 13 2.798 -5.883 -3.814 1.00 0.67 H new ATOM 0 HD11 ILE A 13 6.404 -6.076 -7.104 1.00 0.63 H new ATOM 0 HD12 ILE A 13 4.945 -5.448 -7.907 1.00 0.63 H new ATOM 0 HD13 ILE A 13 5.939 -4.370 -6.899 1.00 0.63 H new ATOM 196 N GLU A 14 2.609 -5.787 -8.747 1.00 0.60 N ATOM 197 CA GLU A 14 2.533 -5.510 -10.173 1.00 0.61 C ATOM 198 C GLU A 14 1.091 -5.186 -10.579 1.00 0.61 C ATOM 199 O GLU A 14 0.846 -4.090 -11.071 1.00 0.63 O ATOM 200 CB GLU A 14 3.157 -6.623 -11.028 1.00 0.64 C ATOM 201 CG GLU A 14 3.835 -6.021 -12.273 1.00 0.69 C ATOM 202 CD GLU A 14 2.901 -5.164 -13.126 1.00 1.55 C ATOM 203 OE1 GLU A 14 1.902 -5.726 -13.624 1.00 2.24 O ATOM 204 OE2 GLU A 14 3.192 -3.954 -13.250 1.00 2.63 O ATOM 0 H GLU A 14 2.943 -6.720 -8.505 1.00 0.60 H new ATOM 0 HA GLU A 14 3.139 -4.626 -10.372 1.00 0.61 H new ATOM 0 HB2 GLU A 14 3.888 -7.177 -10.439 1.00 0.64 H new ATOM 0 HB3 GLU A 14 2.388 -7.333 -11.331 1.00 0.64 H new ATOM 0 HG2 GLU A 14 4.683 -5.414 -11.956 1.00 0.69 H new ATOM 0 HG3 GLU A 14 4.233 -6.830 -12.886 1.00 0.69 H new ATOM 211 N THR A 15 0.124 -6.085 -10.346 1.00 0.61 N ATOM 212 CA THR A 15 -1.236 -5.907 -10.864 1.00 0.62 C ATOM 213 C THR A 15 -1.810 -4.526 -10.488 1.00 0.63 C ATOM 214 O THR A 15 -2.430 -3.840 -11.307 1.00 0.67 O ATOM 215 CB THR A 15 -2.157 -7.099 -10.524 1.00 0.74 C ATOM 216 OG1 THR A 15 -3.223 -7.135 -11.451 1.00 1.18 O ATOM 217 CG2 THR A 15 -2.778 -7.065 -9.125 1.00 0.79 C ATOM 0 H THR A 15 0.259 -6.939 -9.804 1.00 0.61 H new ATOM 0 HA THR A 15 -1.181 -5.910 -11.953 1.00 0.62 H new ATOM 0 HB THR A 15 -1.513 -7.977 -10.567 1.00 0.74 H new ATOM 0 HG1 THR A 15 -3.812 -7.890 -11.243 1.00 1.18 H new ATOM 0 HG21 THR A 15 -3.407 -7.944 -8.985 1.00 0.79 H new ATOM 0 HG22 THR A 15 -1.987 -7.061 -8.376 1.00 0.79 H new ATOM 0 HG23 THR A 15 -3.384 -6.165 -9.017 1.00 0.79 H new ATOM 225 N VAL A 16 -1.546 -4.066 -9.261 1.00 0.63 N ATOM 226 CA VAL A 16 -1.967 -2.733 -8.845 1.00 0.65 C ATOM 227 C VAL A 16 -1.106 -1.646 -9.504 1.00 0.63 C ATOM 228 O VAL A 16 -1.659 -0.643 -9.953 1.00 0.66 O ATOM 229 CB VAL A 16 -2.097 -2.589 -7.318 1.00 0.70 C ATOM 230 CG1 VAL A 16 -3.003 -3.689 -6.747 1.00 0.75 C ATOM 231 CG2 VAL A 16 -0.757 -2.599 -6.581 1.00 0.70 C ATOM 0 H VAL A 16 -1.046 -4.595 -8.546 1.00 0.63 H new ATOM 0 HA VAL A 16 -2.982 -2.584 -9.213 1.00 0.65 H new ATOM 0 HB VAL A 16 -2.542 -1.608 -7.152 1.00 0.70 H new ATOM 0 HG11 VAL A 16 -3.083 -3.570 -5.666 1.00 0.75 H new ATOM 0 HG12 VAL A 16 -3.994 -3.613 -7.194 1.00 0.75 H new ATOM 0 HG13 VAL A 16 -2.577 -4.666 -6.974 1.00 0.75 H new ATOM 0 HG21 VAL A 16 -0.930 -2.493 -5.510 1.00 0.70 H new ATOM 0 HG22 VAL A 16 -0.242 -3.540 -6.774 1.00 0.70 H new ATOM 0 HG23 VAL A 16 -0.142 -1.771 -6.933 1.00 0.70 H new ATOM 241 N VAL A 17 0.220 -1.822 -9.594 1.00 0.60 N ATOM 242 CA VAL A 17 1.098 -0.884 -10.294 1.00 0.59 C ATOM 243 C VAL A 17 0.636 -0.679 -11.735 1.00 0.58 C ATOM 244 O VAL A 17 0.479 0.463 -12.158 1.00 0.61 O ATOM 245 CB VAL A 17 2.574 -1.322 -10.215 1.00 0.60 C ATOM 246 CG1 VAL A 17 3.468 -0.592 -11.230 1.00 0.62 C ATOM 247 CG2 VAL A 17 3.117 -1.008 -8.818 1.00 0.62 C ATOM 0 H VAL A 17 0.709 -2.617 -9.184 1.00 0.60 H new ATOM 0 HA VAL A 17 1.031 0.080 -9.790 1.00 0.59 H new ATOM 0 HB VAL A 17 2.597 -2.389 -10.437 1.00 0.60 H new ATOM 0 HG11 VAL A 17 4.495 -0.941 -11.127 1.00 0.62 H new ATOM 0 HG12 VAL A 17 3.114 -0.797 -12.240 1.00 0.62 H new ATOM 0 HG13 VAL A 17 3.429 0.481 -11.043 1.00 0.62 H new ATOM 0 HG21 VAL A 17 4.161 -1.316 -8.756 1.00 0.62 H new ATOM 0 HG22 VAL A 17 3.043 0.063 -8.631 1.00 0.62 H new ATOM 0 HG23 VAL A 17 2.535 -1.548 -8.071 1.00 0.62 H new ATOM 257 N THR A 18 0.414 -1.744 -12.503 1.00 0.59 N ATOM 258 CA THR A 18 -0.029 -1.607 -13.884 1.00 0.64 C ATOM 259 C THR A 18 -1.377 -0.871 -13.945 1.00 0.64 C ATOM 260 O THR A 18 -1.489 0.114 -14.679 1.00 0.65 O ATOM 261 CB THR A 18 0.021 -2.958 -14.619 1.00 0.73 C ATOM 262 OG1 THR A 18 -0.284 -2.790 -15.988 1.00 0.84 O ATOM 263 CG2 THR A 18 -0.910 -4.011 -14.024 1.00 0.73 C ATOM 0 H THR A 18 0.534 -2.708 -12.191 1.00 0.59 H new ATOM 0 HA THR A 18 0.665 -0.974 -14.437 1.00 0.64 H new ATOM 0 HB THR A 18 1.041 -3.323 -14.498 1.00 0.73 H new ATOM 0 HG1 THR A 18 -0.246 -3.658 -16.441 1.00 0.84 H new ATOM 0 HG21 THR A 18 -0.822 -4.937 -14.592 1.00 0.73 H new ATOM 0 HG22 THR A 18 -0.635 -4.195 -12.986 1.00 0.73 H new ATOM 0 HG23 THR A 18 -1.939 -3.654 -14.069 1.00 0.73 H new ATOM 271 N THR A 19 -2.368 -1.271 -13.130 1.00 0.70 N ATOM 272 CA THR A 19 -3.670 -0.612 -13.088 1.00 0.81 C ATOM 273 C THR A 19 -3.498 0.886 -12.807 1.00 0.79 C ATOM 274 O THR A 19 -4.007 1.727 -13.551 1.00 0.83 O ATOM 275 CB THR A 19 -4.562 -1.310 -12.048 1.00 0.91 C ATOM 276 OG1 THR A 19 -4.682 -2.676 -12.384 1.00 0.95 O ATOM 277 CG2 THR A 19 -5.980 -0.733 -12.011 1.00 0.98 C ATOM 0 H THR A 19 -2.282 -2.058 -12.487 1.00 0.70 H new ATOM 0 HA THR A 19 -4.164 -0.695 -14.056 1.00 0.81 H new ATOM 0 HB THR A 19 -4.092 -1.161 -11.076 1.00 0.91 H new ATOM 0 HG1 THR A 19 -3.910 -3.168 -12.035 1.00 0.95 H new ATOM 0 HG21 THR A 19 -6.568 -1.261 -11.260 1.00 0.98 H new ATOM 0 HG22 THR A 19 -5.935 0.326 -11.758 1.00 0.98 H new ATOM 0 HG23 THR A 19 -6.447 -0.853 -12.988 1.00 0.98 H new ATOM 285 N PHE A 20 -2.745 1.214 -11.752 1.00 0.79 N ATOM 286 CA PHE A 20 -2.326 2.575 -11.452 1.00 0.83 C ATOM 287 C PHE A 20 -1.789 3.233 -12.721 1.00 0.76 C ATOM 288 O PHE A 20 -2.323 4.247 -13.152 1.00 0.81 O ATOM 289 CB PHE A 20 -1.290 2.578 -10.311 1.00 0.90 C ATOM 290 CG PHE A 20 -0.317 3.746 -10.311 1.00 1.11 C ATOM 291 CD1 PHE A 20 -0.715 5.002 -9.823 1.00 2.23 C ATOM 292 CD2 PHE A 20 0.970 3.592 -10.864 1.00 2.28 C ATOM 293 CE1 PHE A 20 0.194 6.076 -9.824 1.00 2.84 C ATOM 294 CE2 PHE A 20 1.827 4.698 -10.977 1.00 2.96 C ATOM 295 CZ PHE A 20 1.451 5.936 -10.432 1.00 2.81 C ATOM 0 H PHE A 20 -2.408 0.528 -11.077 1.00 0.79 H new ATOM 0 HA PHE A 20 -3.180 3.158 -11.108 1.00 0.83 H new ATOM 0 HB2 PHE A 20 -1.823 2.572 -9.360 1.00 0.90 H new ATOM 0 HB3 PHE A 20 -0.718 1.652 -10.361 1.00 0.90 H new ATOM 0 HD1 PHE A 20 -1.718 5.143 -9.447 1.00 2.23 H new ATOM 0 HD2 PHE A 20 1.298 2.620 -11.202 1.00 2.28 H new ATOM 0 HE1 PHE A 20 -0.076 7.011 -9.356 1.00 2.84 H new ATOM 0 HE2 PHE A 20 2.776 4.597 -11.483 1.00 2.96 H new ATOM 0 HZ PHE A 20 2.126 6.777 -10.480 1.00 2.81 H new ATOM 305 N PHE A 21 -0.754 2.653 -13.327 1.00 0.70 N ATOM 306 CA PHE A 21 0.009 3.250 -14.410 1.00 0.72 C ATOM 307 C PHE A 21 -0.889 3.614 -15.592 1.00 0.70 C ATOM 308 O PHE A 21 -0.819 4.734 -16.106 1.00 0.77 O ATOM 309 CB PHE A 21 1.147 2.303 -14.814 1.00 0.81 C ATOM 310 CG PHE A 21 2.233 2.926 -15.672 1.00 0.99 C ATOM 311 CD1 PHE A 21 3.036 3.954 -15.141 1.00 2.20 C ATOM 312 CD2 PHE A 21 2.573 2.349 -16.911 1.00 2.15 C ATOM 313 CE1 PHE A 21 4.191 4.374 -15.821 1.00 2.64 C ATOM 314 CE2 PHE A 21 3.730 2.771 -17.593 1.00 2.59 C ATOM 315 CZ PHE A 21 4.549 3.770 -17.039 1.00 2.28 C ATOM 0 H PHE A 21 -0.417 1.726 -13.066 1.00 0.70 H new ATOM 0 HA PHE A 21 0.449 4.186 -14.065 1.00 0.72 H new ATOM 0 HB2 PHE A 21 1.605 1.905 -13.909 1.00 0.81 H new ATOM 0 HB3 PHE A 21 0.720 1.458 -15.354 1.00 0.81 H new ATOM 0 HD1 PHE A 21 2.762 4.422 -14.207 1.00 2.20 H new ATOM 0 HD2 PHE A 21 1.945 1.581 -17.339 1.00 2.15 H new ATOM 0 HE1 PHE A 21 4.804 5.161 -15.408 1.00 2.64 H new ATOM 0 HE2 PHE A 21 3.989 2.327 -18.543 1.00 2.59 H new ATOM 0 HZ PHE A 21 5.452 4.073 -17.548 1.00 2.28 H new ATOM 325 N THR A 22 -1.762 2.688 -16.006 1.00 0.69 N ATOM 326 CA THR A 22 -2.694 2.936 -17.097 1.00 0.79 C ATOM 327 C THR A 22 -3.511 4.212 -16.873 1.00 0.82 C ATOM 328 O THR A 22 -3.707 4.974 -17.824 1.00 1.06 O ATOM 329 CB THR A 22 -3.593 1.710 -17.327 1.00 0.84 C ATOM 330 OG1 THR A 22 -3.847 1.003 -16.132 1.00 2.38 O ATOM 331 CG2 THR A 22 -2.901 0.729 -18.276 1.00 2.29 C ATOM 0 H THR A 22 -1.837 1.757 -15.595 1.00 0.69 H new ATOM 0 HA THR A 22 -2.112 3.100 -18.004 1.00 0.79 H new ATOM 0 HB THR A 22 -4.530 2.087 -17.738 1.00 0.84 H new ATOM 0 HG1 THR A 22 -3.917 1.635 -15.386 1.00 2.38 H new ATOM 0 HG21 THR A 22 -3.543 -0.138 -18.435 1.00 2.29 H new ATOM 0 HG22 THR A 22 -2.710 1.219 -19.231 1.00 2.29 H new ATOM 0 HG23 THR A 22 -1.956 0.405 -17.839 1.00 2.29 H new ATOM 339 N PHE A 23 -3.971 4.433 -15.637 1.00 0.71 N ATOM 340 CA PHE A 23 -4.699 5.636 -15.248 1.00 0.75 C ATOM 341 C PHE A 23 -3.750 6.803 -14.955 1.00 0.75 C ATOM 342 O PHE A 23 -4.085 7.949 -15.210 1.00 0.95 O ATOM 343 CB PHE A 23 -5.638 5.326 -14.075 1.00 0.91 C ATOM 344 CG PHE A 23 -6.651 4.228 -14.372 1.00 1.44 C ATOM 345 CD1 PHE A 23 -7.493 4.333 -15.495 1.00 2.74 C ATOM 346 CD2 PHE A 23 -6.732 3.084 -13.555 1.00 2.50 C ATOM 347 CE1 PHE A 23 -8.321 3.259 -15.866 1.00 3.54 C ATOM 348 CE2 PHE A 23 -7.613 2.040 -13.886 1.00 3.34 C ATOM 349 CZ PHE A 23 -8.370 2.104 -15.067 1.00 3.49 C ATOM 0 H PHE A 23 -3.844 3.770 -14.872 1.00 0.71 H new ATOM 0 HA PHE A 23 -5.315 5.959 -16.087 1.00 0.75 H new ATOM 0 HB2 PHE A 23 -5.041 5.033 -13.212 1.00 0.91 H new ATOM 0 HB3 PHE A 23 -6.172 6.235 -13.799 1.00 0.91 H new ATOM 0 HD1 PHE A 23 -7.503 5.244 -16.075 1.00 2.74 H new ATOM 0 HD2 PHE A 23 -6.115 3.009 -12.672 1.00 2.50 H new ATOM 0 HE1 PHE A 23 -8.918 3.322 -16.764 1.00 3.54 H new ATOM 0 HE2 PHE A 23 -7.708 1.187 -13.231 1.00 3.34 H new ATOM 0 HZ PHE A 23 -8.988 1.268 -15.360 1.00 3.49 H new ATOM 359 N ALA A 24 -2.540 6.548 -14.464 1.00 0.75 N ATOM 360 CA ALA A 24 -1.548 7.580 -14.190 1.00 0.89 C ATOM 361 C ALA A 24 -1.232 8.341 -15.467 1.00 0.94 C ATOM 362 O ALA A 24 -0.937 9.538 -15.434 1.00 0.98 O ATOM 363 CB ALA A 24 -0.275 6.969 -13.598 1.00 0.95 C ATOM 0 H ALA A 24 -2.218 5.606 -14.243 1.00 0.75 H new ATOM 0 HA ALA A 24 -1.958 8.274 -13.456 1.00 0.89 H new ATOM 0 HB1 ALA A 24 0.450 7.759 -13.402 1.00 0.95 H new ATOM 0 HB2 ALA A 24 -0.516 6.458 -12.666 1.00 0.95 H new ATOM 0 HB3 ALA A 24 0.148 6.255 -14.304 1.00 0.95 H new ATOM 369 N ARG A 25 -1.249 7.616 -16.582 1.00 0.99 N ATOM 370 CA ARG A 25 -1.019 8.109 -17.925 1.00 1.11 C ATOM 371 C ARG A 25 -2.145 9.015 -18.449 1.00 1.09 C ATOM 372 O ARG A 25 -1.847 9.815 -19.333 1.00 1.23 O ATOM 373 CB ARG A 25 -0.781 6.868 -18.799 1.00 1.27 C ATOM 374 CG ARG A 25 -0.781 7.081 -20.323 1.00 2.15 C ATOM 375 CD ARG A 25 -1.002 5.742 -21.034 1.00 2.57 C ATOM 376 NE ARG A 25 -2.336 5.206 -20.707 1.00 2.83 N ATOM 377 CZ ARG A 25 -2.896 4.108 -21.232 1.00 3.75 C ATOM 378 NH1 ARG A 25 -2.227 3.388 -22.141 1.00 4.59 N ATOM 379 NH2 ARG A 25 -4.119 3.746 -20.835 1.00 4.36 N ATOM 0 H ARG A 25 -1.435 6.613 -16.565 1.00 0.99 H new ATOM 0 HA ARG A 25 -0.151 8.768 -17.945 1.00 1.11 H new ATOM 0 HB2 ARG A 25 0.178 6.433 -18.517 1.00 1.27 H new ATOM 0 HB3 ARG A 25 -1.548 6.132 -18.559 1.00 1.27 H new ATOM 0 HG2 ARG A 25 -1.566 7.785 -20.601 1.00 2.15 H new ATOM 0 HG3 ARG A 25 0.166 7.519 -20.638 1.00 2.15 H new ATOM 0 HD2 ARG A 25 -0.910 5.875 -22.112 1.00 2.57 H new ATOM 0 HD3 ARG A 25 -0.233 5.031 -20.733 1.00 2.57 H new ATOM 0 HE ARG A 25 -2.884 5.719 -20.016 1.00 2.83 H new ATOM 0 HH11 ARG A 25 -1.293 3.676 -22.433 1.00 4.59 H new ATOM 0 HH12 ARG A 25 -2.651 2.552 -22.542 1.00 4.59 H new ATOM 0 HH21 ARG A 25 -4.615 4.303 -20.140 1.00 4.36 H new ATOM 0 HH22 ARG A 25 -4.556 2.912 -21.227 1.00 4.36 H new ATOM 393 N GLN A 26 -3.397 8.889 -17.977 1.00 0.97 N ATOM 394 CA GLN A 26 -4.571 9.522 -18.580 1.00 1.00 C ATOM 395 C GLN A 26 -4.319 10.960 -19.045 1.00 1.05 C ATOM 396 O GLN A 26 -4.452 11.286 -20.224 1.00 1.19 O ATOM 397 CB GLN A 26 -5.715 9.516 -17.552 1.00 0.90 C ATOM 398 CG GLN A 26 -7.067 9.154 -18.125 1.00 1.00 C ATOM 399 CD GLN A 26 -7.227 7.663 -18.430 1.00 1.18 C ATOM 400 OE1 GLN A 26 -6.438 7.072 -19.165 1.00 1.78 O ATOM 401 NE2 GLN A 26 -8.251 7.026 -17.877 1.00 1.64 N ATOM 0 H GLN A 26 -3.620 8.334 -17.151 1.00 0.97 H new ATOM 0 HA GLN A 26 -4.826 8.947 -19.470 1.00 1.00 H new ATOM 0 HB2 GLN A 26 -5.470 8.811 -16.758 1.00 0.90 H new ATOM 0 HB3 GLN A 26 -5.780 10.503 -17.093 1.00 0.90 H new ATOM 0 HG2 GLN A 26 -7.843 9.457 -17.422 1.00 1.00 H new ATOM 0 HG3 GLN A 26 -7.227 9.722 -19.041 1.00 1.00 H new ATOM 0 HE21 GLN A 26 -8.897 7.530 -17.269 1.00 1.64 H new ATOM 0 HE22 GLN A 26 -8.392 6.032 -18.059 1.00 1.64 H new ATOM 410 N GLU A 27 -3.964 11.804 -18.082 1.00 0.97 N ATOM 411 CA GLU A 27 -3.587 13.192 -18.236 1.00 1.11 C ATOM 412 C GLU A 27 -2.093 13.268 -17.930 1.00 1.12 C ATOM 413 O GLU A 27 -1.529 12.326 -17.359 1.00 1.65 O ATOM 414 CB GLU A 27 -4.361 14.055 -17.224 1.00 1.18 C ATOM 415 CG GLU A 27 -5.887 13.884 -17.245 1.00 1.24 C ATOM 416 CD GLU A 27 -6.497 14.562 -16.022 1.00 1.65 C ATOM 417 OE1 GLU A 27 -6.182 15.751 -15.795 1.00 2.55 O ATOM 418 OE2 GLU A 27 -7.216 13.865 -15.275 1.00 2.63 O ATOM 0 H GLU A 27 -3.932 11.508 -17.106 1.00 0.97 H new ATOM 0 HA GLU A 27 -3.810 13.555 -19.239 1.00 1.11 H new ATOM 0 HB2 GLU A 27 -4.000 13.822 -16.222 1.00 1.18 H new ATOM 0 HB3 GLU A 27 -4.127 15.103 -17.412 1.00 1.18 H new ATOM 0 HG2 GLU A 27 -6.299 14.318 -18.156 1.00 1.24 H new ATOM 0 HG3 GLU A 27 -6.144 12.825 -17.252 1.00 1.24 H new ATOM 425 N GLY A 28 -1.478 14.417 -18.223 1.00 1.18 N ATOM 426 CA GLY A 28 -0.089 14.772 -17.946 1.00 1.40 C ATOM 427 C GLY A 28 0.651 13.821 -16.998 1.00 1.23 C ATOM 428 O GLY A 28 0.218 13.607 -15.856 1.00 1.37 O ATOM 0 H GLY A 28 -1.975 15.174 -18.693 1.00 1.18 H new ATOM 0 HA2 GLY A 28 0.454 14.813 -18.890 1.00 1.40 H new ATOM 0 HA3 GLY A 28 -0.065 15.775 -17.520 1.00 1.40 H new ATOM 432 N ARG A 29 1.754 13.234 -17.482 1.00 1.21 N ATOM 433 CA ARG A 29 2.693 12.470 -16.669 1.00 1.25 C ATOM 434 C ARG A 29 2.111 11.142 -16.166 1.00 1.13 C ATOM 435 O ARG A 29 1.235 11.137 -15.294 1.00 1.01 O ATOM 436 CB ARG A 29 3.327 13.330 -15.552 1.00 1.43 C ATOM 437 CG ARG A 29 4.845 13.503 -15.709 1.00 2.26 C ATOM 438 CD ARG A 29 5.279 14.662 -16.622 1.00 2.27 C ATOM 439 NE ARG A 29 4.907 14.473 -18.036 1.00 3.26 N ATOM 440 CZ ARG A 29 5.336 15.239 -19.056 1.00 4.19 C ATOM 441 NH1 ARG A 29 6.156 16.269 -18.819 1.00 4.20 N ATOM 442 NH2 ARG A 29 4.945 14.973 -20.308 1.00 5.76 N ATOM 0 H ARG A 29 2.018 13.281 -18.466 1.00 1.21 H new ATOM 0 HA ARG A 29 3.512 12.183 -17.328 1.00 1.25 H new ATOM 0 HB2 ARG A 29 2.855 14.312 -15.546 1.00 1.43 H new ATOM 0 HB3 ARG A 29 3.118 12.870 -14.586 1.00 1.43 H new ATOM 0 HG2 ARG A 29 5.282 13.656 -14.722 1.00 2.26 H new ATOM 0 HG3 ARG A 29 5.262 12.576 -16.102 1.00 2.26 H new ATOM 0 HD2 ARG A 29 4.831 15.587 -16.258 1.00 2.27 H new ATOM 0 HD3 ARG A 29 6.360 14.782 -16.553 1.00 2.27 H new ATOM 0 HE ARG A 29 4.276 13.703 -18.258 1.00 3.26 H new ATOM 0 HH11 ARG A 29 6.456 16.473 -17.866 1.00 4.20 H new ATOM 0 HH12 ARG A 29 6.482 16.850 -19.592 1.00 4.20 H new ATOM 0 HH21 ARG A 29 4.320 14.188 -20.491 1.00 5.76 H new ATOM 0 HH22 ARG A 29 5.272 15.555 -21.079 1.00 5.76 H new ATOM 456 N LYS A 30 2.561 10.026 -16.757 1.00 1.27 N ATOM 457 CA LYS A 30 2.331 8.663 -16.272 1.00 1.36 C ATOM 458 C LYS A 30 3.077 8.393 -14.950 1.00 1.37 C ATOM 459 O LYS A 30 3.855 7.450 -14.836 1.00 1.66 O ATOM 460 CB LYS A 30 2.612 7.641 -17.394 1.00 1.61 C ATOM 461 CG LYS A 30 4.079 7.565 -17.854 1.00 1.78 C ATOM 462 CD LYS A 30 4.264 6.662 -19.085 1.00 2.11 C ATOM 463 CE LYS A 30 3.853 7.362 -20.390 1.00 2.63 C ATOM 464 NZ LYS A 30 4.180 6.552 -21.583 1.00 3.63 N ATOM 0 H LYS A 30 3.113 10.051 -17.614 1.00 1.27 H new ATOM 0 HA LYS A 30 1.278 8.544 -16.015 1.00 1.36 H new ATOM 0 HB2 LYS A 30 2.303 6.654 -17.051 1.00 1.61 H new ATOM 0 HB3 LYS A 30 1.990 7.888 -18.254 1.00 1.61 H new ATOM 0 HG2 LYS A 30 4.436 8.568 -18.086 1.00 1.78 H new ATOM 0 HG3 LYS A 30 4.694 7.189 -17.036 1.00 1.78 H new ATOM 0 HD2 LYS A 30 5.307 6.354 -19.154 1.00 2.11 H new ATOM 0 HD3 LYS A 30 3.672 5.755 -18.960 1.00 2.11 H new ATOM 0 HE2 LYS A 30 2.782 7.563 -20.371 1.00 2.63 H new ATOM 0 HE3 LYS A 30 4.357 8.326 -20.458 1.00 2.63 H new ATOM 0 HZ1 LYS A 30 3.886 7.062 -22.440 1.00 3.63 H new ATOM 0 HZ2 LYS A 30 5.205 6.381 -21.616 1.00 3.63 H new ATOM 0 HZ3 LYS A 30 3.679 5.642 -21.533 1.00 3.63 H new ATOM 478 N ASP A 31 2.822 9.241 -13.954 1.00 1.31 N ATOM 479 CA ASP A 31 3.392 9.202 -12.612 1.00 1.47 C ATOM 480 C ASP A 31 2.432 9.993 -11.731 1.00 1.33 C ATOM 481 O ASP A 31 1.775 9.444 -10.851 1.00 1.66 O ATOM 482 CB ASP A 31 4.806 9.812 -12.617 1.00 1.76 C ATOM 483 CG ASP A 31 5.440 9.866 -11.230 1.00 3.12 C ATOM 484 OD1 ASP A 31 4.759 10.305 -10.278 1.00 4.14 O ATOM 485 OD2 ASP A 31 6.625 9.484 -11.125 1.00 4.02 O ATOM 0 H ASP A 31 2.173 10.019 -14.072 1.00 1.31 H new ATOM 0 HA ASP A 31 3.503 8.184 -12.239 1.00 1.47 H new ATOM 0 HB2 ASP A 31 5.445 9.228 -13.279 1.00 1.76 H new ATOM 0 HB3 ASP A 31 4.759 10.821 -13.028 1.00 1.76 H new ATOM 490 N SER A 32 2.289 11.277 -12.064 1.00 1.11 N ATOM 491 CA SER A 32 1.466 12.209 -11.328 1.00 1.04 C ATOM 492 C SER A 32 0.015 12.062 -11.772 1.00 0.88 C ATOM 493 O SER A 32 -0.277 12.130 -12.976 1.00 0.92 O ATOM 494 CB SER A 32 1.961 13.635 -11.598 1.00 1.12 C ATOM 495 OG SER A 32 3.377 13.673 -11.591 1.00 2.30 O ATOM 0 H SER A 32 2.755 11.695 -12.869 1.00 1.11 H new ATOM 0 HA SER A 32 1.531 12.003 -10.260 1.00 1.04 H new ATOM 0 HB2 SER A 32 1.586 13.981 -12.561 1.00 1.12 H new ATOM 0 HB3 SER A 32 1.568 14.313 -10.840 1.00 1.12 H new ATOM 0 HG SER A 32 3.681 14.588 -11.766 1.00 2.30 H new ATOM 501 N LEU A 33 -0.898 11.867 -10.819 1.00 0.79 N ATOM 502 CA LEU A 33 -2.323 11.904 -11.091 1.00 0.75 C ATOM 503 C LEU A 33 -2.879 13.301 -10.841 1.00 0.78 C ATOM 504 O LEU A 33 -2.603 13.911 -9.810 1.00 0.96 O ATOM 505 CB LEU A 33 -3.103 10.795 -10.367 1.00 0.87 C ATOM 506 CG LEU A 33 -2.966 9.471 -11.140 1.00 1.05 C ATOM 507 CD1 LEU A 33 -1.682 8.735 -10.760 1.00 2.10 C ATOM 508 CD2 LEU A 33 -4.161 8.527 -10.978 1.00 2.28 C ATOM 0 H LEU A 33 -0.665 11.680 -9.844 1.00 0.79 H new ATOM 0 HA LEU A 33 -2.464 11.686 -12.150 1.00 0.75 H new ATOM 0 HB2 LEU A 33 -2.724 10.675 -9.352 1.00 0.87 H new ATOM 0 HB3 LEU A 33 -4.154 11.071 -10.285 1.00 0.87 H new ATOM 0 HG LEU A 33 -2.930 9.763 -12.190 1.00 1.05 H new ATOM 0 HD11 LEU A 33 -1.616 7.804 -11.323 1.00 2.10 H new ATOM 0 HD12 LEU A 33 -0.821 9.362 -10.992 1.00 2.10 H new ATOM 0 HD13 LEU A 33 -1.692 8.513 -9.693 1.00 2.10 H new ATOM 0 HD21 LEU A 33 -3.987 7.618 -11.553 1.00 2.28 H new ATOM 0 HD22 LEU A 33 -4.284 8.273 -9.925 1.00 2.28 H new ATOM 0 HD23 LEU A 33 -5.064 9.018 -11.340 1.00 2.28 H new ATOM 520 N SER A 34 -3.659 13.778 -11.809 1.00 0.89 N ATOM 521 CA SER A 34 -4.425 15.013 -11.739 1.00 1.05 C ATOM 522 C SER A 34 -5.724 14.735 -10.973 1.00 0.90 C ATOM 523 O SER A 34 -5.999 13.603 -10.569 1.00 0.76 O ATOM 524 CB SER A 34 -4.687 15.471 -13.182 1.00 1.35 C ATOM 525 OG SER A 34 -5.670 16.479 -13.302 1.00 2.56 O ATOM 0 H SER A 34 -3.777 13.292 -12.698 1.00 0.89 H new ATOM 0 HA SER A 34 -3.894 15.805 -11.211 1.00 1.05 H new ATOM 0 HB2 SER A 34 -3.754 15.837 -13.610 1.00 1.35 H new ATOM 0 HB3 SER A 34 -4.993 14.609 -13.775 1.00 1.35 H new ATOM 0 HG SER A 34 -6.119 16.397 -14.169 1.00 2.56 H new ATOM 531 N VAL A 35 -6.515 15.780 -10.736 1.00 1.05 N ATOM 532 CA VAL A 35 -7.728 15.694 -9.933 1.00 1.02 C ATOM 533 C VAL A 35 -8.743 14.785 -10.630 1.00 0.94 C ATOM 534 O VAL A 35 -9.297 13.880 -10.003 1.00 0.88 O ATOM 535 CB VAL A 35 -8.285 17.099 -9.645 1.00 1.17 C ATOM 536 CG1 VAL A 35 -9.542 17.019 -8.766 1.00 1.88 C ATOM 537 CG2 VAL A 35 -7.240 17.961 -8.921 1.00 1.97 C ATOM 0 H VAL A 35 -6.329 16.715 -11.099 1.00 1.05 H new ATOM 0 HA VAL A 35 -7.500 15.247 -8.965 1.00 1.02 H new ATOM 0 HB VAL A 35 -8.536 17.552 -10.604 1.00 1.17 H new ATOM 0 HG11 VAL A 35 -9.918 18.024 -8.576 1.00 1.88 H new ATOM 0 HG12 VAL A 35 -10.308 16.436 -9.278 1.00 1.88 H new ATOM 0 HG13 VAL A 35 -9.294 16.539 -7.819 1.00 1.88 H new ATOM 0 HG21 VAL A 35 -7.655 18.950 -8.727 1.00 1.97 H new ATOM 0 HG22 VAL A 35 -6.971 17.489 -7.976 1.00 1.97 H new ATOM 0 HG23 VAL A 35 -6.351 18.056 -9.545 1.00 1.97 H new ATOM 547 N ASN A 36 -8.975 15.009 -11.928 1.00 1.00 N ATOM 548 CA ASN A 36 -9.850 14.148 -12.714 1.00 1.01 C ATOM 549 C ASN A 36 -9.309 12.714 -12.696 1.00 0.91 C ATOM 550 O ASN A 36 -10.010 11.821 -12.231 1.00 0.90 O ATOM 551 CB ASN A 36 -10.064 14.704 -14.128 1.00 1.16 C ATOM 552 CG ASN A 36 -10.599 13.610 -15.049 1.00 1.43 C ATOM 553 OD1 ASN A 36 -11.803 13.384 -15.105 1.00 1.87 O ATOM 554 ND2 ASN A 36 -9.699 12.907 -15.725 1.00 2.11 N ATOM 0 H ASN A 36 -8.566 15.782 -12.453 1.00 1.00 H new ATOM 0 HA ASN A 36 -10.842 14.127 -12.262 1.00 1.01 H new ATOM 0 HB2 ASN A 36 -10.765 15.538 -14.096 1.00 1.16 H new ATOM 0 HB3 ASN A 36 -9.124 15.092 -14.520 1.00 1.16 H new ATOM 0 HD21 ASN A 36 -9.998 12.139 -16.325 1.00 2.11 H new ATOM 0 HD22 ASN A 36 -8.708 13.135 -15.644 1.00 2.11 H new ATOM 561 N GLU A 37 -8.059 12.509 -13.123 1.00 0.89 N ATOM 562 CA GLU A 37 -7.338 11.241 -13.034 1.00 0.88 C ATOM 563 C GLU A 37 -7.608 10.506 -11.721 1.00 0.80 C ATOM 564 O GLU A 37 -7.951 9.325 -11.717 1.00 0.86 O ATOM 565 CB GLU A 37 -5.832 11.525 -13.168 1.00 0.92 C ATOM 566 CG GLU A 37 -5.322 11.116 -14.545 1.00 0.74 C ATOM 567 CD GLU A 37 -3.873 11.509 -14.795 1.00 0.74 C ATOM 568 OE1 GLU A 37 -3.278 12.410 -14.163 1.00 1.62 O ATOM 569 OE2 GLU A 37 -3.205 10.907 -15.651 1.00 1.72 O ATOM 0 H GLU A 37 -7.505 13.249 -13.555 1.00 0.89 H new ATOM 0 HA GLU A 37 -7.688 10.594 -13.839 1.00 0.88 H new ATOM 0 HB2 GLU A 37 -5.642 12.586 -13.006 1.00 0.92 H new ATOM 0 HB3 GLU A 37 -5.285 10.982 -12.397 1.00 0.92 H new ATOM 0 HG2 GLU A 37 -5.422 10.036 -14.655 1.00 0.74 H new ATOM 0 HG3 GLU A 37 -5.952 11.574 -15.308 1.00 0.74 H new ATOM 576 N PHE A 38 -7.431 11.195 -10.592 1.00 0.73 N ATOM 577 CA PHE A 38 -7.746 10.621 -9.297 1.00 0.71 C ATOM 578 C PHE A 38 -9.221 10.218 -9.263 1.00 0.74 C ATOM 579 O PHE A 38 -9.530 9.045 -9.034 1.00 0.76 O ATOM 580 CB PHE A 38 -7.378 11.601 -8.173 1.00 0.73 C ATOM 581 CG PHE A 38 -7.772 11.203 -6.756 1.00 1.00 C ATOM 582 CD1 PHE A 38 -8.017 9.860 -6.398 1.00 1.92 C ATOM 583 CD2 PHE A 38 -7.925 12.211 -5.786 1.00 2.43 C ATOM 584 CE1 PHE A 38 -8.424 9.533 -5.096 1.00 2.28 C ATOM 585 CE2 PHE A 38 -8.348 11.882 -4.488 1.00 3.04 C ATOM 586 CZ PHE A 38 -8.587 10.544 -4.138 1.00 2.41 C ATOM 0 H PHE A 38 -7.072 12.149 -10.556 1.00 0.73 H new ATOM 0 HA PHE A 38 -7.153 9.721 -9.135 1.00 0.71 H new ATOM 0 HB2 PHE A 38 -6.299 11.753 -8.195 1.00 0.73 H new ATOM 0 HB3 PHE A 38 -7.840 12.563 -8.396 1.00 0.73 H new ATOM 0 HD1 PHE A 38 -7.890 9.078 -7.132 1.00 1.92 H new ATOM 0 HD2 PHE A 38 -7.717 13.240 -6.040 1.00 2.43 H new ATOM 0 HE1 PHE A 38 -8.612 8.503 -4.831 1.00 2.28 H new ATOM 0 HE2 PHE A 38 -8.490 12.663 -3.755 1.00 3.04 H new ATOM 0 HZ PHE A 38 -8.896 10.294 -3.134 1.00 2.41 H new ATOM 596 N LYS A 39 -10.124 11.179 -9.490 1.00 0.78 N ATOM 597 CA LYS A 39 -11.547 10.919 -9.376 1.00 0.84 C ATOM 598 C LYS A 39 -11.975 9.711 -10.218 1.00 0.85 C ATOM 599 O LYS A 39 -12.804 8.920 -9.759 1.00 0.85 O ATOM 600 CB LYS A 39 -12.418 12.155 -9.643 1.00 0.96 C ATOM 601 CG LYS A 39 -13.854 11.773 -9.247 1.00 1.12 C ATOM 602 CD LYS A 39 -14.824 12.943 -9.062 1.00 1.36 C ATOM 603 CE LYS A 39 -15.878 12.582 -7.999 1.00 1.85 C ATOM 604 NZ LYS A 39 -16.615 11.324 -8.271 1.00 3.55 N ATOM 0 H LYS A 39 -9.887 12.136 -9.752 1.00 0.78 H new ATOM 0 HA LYS A 39 -11.722 10.663 -8.331 1.00 0.84 H new ATOM 0 HB2 LYS A 39 -12.069 13.008 -9.061 1.00 0.96 H new ATOM 0 HB3 LYS A 39 -12.369 12.444 -10.693 1.00 0.96 H new ATOM 0 HG2 LYS A 39 -14.257 11.108 -10.010 1.00 1.12 H new ATOM 0 HG3 LYS A 39 -13.816 11.205 -8.317 1.00 1.12 H new ATOM 0 HD2 LYS A 39 -14.278 13.836 -8.758 1.00 1.36 H new ATOM 0 HD3 LYS A 39 -15.313 13.175 -10.008 1.00 1.36 H new ATOM 0 HE2 LYS A 39 -15.386 12.498 -7.030 1.00 1.85 H new ATOM 0 HE3 LYS A 39 -16.595 13.400 -7.923 1.00 1.85 H new ATOM 0 HZ1 LYS A 39 -17.069 10.992 -7.396 1.00 3.55 H new ATOM 0 HZ2 LYS A 39 -17.342 11.497 -8.995 1.00 3.55 H new ATOM 0 HZ3 LYS A 39 -15.951 10.600 -8.613 1.00 3.55 H new ATOM 618 N GLU A 40 -11.423 9.557 -11.424 1.00 0.86 N ATOM 619 CA GLU A 40 -11.707 8.418 -12.277 1.00 0.89 C ATOM 620 C GLU A 40 -11.602 7.106 -11.501 1.00 0.78 C ATOM 621 O GLU A 40 -12.513 6.291 -11.587 1.00 0.79 O ATOM 622 CB GLU A 40 -10.804 8.387 -13.519 1.00 0.97 C ATOM 623 CG GLU A 40 -11.192 9.456 -14.552 1.00 1.16 C ATOM 624 CD GLU A 40 -10.339 9.367 -15.815 1.00 2.00 C ATOM 625 OE1 GLU A 40 -9.813 8.264 -16.081 1.00 2.89 O ATOM 626 OE2 GLU A 40 -10.227 10.402 -16.506 1.00 2.34 O ATOM 0 H GLU A 40 -10.767 10.224 -11.830 1.00 0.86 H new ATOM 0 HA GLU A 40 -12.734 8.531 -12.623 1.00 0.89 H new ATOM 0 HB2 GLU A 40 -9.768 8.538 -13.216 1.00 0.97 H new ATOM 0 HB3 GLU A 40 -10.860 7.402 -13.981 1.00 0.97 H new ATOM 0 HG2 GLU A 40 -12.243 9.341 -14.816 1.00 1.16 H new ATOM 0 HG3 GLU A 40 -11.081 10.446 -14.109 1.00 1.16 H new ATOM 633 N LEU A 41 -10.541 6.879 -10.719 1.00 0.76 N ATOM 634 CA LEU A 41 -10.344 5.564 -10.119 1.00 0.77 C ATOM 635 C LEU A 41 -11.463 5.295 -9.117 1.00 0.73 C ATOM 636 O LEU A 41 -12.087 4.236 -9.115 1.00 0.75 O ATOM 637 CB LEU A 41 -8.970 5.468 -9.439 1.00 0.85 C ATOM 638 CG LEU A 41 -8.591 4.000 -9.150 1.00 1.08 C ATOM 639 CD1 LEU A 41 -7.855 3.395 -10.349 1.00 2.68 C ATOM 640 CD2 LEU A 41 -7.716 3.882 -7.898 1.00 1.67 C ATOM 0 H LEU A 41 -9.826 7.570 -10.494 1.00 0.76 H new ATOM 0 HA LEU A 41 -10.374 4.808 -10.904 1.00 0.77 H new ATOM 0 HB2 LEU A 41 -8.213 5.923 -10.078 1.00 0.85 H new ATOM 0 HB3 LEU A 41 -8.982 6.033 -8.507 1.00 0.85 H new ATOM 0 HG LEU A 41 -9.516 3.450 -8.975 1.00 1.08 H new ATOM 0 HD11 LEU A 41 -7.594 2.359 -10.131 1.00 2.68 H new ATOM 0 HD12 LEU A 41 -8.500 3.429 -11.227 1.00 2.68 H new ATOM 0 HD13 LEU A 41 -6.947 3.965 -10.544 1.00 2.68 H new ATOM 0 HD21 LEU A 41 -7.468 2.835 -7.725 1.00 1.67 H new ATOM 0 HD22 LEU A 41 -6.799 4.453 -8.040 1.00 1.67 H new ATOM 0 HD23 LEU A 41 -8.258 4.274 -7.037 1.00 1.67 H new ATOM 652 N VAL A 42 -11.738 6.287 -8.270 1.00 0.72 N ATOM 653 CA VAL A 42 -12.682 6.127 -7.177 1.00 0.74 C ATOM 654 C VAL A 42 -14.094 5.992 -7.740 1.00 0.81 C ATOM 655 O VAL A 42 -14.916 5.240 -7.232 1.00 0.95 O ATOM 656 CB VAL A 42 -12.549 7.272 -6.160 1.00 0.77 C ATOM 657 CG1 VAL A 42 -11.245 7.153 -5.363 1.00 0.78 C ATOM 658 CG2 VAL A 42 -12.618 8.664 -6.770 1.00 0.88 C ATOM 0 H VAL A 42 -11.315 7.213 -8.325 1.00 0.72 H new ATOM 0 HA VAL A 42 -12.456 5.212 -6.629 1.00 0.74 H new ATOM 0 HB VAL A 42 -13.414 7.161 -5.507 1.00 0.77 H new ATOM 0 HG11 VAL A 42 -11.177 7.976 -4.651 1.00 0.78 H new ATOM 0 HG12 VAL A 42 -11.233 6.205 -4.824 1.00 0.78 H new ATOM 0 HG13 VAL A 42 -10.396 7.193 -6.046 1.00 0.78 H new ATOM 0 HG21 VAL A 42 -12.516 9.411 -5.983 1.00 0.88 H new ATOM 0 HG22 VAL A 42 -11.811 8.785 -7.493 1.00 0.88 H new ATOM 0 HG23 VAL A 42 -13.577 8.794 -7.272 1.00 0.88 H new ATOM 668 N THR A 43 -14.365 6.725 -8.816 1.00 0.84 N ATOM 669 CA THR A 43 -15.649 6.713 -9.486 1.00 0.94 C ATOM 670 C THR A 43 -15.821 5.427 -10.315 1.00 0.96 C ATOM 671 O THR A 43 -16.943 4.963 -10.500 1.00 1.19 O ATOM 672 CB THR A 43 -15.718 8.002 -10.311 1.00 1.00 C ATOM 673 OG1 THR A 43 -15.505 9.107 -9.441 1.00 1.03 O ATOM 674 CG2 THR A 43 -17.056 8.186 -11.030 1.00 1.17 C ATOM 0 H THR A 43 -13.685 7.351 -9.248 1.00 0.84 H new ATOM 0 HA THR A 43 -16.483 6.696 -8.784 1.00 0.94 H new ATOM 0 HB THR A 43 -14.949 7.939 -11.081 1.00 1.00 H new ATOM 0 HG1 THR A 43 -14.545 9.210 -9.272 1.00 1.03 H new ATOM 0 HG21 THR A 43 -17.040 9.117 -11.596 1.00 1.17 H new ATOM 0 HG22 THR A 43 -17.221 7.351 -11.710 1.00 1.17 H new ATOM 0 HG23 THR A 43 -17.861 8.221 -10.296 1.00 1.17 H new ATOM 682 N GLN A 44 -14.721 4.862 -10.828 1.00 0.84 N ATOM 683 CA GLN A 44 -14.715 3.685 -11.684 1.00 0.89 C ATOM 684 C GLN A 44 -14.842 2.407 -10.847 1.00 0.88 C ATOM 685 O GLN A 44 -15.742 1.607 -11.088 1.00 0.95 O ATOM 686 CB GLN A 44 -13.429 3.714 -12.522 1.00 1.02 C ATOM 687 CG GLN A 44 -13.271 2.553 -13.512 1.00 1.35 C ATOM 688 CD GLN A 44 -11.927 2.586 -14.245 1.00 1.63 C ATOM 689 OE1 GLN A 44 -11.651 1.723 -15.071 1.00 2.18 O ATOM 690 NE2 GLN A 44 -11.058 3.550 -13.944 1.00 1.93 N ATOM 0 H GLN A 44 -13.786 5.228 -10.649 1.00 0.84 H new ATOM 0 HA GLN A 44 -15.573 3.692 -12.356 1.00 0.89 H new ATOM 0 HB2 GLN A 44 -13.397 4.651 -13.077 1.00 1.02 H new ATOM 0 HB3 GLN A 44 -12.574 3.714 -11.846 1.00 1.02 H new ATOM 0 HG2 GLN A 44 -13.366 1.608 -12.977 1.00 1.35 H new ATOM 0 HG3 GLN A 44 -14.080 2.589 -14.242 1.00 1.35 H new ATOM 0 HE21 GLN A 44 -11.303 4.261 -13.254 1.00 1.93 H new ATOM 0 HE22 GLN A 44 -10.148 3.577 -14.403 1.00 1.93 H new ATOM 699 N GLN A 45 -13.920 2.192 -9.900 1.00 0.93 N ATOM 700 CA GLN A 45 -13.950 1.048 -8.996 1.00 1.22 C ATOM 701 C GLN A 45 -14.578 1.480 -7.656 1.00 1.58 C ATOM 702 O GLN A 45 -15.692 1.994 -7.644 1.00 3.26 O ATOM 703 CB GLN A 45 -12.546 0.419 -8.886 1.00 1.63 C ATOM 704 CG GLN A 45 -12.020 -0.121 -10.230 1.00 1.75 C ATOM 705 CD GLN A 45 -11.231 0.893 -11.061 1.00 2.64 C ATOM 706 OE1 GLN A 45 -11.018 2.030 -10.661 1.00 3.98 O ATOM 707 NE2 GLN A 45 -10.771 0.483 -12.239 1.00 2.97 N ATOM 0 H GLN A 45 -13.128 2.815 -9.743 1.00 0.93 H new ATOM 0 HA GLN A 45 -14.585 0.252 -9.385 1.00 1.22 H new ATOM 0 HB2 GLN A 45 -11.849 1.164 -8.503 1.00 1.63 H new ATOM 0 HB3 GLN A 45 -12.574 -0.394 -8.160 1.00 1.63 H new ATOM 0 HG2 GLN A 45 -11.384 -0.984 -10.035 1.00 1.75 H new ATOM 0 HG3 GLN A 45 -12.866 -0.475 -10.820 1.00 1.75 H new ATOM 0 HE21 GLN A 45 -10.958 -0.468 -12.557 1.00 2.97 H new ATOM 0 HE22 GLN A 45 -10.231 1.120 -12.825 1.00 2.97 H new ATOM 716 N LEU A 46 -13.877 1.246 -6.540 1.00 1.08 N ATOM 717 CA LEU A 46 -14.208 1.641 -5.167 1.00 0.97 C ATOM 718 C LEU A 46 -15.716 1.767 -4.853 1.00 1.07 C ATOM 719 O LEU A 46 -16.173 2.849 -4.488 1.00 1.39 O ATOM 720 CB LEU A 46 -13.494 2.964 -4.836 1.00 0.96 C ATOM 721 CG LEU A 46 -11.956 2.979 -4.789 1.00 1.11 C ATOM 722 CD1 LEU A 46 -11.407 2.179 -3.619 1.00 1.80 C ATOM 723 CD2 LEU A 46 -11.223 2.552 -6.067 1.00 2.34 C ATOM 0 H LEU A 46 -12.995 0.736 -6.577 1.00 1.08 H new ATOM 0 HA LEU A 46 -13.859 0.823 -4.536 1.00 0.97 H new ATOM 0 HB2 LEU A 46 -13.810 3.704 -5.572 1.00 0.96 H new ATOM 0 HB3 LEU A 46 -13.858 3.303 -3.866 1.00 0.96 H new ATOM 0 HG LEU A 46 -11.747 4.042 -4.666 1.00 1.11 H new ATOM 0 HD11 LEU A 46 -10.318 2.220 -3.629 1.00 1.80 H new ATOM 0 HD12 LEU A 46 -11.777 2.600 -2.684 1.00 1.80 H new ATOM 0 HD13 LEU A 46 -11.732 1.142 -3.703 1.00 1.80 H new ATOM 0 HD21 LEU A 46 -10.147 2.606 -5.904 1.00 2.34 H new ATOM 0 HD22 LEU A 46 -11.501 1.529 -6.321 1.00 2.34 H new ATOM 0 HD23 LEU A 46 -11.500 3.217 -6.885 1.00 2.34 H new ATOM 735 N PRO A 47 -16.502 0.679 -4.902 1.00 1.05 N ATOM 736 CA PRO A 47 -17.912 0.733 -4.552 1.00 1.26 C ATOM 737 C PRO A 47 -18.100 0.815 -3.031 1.00 1.33 C ATOM 738 O PRO A 47 -18.862 1.645 -2.539 1.00 1.72 O ATOM 739 CB PRO A 47 -18.518 -0.544 -5.139 1.00 1.35 C ATOM 740 CG PRO A 47 -17.358 -1.540 -5.148 1.00 1.27 C ATOM 741 CD PRO A 47 -16.117 -0.660 -5.316 1.00 1.15 C ATOM 0 HA PRO A 47 -18.402 1.621 -4.950 1.00 1.26 H new ATOM 0 HB2 PRO A 47 -19.349 -0.906 -4.533 1.00 1.35 H new ATOM 0 HB3 PRO A 47 -18.906 -0.375 -6.144 1.00 1.35 H new ATOM 0 HG2 PRO A 47 -17.318 -2.115 -4.223 1.00 1.27 H new ATOM 0 HG3 PRO A 47 -17.453 -2.256 -5.964 1.00 1.27 H new ATOM 0 HD2 PRO A 47 -15.292 -1.032 -4.708 1.00 1.15 H new ATOM 0 HD3 PRO A 47 -15.776 -0.663 -6.351 1.00 1.15 H new ATOM 749 N HIS A 48 -17.439 -0.081 -2.289 1.00 1.23 N ATOM 750 CA HIS A 48 -17.712 -0.337 -0.877 1.00 1.39 C ATOM 751 C HIS A 48 -16.612 0.218 0.035 1.00 1.28 C ATOM 752 O HIS A 48 -16.856 0.450 1.218 1.00 1.81 O ATOM 753 CB HIS A 48 -17.872 -1.855 -0.708 1.00 1.68 C ATOM 754 CG HIS A 48 -18.430 -2.341 0.611 1.00 2.42 C ATOM 755 ND1 HIS A 48 -18.492 -3.662 0.990 1.00 3.68 N ATOM 756 CD2 HIS A 48 -19.086 -1.612 1.570 1.00 2.68 C ATOM 757 CE1 HIS A 48 -19.179 -3.727 2.140 1.00 4.12 C ATOM 758 NE2 HIS A 48 -19.532 -2.497 2.560 1.00 3.44 N ATOM 0 H HIS A 48 -16.686 -0.658 -2.664 1.00 1.23 H new ATOM 0 HA HIS A 48 -18.625 0.178 -0.578 1.00 1.39 H new ATOM 0 HB2 HIS A 48 -18.520 -2.219 -1.505 1.00 1.68 H new ATOM 0 HB3 HIS A 48 -16.896 -2.318 -0.855 1.00 1.68 H new ATOM 0 HD2 HIS A 48 -19.233 -0.542 1.563 1.00 2.68 H new ATOM 0 HE1 HIS A 48 -19.417 -4.643 2.660 1.00 4.12 H new ATOM 0 HE2 HIS A 48 -20.023 -2.259 3.422 1.00 3.44 H new ATOM 766 N LEU A 49 -15.406 0.409 -0.507 1.00 1.01 N ATOM 767 CA LEU A 49 -14.194 0.671 0.253 1.00 0.97 C ATOM 768 C LEU A 49 -14.211 2.117 0.775 1.00 0.94 C ATOM 769 O LEU A 49 -14.760 2.411 1.839 1.00 1.09 O ATOM 770 CB LEU A 49 -13.026 0.361 -0.687 1.00 0.93 C ATOM 771 CG LEU A 49 -11.651 0.235 -0.023 1.00 0.99 C ATOM 772 CD1 LEU A 49 -11.527 -1.021 0.846 1.00 1.20 C ATOM 773 CD2 LEU A 49 -10.642 0.139 -1.168 1.00 1.08 C ATOM 0 H LEU A 49 -15.248 0.384 -1.514 1.00 1.01 H new ATOM 0 HA LEU A 49 -14.103 0.048 1.143 1.00 0.97 H new ATOM 0 HB2 LEU A 49 -13.243 -0.570 -1.210 1.00 0.93 H new ATOM 0 HB3 LEU A 49 -12.974 1.146 -1.442 1.00 0.93 H new ATOM 0 HG LEU A 49 -11.484 1.089 0.633 1.00 0.99 H new ATOM 0 HD11 LEU A 49 -10.533 -1.059 1.291 1.00 1.20 H new ATOM 0 HD12 LEU A 49 -12.278 -0.992 1.636 1.00 1.20 H new ATOM 0 HD13 LEU A 49 -11.682 -1.907 0.230 1.00 1.20 H new ATOM 0 HD21 LEU A 49 -9.636 0.047 -0.759 1.00 1.08 H new ATOM 0 HD22 LEU A 49 -10.867 -0.735 -1.779 1.00 1.08 H new ATOM 0 HD23 LEU A 49 -10.703 1.037 -1.783 1.00 1.08 H new ATOM 785 N LEU A 50 -13.656 3.056 0.004 1.00 0.98 N ATOM 786 CA LEU A 50 -13.726 4.478 0.287 1.00 1.03 C ATOM 787 C LEU A 50 -15.062 4.999 -0.230 1.00 1.19 C ATOM 788 O LEU A 50 -15.112 5.762 -1.191 1.00 2.11 O ATOM 789 CB LEU A 50 -12.541 5.202 -0.365 1.00 1.05 C ATOM 790 CG LEU A 50 -11.205 4.852 0.307 1.00 1.01 C ATOM 791 CD1 LEU A 50 -10.053 5.314 -0.591 1.00 1.15 C ATOM 792 CD2 LEU A 50 -11.074 5.530 1.678 1.00 1.10 C ATOM 0 H LEU A 50 -13.138 2.838 -0.847 1.00 0.98 H new ATOM 0 HA LEU A 50 -13.664 4.663 1.359 1.00 1.03 H new ATOM 0 HB2 LEU A 50 -12.494 4.939 -1.422 1.00 1.05 H new ATOM 0 HB3 LEU A 50 -12.701 6.279 -0.311 1.00 1.05 H new ATOM 0 HG LEU A 50 -11.169 3.772 0.452 1.00 1.01 H new ATOM 0 HD11 LEU A 50 -9.102 5.068 -0.118 1.00 1.15 H new ATOM 0 HD12 LEU A 50 -10.120 4.811 -1.556 1.00 1.15 H new ATOM 0 HD13 LEU A 50 -10.117 6.392 -0.739 1.00 1.15 H new ATOM 0 HD21 LEU A 50 -10.118 5.262 2.127 1.00 1.10 H new ATOM 0 HD22 LEU A 50 -11.127 6.612 1.555 1.00 1.10 H new ATOM 0 HD23 LEU A 50 -11.885 5.199 2.327 1.00 1.10 H new ATOM 804 N LYS A 51 -16.150 4.570 0.414 1.00 1.15 N ATOM 805 CA LYS A 51 -17.453 5.153 0.133 1.00 1.25 C ATOM 806 C LYS A 51 -17.431 6.659 0.430 1.00 1.31 C ATOM 807 O LYS A 51 -16.608 7.119 1.224 1.00 2.17 O ATOM 808 CB LYS A 51 -18.580 4.414 0.867 1.00 1.46 C ATOM 809 CG LYS A 51 -18.433 4.428 2.395 1.00 1.96 C ATOM 810 CD LYS A 51 -19.780 4.165 3.089 1.00 3.02 C ATOM 811 CE LYS A 51 -20.391 2.813 2.687 1.00 3.98 C ATOM 812 NZ LYS A 51 -21.690 2.570 3.349 1.00 5.42 N ATOM 0 H LYS A 51 -16.151 3.834 1.120 1.00 1.15 H new ATOM 0 HA LYS A 51 -17.668 5.032 -0.929 1.00 1.25 H new ATOM 0 HB2 LYS A 51 -19.535 4.866 0.598 1.00 1.46 H new ATOM 0 HB3 LYS A 51 -18.609 3.380 0.523 1.00 1.46 H new ATOM 0 HG2 LYS A 51 -17.711 3.671 2.700 1.00 1.96 H new ATOM 0 HG3 LYS A 51 -18.039 5.392 2.716 1.00 1.96 H new ATOM 0 HD2 LYS A 51 -19.640 4.191 4.170 1.00 3.02 H new ATOM 0 HD3 LYS A 51 -20.477 4.965 2.839 1.00 3.02 H new ATOM 0 HE2 LYS A 51 -20.525 2.784 1.606 1.00 3.98 H new ATOM 0 HE3 LYS A 51 -19.698 2.012 2.944 1.00 3.98 H new ATOM 0 HZ1 LYS A 51 -22.065 1.648 3.049 1.00 5.42 H new ATOM 0 HZ2 LYS A 51 -21.560 2.572 4.381 1.00 5.42 H new ATOM 0 HZ3 LYS A 51 -22.360 3.319 3.084 1.00 5.42 H new ATOM 826 N ASP A 52 -18.339 7.391 -0.221 1.00 1.48 N ATOM 827 CA ASP A 52 -18.238 8.817 -0.513 1.00 1.63 C ATOM 828 C ASP A 52 -17.113 9.041 -1.519 1.00 1.54 C ATOM 829 O ASP A 52 -15.979 9.370 -1.172 1.00 1.94 O ATOM 830 CB ASP A 52 -18.130 9.743 0.707 1.00 2.00 C ATOM 831 CG ASP A 52 -18.077 11.211 0.278 1.00 3.04 C ATOM 832 OD1 ASP A 52 -18.259 11.484 -0.933 1.00 4.44 O ATOM 833 OD2 ASP A 52 -17.857 12.059 1.164 1.00 3.46 O ATOM 0 H ASP A 52 -19.204 6.983 -0.574 1.00 1.48 H new ATOM 0 HA ASP A 52 -19.194 9.111 -0.947 1.00 1.63 H new ATOM 0 HB2 ASP A 52 -18.984 9.584 1.366 1.00 2.00 H new ATOM 0 HB3 ASP A 52 -17.236 9.495 1.278 1.00 2.00 H new ATOM 838 N VAL A 53 -17.476 8.878 -2.790 1.00 1.36 N ATOM 839 CA VAL A 53 -16.678 9.295 -3.929 1.00 1.28 C ATOM 840 C VAL A 53 -17.219 10.630 -4.465 1.00 1.44 C ATOM 841 O VAL A 53 -17.107 10.916 -5.663 1.00 1.97 O ATOM 842 CB VAL A 53 -16.649 8.159 -4.969 1.00 1.32 C ATOM 843 CG1 VAL A 53 -16.079 6.885 -4.327 1.00 2.08 C ATOM 844 CG2 VAL A 53 -18.029 7.837 -5.562 1.00 1.88 C ATOM 0 H VAL A 53 -18.358 8.440 -3.057 1.00 1.36 H new ATOM 0 HA VAL A 53 -15.641 9.478 -3.648 1.00 1.28 H new ATOM 0 HB VAL A 53 -16.018 8.507 -5.786 1.00 1.32 H new ATOM 0 HG11 VAL A 53 -16.060 6.083 -5.065 1.00 2.08 H new ATOM 0 HG12 VAL A 53 -15.066 7.078 -3.974 1.00 2.08 H new ATOM 0 HG13 VAL A 53 -16.706 6.589 -3.486 1.00 2.08 H new ATOM 0 HG21 VAL A 53 -17.934 7.028 -6.287 1.00 1.88 H new ATOM 0 HG22 VAL A 53 -18.706 7.532 -4.764 1.00 1.88 H new ATOM 0 HG23 VAL A 53 -18.428 8.722 -6.057 1.00 1.88 H new ATOM 854 N GLY A 54 -17.817 11.437 -3.578 1.00 1.27 N ATOM 855 CA GLY A 54 -18.349 12.760 -3.840 1.00 1.43 C ATOM 856 C GLY A 54 -17.394 13.796 -3.258 1.00 1.33 C ATOM 857 O GLY A 54 -16.849 14.604 -4.011 1.00 1.45 O ATOM 0 H GLY A 54 -17.944 11.158 -2.605 1.00 1.27 H new ATOM 0 HA2 GLY A 54 -18.466 12.914 -4.913 1.00 1.43 H new ATOM 0 HA3 GLY A 54 -19.338 12.865 -3.393 1.00 1.43 H new ATOM 861 N SER A 55 -17.138 13.749 -1.943 1.00 1.26 N ATOM 862 CA SER A 55 -16.168 14.633 -1.290 1.00 1.25 C ATOM 863 C SER A 55 -14.747 14.134 -1.573 1.00 1.12 C ATOM 864 O SER A 55 -13.973 13.762 -0.689 1.00 1.16 O ATOM 865 CB SER A 55 -16.454 14.786 0.212 1.00 1.35 C ATOM 866 OG SER A 55 -15.965 16.038 0.673 1.00 2.04 O ATOM 0 H SER A 55 -17.597 13.098 -1.306 1.00 1.26 H new ATOM 0 HA SER A 55 -16.264 15.634 -1.710 1.00 1.25 H new ATOM 0 HB2 SER A 55 -17.526 14.715 0.396 1.00 1.35 H new ATOM 0 HB3 SER A 55 -15.981 13.975 0.766 1.00 1.35 H new ATOM 0 HG SER A 55 -15.210 16.320 0.115 1.00 2.04 H new ATOM 872 N LEU A 56 -14.406 14.104 -2.858 1.00 1.16 N ATOM 873 CA LEU A 56 -13.132 13.661 -3.359 1.00 1.13 C ATOM 874 C LEU A 56 -12.074 14.732 -3.057 1.00 1.10 C ATOM 875 O LEU A 56 -10.899 14.417 -2.898 1.00 1.16 O ATOM 876 CB LEU A 56 -13.373 13.353 -4.846 1.00 1.20 C ATOM 877 CG LEU A 56 -12.264 12.622 -5.605 1.00 1.16 C ATOM 878 CD1 LEU A 56 -11.242 13.613 -6.162 1.00 1.10 C ATOM 879 CD2 LEU A 56 -11.612 11.541 -4.748 1.00 1.19 C ATOM 0 H LEU A 56 -15.042 14.401 -3.598 1.00 1.16 H new ATOM 0 HA LEU A 56 -12.737 12.761 -2.887 1.00 1.13 H new ATOM 0 HB2 LEU A 56 -14.282 12.757 -4.923 1.00 1.20 H new ATOM 0 HB3 LEU A 56 -13.566 14.296 -5.358 1.00 1.20 H new ATOM 0 HG LEU A 56 -12.718 12.111 -6.454 1.00 1.16 H new ATOM 0 HD11 LEU A 56 -10.463 13.070 -6.698 1.00 1.10 H new ATOM 0 HD12 LEU A 56 -11.739 14.303 -6.845 1.00 1.10 H new ATOM 0 HD13 LEU A 56 -10.795 14.174 -5.342 1.00 1.10 H new ATOM 0 HD21 LEU A 56 -10.830 11.044 -5.322 1.00 1.19 H new ATOM 0 HD22 LEU A 56 -11.176 11.996 -3.858 1.00 1.19 H new ATOM 0 HD23 LEU A 56 -12.364 10.810 -4.451 1.00 1.19 H new ATOM 891 N ASP A 57 -12.504 15.989 -2.908 1.00 1.14 N ATOM 892 CA ASP A 57 -11.705 17.117 -2.454 1.00 1.26 C ATOM 893 C ASP A 57 -11.000 16.812 -1.127 1.00 1.20 C ATOM 894 O ASP A 57 -9.781 16.954 -1.015 1.00 1.21 O ATOM 895 CB ASP A 57 -12.618 18.352 -2.341 1.00 1.58 C ATOM 896 CG ASP A 57 -13.720 18.234 -1.286 1.00 2.91 C ATOM 897 OD1 ASP A 57 -14.187 17.090 -1.058 1.00 3.75 O ATOM 898 OD2 ASP A 57 -14.057 19.286 -0.710 1.00 4.02 O ATOM 0 H ASP A 57 -13.468 16.254 -3.113 1.00 1.14 H new ATOM 0 HA ASP A 57 -10.916 17.316 -3.179 1.00 1.26 H new ATOM 0 HB2 ASP A 57 -12.003 19.222 -2.110 1.00 1.58 H new ATOM 0 HB3 ASP A 57 -13.080 18.536 -3.311 1.00 1.58 H new ATOM 903 N GLU A 58 -11.764 16.379 -0.123 1.00 1.24 N ATOM 904 CA GLU A 58 -11.255 16.003 1.186 1.00 1.33 C ATOM 905 C GLU A 58 -10.158 14.953 1.008 1.00 1.19 C ATOM 906 O GLU A 58 -9.025 15.130 1.456 1.00 1.22 O ATOM 907 CB GLU A 58 -12.419 15.456 2.023 1.00 1.52 C ATOM 908 CG GLU A 58 -11.969 14.912 3.394 1.00 1.68 C ATOM 909 CD GLU A 58 -12.582 13.561 3.729 1.00 2.24 C ATOM 910 OE1 GLU A 58 -13.567 13.153 3.075 1.00 2.80 O ATOM 911 OE2 GLU A 58 -11.976 12.807 4.522 1.00 3.39 O ATOM 0 H GLU A 58 -12.776 16.280 -0.205 1.00 1.24 H new ATOM 0 HA GLU A 58 -10.827 16.862 1.702 1.00 1.33 H new ATOM 0 HB2 GLU A 58 -13.154 16.247 2.175 1.00 1.52 H new ATOM 0 HB3 GLU A 58 -12.917 14.661 1.468 1.00 1.52 H new ATOM 0 HG2 GLU A 58 -10.883 14.824 3.405 1.00 1.68 H new ATOM 0 HG3 GLU A 58 -12.239 15.629 4.169 1.00 1.68 H new ATOM 918 N LYS A 59 -10.508 13.849 0.346 1.00 1.12 N ATOM 919 CA LYS A 59 -9.581 12.761 0.083 1.00 1.11 C ATOM 920 C LYS A 59 -8.319 13.300 -0.603 1.00 0.99 C ATOM 921 O LYS A 59 -7.206 12.968 -0.200 1.00 1.02 O ATOM 922 CB LYS A 59 -10.278 11.676 -0.749 1.00 1.21 C ATOM 923 CG LYS A 59 -11.544 11.058 -0.117 1.00 2.08 C ATOM 924 CD LYS A 59 -11.247 10.018 0.979 1.00 1.42 C ATOM 925 CE LYS A 59 -11.238 10.592 2.404 1.00 2.01 C ATOM 926 NZ LYS A 59 -12.587 10.830 2.951 1.00 2.62 N ATOM 0 H LYS A 59 -11.446 13.689 -0.021 1.00 1.12 H new ATOM 0 HA LYS A 59 -9.268 12.305 1.022 1.00 1.11 H new ATOM 0 HB2 LYS A 59 -10.548 12.102 -1.715 1.00 1.21 H new ATOM 0 HB3 LYS A 59 -9.563 10.876 -0.942 1.00 1.21 H new ATOM 0 HG2 LYS A 59 -12.153 11.856 0.308 1.00 2.08 H new ATOM 0 HG3 LYS A 59 -12.137 10.587 -0.901 1.00 2.08 H new ATOM 0 HD2 LYS A 59 -11.992 9.225 0.923 1.00 1.42 H new ATOM 0 HD3 LYS A 59 -10.279 9.560 0.777 1.00 1.42 H new ATOM 0 HE2 LYS A 59 -10.704 9.905 3.061 1.00 2.01 H new ATOM 0 HE3 LYS A 59 -10.683 11.530 2.406 1.00 2.01 H new ATOM 0 HZ1 LYS A 59 -12.512 11.120 3.947 1.00 2.62 H new ATOM 0 HZ2 LYS A 59 -13.055 11.582 2.406 1.00 2.62 H new ATOM 0 HZ3 LYS A 59 -13.147 9.956 2.886 1.00 2.62 H new ATOM 940 N MET A 60 -8.488 14.161 -1.609 1.00 0.95 N ATOM 941 CA MET A 60 -7.386 14.740 -2.366 1.00 0.91 C ATOM 942 C MET A 60 -6.441 15.470 -1.420 1.00 0.93 C ATOM 943 O MET A 60 -5.256 15.153 -1.368 1.00 0.94 O ATOM 944 CB MET A 60 -7.918 15.638 -3.497 1.00 0.98 C ATOM 945 CG MET A 60 -6.800 16.264 -4.343 1.00 0.94 C ATOM 946 SD MET A 60 -6.027 17.760 -3.668 1.00 1.37 S ATOM 947 CE MET A 60 -4.769 18.069 -4.927 1.00 1.35 C ATOM 0 H MET A 60 -9.406 14.477 -1.921 1.00 0.95 H new ATOM 0 HA MET A 60 -6.813 13.948 -2.849 1.00 0.91 H new ATOM 0 HB2 MET A 60 -8.570 15.050 -4.144 1.00 0.98 H new ATOM 0 HB3 MET A 60 -8.528 16.432 -3.066 1.00 0.98 H new ATOM 0 HG2 MET A 60 -6.023 15.514 -4.492 1.00 0.94 H new ATOM 0 HG3 MET A 60 -7.207 16.502 -5.326 1.00 0.94 H new ATOM 0 HE1 MET A 60 -4.200 18.960 -4.662 1.00 1.35 H new ATOM 0 HE2 MET A 60 -4.096 17.214 -4.986 1.00 1.35 H new ATOM 0 HE3 MET A 60 -5.251 18.220 -5.893 1.00 1.35 H new ATOM 957 N LYS A 61 -6.966 16.424 -0.650 1.00 1.00 N ATOM 958 CA LYS A 61 -6.142 17.187 0.274 1.00 1.06 C ATOM 959 C LYS A 61 -5.528 16.293 1.354 1.00 1.13 C ATOM 960 O LYS A 61 -4.413 16.545 1.798 1.00 1.25 O ATOM 961 CB LYS A 61 -6.939 18.353 0.865 1.00 1.13 C ATOM 962 CG LYS A 61 -7.330 19.333 -0.249 1.00 1.41 C ATOM 963 CD LYS A 61 -7.700 20.701 0.335 1.00 1.60 C ATOM 964 CE LYS A 61 -7.923 21.719 -0.794 1.00 2.39 C ATOM 965 NZ LYS A 61 -7.661 23.102 -0.348 1.00 3.67 N ATOM 0 H LYS A 61 -7.953 16.682 -0.651 1.00 1.00 H new ATOM 0 HA LYS A 61 -5.306 17.610 -0.282 1.00 1.06 H new ATOM 0 HB2 LYS A 61 -7.833 17.979 1.363 1.00 1.13 H new ATOM 0 HB3 LYS A 61 -6.344 18.866 1.621 1.00 1.13 H new ATOM 0 HG2 LYS A 61 -6.502 19.443 -0.950 1.00 1.41 H new ATOM 0 HG3 LYS A 61 -8.173 18.933 -0.812 1.00 1.41 H new ATOM 0 HD2 LYS A 61 -8.603 20.614 0.939 1.00 1.60 H new ATOM 0 HD3 LYS A 61 -6.906 21.049 0.996 1.00 1.60 H new ATOM 0 HE2 LYS A 61 -7.271 21.479 -1.634 1.00 2.39 H new ATOM 0 HE3 LYS A 61 -8.949 21.642 -1.155 1.00 2.39 H new ATOM 0 HZ1 LYS A 61 -8.058 23.771 -1.039 1.00 3.67 H new ATOM 0 HZ2 LYS A 61 -8.105 23.258 0.579 1.00 3.67 H new ATOM 0 HZ3 LYS A 61 -6.635 23.253 -0.270 1.00 3.67 H new ATOM 979 N SER A 62 -6.238 15.240 1.771 1.00 1.13 N ATOM 980 CA SER A 62 -5.686 14.254 2.687 1.00 1.25 C ATOM 981 C SER A 62 -4.475 13.548 2.062 1.00 1.19 C ATOM 982 O SER A 62 -3.489 13.299 2.758 1.00 1.34 O ATOM 983 CB SER A 62 -6.774 13.258 3.108 1.00 1.35 C ATOM 984 OG SER A 62 -6.290 12.398 4.123 1.00 1.92 O ATOM 0 H SER A 62 -7.199 15.054 1.484 1.00 1.13 H new ATOM 0 HA SER A 62 -5.333 14.762 3.585 1.00 1.25 H new ATOM 0 HB2 SER A 62 -7.650 13.797 3.467 1.00 1.35 H new ATOM 0 HB3 SER A 62 -7.092 12.671 2.246 1.00 1.35 H new ATOM 0 HG SER A 62 -6.995 11.769 4.383 1.00 1.92 H new ATOM 990 N LEU A 63 -4.556 13.194 0.773 1.00 1.03 N ATOM 991 CA LEU A 63 -3.548 12.425 0.045 1.00 1.06 C ATOM 992 C LEU A 63 -2.329 13.261 -0.337 1.00 1.02 C ATOM 993 O LEU A 63 -1.196 12.882 -0.028 1.00 1.10 O ATOM 994 CB LEU A 63 -4.163 11.842 -1.231 1.00 1.08 C ATOM 995 CG LEU A 63 -5.144 10.713 -0.910 1.00 1.24 C ATOM 996 CD1 LEU A 63 -6.137 10.561 -2.061 1.00 1.50 C ATOM 997 CD2 LEU A 63 -4.391 9.398 -0.708 1.00 1.42 C ATOM 0 H LEU A 63 -5.355 13.446 0.191 1.00 1.03 H new ATOM 0 HA LEU A 63 -3.213 11.632 0.714 1.00 1.06 H new ATOM 0 HB2 LEU A 63 -4.679 12.629 -1.781 1.00 1.08 H new ATOM 0 HB3 LEU A 63 -3.372 11.466 -1.879 1.00 1.08 H new ATOM 0 HG LEU A 63 -5.678 10.958 0.008 1.00 1.24 H new ATOM 0 HD11 LEU A 63 -6.837 9.757 -1.834 1.00 1.50 H new ATOM 0 HD12 LEU A 63 -6.686 11.493 -2.193 1.00 1.50 H new ATOM 0 HD13 LEU A 63 -5.598 10.324 -2.978 1.00 1.50 H new ATOM 0 HD21 LEU A 63 -5.101 8.603 -0.480 1.00 1.42 H new ATOM 0 HD22 LEU A 63 -3.846 9.147 -1.618 1.00 1.42 H new ATOM 0 HD23 LEU A 63 -3.688 9.504 0.118 1.00 1.42 H new ATOM 1009 N ASP A 64 -2.564 14.357 -1.058 1.00 0.95 N ATOM 1010 CA ASP A 64 -1.524 15.215 -1.594 1.00 0.96 C ATOM 1011 C ASP A 64 -0.681 15.749 -0.438 1.00 1.20 C ATOM 1012 O ASP A 64 -1.182 16.471 0.420 1.00 1.85 O ATOM 1013 CB ASP A 64 -2.191 16.333 -2.394 1.00 1.04 C ATOM 1014 CG ASP A 64 -1.221 17.254 -3.105 1.00 1.16 C ATOM 1015 OD1 ASP A 64 0.012 17.203 -2.865 1.00 1.38 O ATOM 1016 OD2 ASP A 64 -1.715 18.059 -3.909 1.00 1.61 O ATOM 0 H ASP A 64 -3.506 14.674 -1.287 1.00 0.95 H new ATOM 0 HA ASP A 64 -0.857 14.671 -2.263 1.00 0.96 H new ATOM 0 HB2 ASP A 64 -2.858 15.888 -3.132 1.00 1.04 H new ATOM 0 HB3 ASP A 64 -2.810 16.926 -1.721 1.00 1.04 H new ATOM 1021 N VAL A 65 0.591 15.356 -0.385 1.00 1.28 N ATOM 1022 CA VAL A 65 1.469 15.667 0.723 1.00 1.68 C ATOM 1023 C VAL A 65 1.861 17.144 0.654 1.00 1.50 C ATOM 1024 O VAL A 65 2.107 17.773 1.679 1.00 1.80 O ATOM 1025 CB VAL A 65 2.653 14.678 0.682 1.00 2.16 C ATOM 1026 CG1 VAL A 65 4.026 15.343 0.764 1.00 3.63 C ATOM 1027 CG2 VAL A 65 2.484 13.623 1.779 1.00 2.29 C ATOM 0 H VAL A 65 1.037 14.808 -1.121 1.00 1.28 H new ATOM 0 HA VAL A 65 0.986 15.540 1.692 1.00 1.68 H new ATOM 0 HB VAL A 65 2.627 14.202 -0.298 1.00 2.16 H new ATOM 0 HG11 VAL A 65 4.803 14.579 0.729 1.00 3.63 H new ATOM 0 HG12 VAL A 65 4.150 16.026 -0.076 1.00 3.63 H new ATOM 0 HG13 VAL A 65 4.106 15.899 1.698 1.00 3.63 H new ATOM 0 HG21 VAL A 65 3.322 12.927 1.746 1.00 2.29 H new ATOM 0 HG22 VAL A 65 2.456 14.112 2.753 1.00 2.29 H new ATOM 0 HG23 VAL A 65 1.553 13.078 1.620 1.00 2.29 H new ATOM 1037 N ASN A 66 1.930 17.692 -0.562 1.00 1.20 N ATOM 1038 CA ASN A 66 2.275 19.091 -0.780 1.00 1.20 C ATOM 1039 C ASN A 66 1.021 19.946 -0.630 1.00 1.49 C ATOM 1040 O ASN A 66 1.077 21.054 -0.106 1.00 2.12 O ATOM 1041 CB ASN A 66 2.853 19.292 -2.187 1.00 1.56 C ATOM 1042 CG ASN A 66 3.811 18.181 -2.601 1.00 1.13 C ATOM 1043 OD1 ASN A 66 3.379 17.192 -3.193 1.00 1.24 O ATOM 1044 ND2 ASN A 66 5.094 18.308 -2.279 1.00 2.02 N ATOM 0 H ASN A 66 1.747 17.174 -1.421 1.00 1.20 H new ATOM 0 HA ASN A 66 3.024 19.386 -0.045 1.00 1.20 H new ATOM 0 HB2 ASN A 66 2.035 19.346 -2.906 1.00 1.56 H new ATOM 0 HB3 ASN A 66 3.375 20.248 -2.226 1.00 1.56 H new ATOM 0 HD21 ASN A 66 5.756 17.572 -2.523 1.00 2.02 H new ATOM 0 HD22 ASN A 66 5.416 19.142 -1.788 1.00 2.02 H new ATOM 1051 N GLN A 67 -0.091 19.431 -1.162 1.00 1.33 N ATOM 1052 CA GLN A 67 -1.266 20.197 -1.541 1.00 1.53 C ATOM 1053 C GLN A 67 -0.876 21.123 -2.689 1.00 1.58 C ATOM 1054 O GLN A 67 -0.874 22.346 -2.560 1.00 1.82 O ATOM 1055 CB GLN A 67 -1.957 20.880 -0.357 1.00 1.84 C ATOM 1056 CG GLN A 67 -3.381 21.260 -0.798 1.00 1.97 C ATOM 1057 CD GLN A 67 -4.220 21.874 0.321 1.00 2.35 C ATOM 1058 OE1 GLN A 67 -5.024 22.776 0.087 1.00 2.62 O ATOM 1059 NE2 GLN A 67 -4.099 21.368 1.546 1.00 3.42 N ATOM 0 H GLN A 67 -0.194 18.433 -1.344 1.00 1.33 H new ATOM 0 HA GLN A 67 -2.047 19.527 -1.900 1.00 1.53 H new ATOM 0 HB2 GLN A 67 -1.989 20.212 0.504 1.00 1.84 H new ATOM 0 HB3 GLN A 67 -1.402 21.767 -0.051 1.00 1.84 H new ATOM 0 HG2 GLN A 67 -3.320 21.966 -1.626 1.00 1.97 H new ATOM 0 HG3 GLN A 67 -3.886 20.370 -1.174 1.00 1.97 H new ATOM 0 HE21 GLN A 67 -3.428 20.621 1.725 1.00 3.42 H new ATOM 0 HE22 GLN A 67 -4.677 21.728 2.306 1.00 3.42 H new ATOM 1068 N ASP A 68 -0.524 20.491 -3.807 1.00 1.55 N ATOM 1069 CA ASP A 68 -0.266 21.113 -5.087 1.00 1.69 C ATOM 1070 C ASP A 68 -1.503 20.817 -5.942 1.00 1.92 C ATOM 1071 O ASP A 68 -2.616 21.131 -5.518 1.00 3.64 O ATOM 1072 CB ASP A 68 1.098 20.632 -5.637 1.00 1.61 C ATOM 1073 CG ASP A 68 1.311 19.121 -5.613 1.00 1.43 C ATOM 1074 OD1 ASP A 68 0.360 18.329 -5.726 1.00 1.37 O ATOM 1075 OD2 ASP A 68 2.403 18.624 -5.272 1.00 1.46 O ATOM 0 H ASP A 68 -0.407 19.478 -3.837 1.00 1.55 H new ATOM 0 HA ASP A 68 -0.145 22.196 -5.054 1.00 1.69 H new ATOM 0 HB2 ASP A 68 1.201 20.981 -6.664 1.00 1.61 H new ATOM 0 HB3 ASP A 68 1.892 21.104 -5.059 1.00 1.61 H new ATOM 1080 N SER A 69 -1.344 20.223 -7.122 1.00 1.24 N ATOM 1081 CA SER A 69 -2.439 19.708 -7.940 1.00 1.28 C ATOM 1082 C SER A 69 -2.064 18.336 -8.522 1.00 1.04 C ATOM 1083 O SER A 69 -2.660 17.878 -9.496 1.00 1.06 O ATOM 1084 CB SER A 69 -2.755 20.731 -9.041 1.00 1.56 C ATOM 1085 OG SER A 69 -4.091 20.604 -9.494 1.00 2.47 O ATOM 0 H SER A 69 -0.427 20.083 -7.546 1.00 1.24 H new ATOM 0 HA SER A 69 -3.333 19.565 -7.333 1.00 1.28 H new ATOM 0 HB2 SER A 69 -2.592 21.739 -8.661 1.00 1.56 H new ATOM 0 HB3 SER A 69 -2.070 20.591 -9.878 1.00 1.56 H new ATOM 0 HG SER A 69 -4.264 21.269 -10.193 1.00 2.47 H new ATOM 1091 N GLU A 70 -1.057 17.683 -7.934 1.00 1.05 N ATOM 1092 CA GLU A 70 -0.362 16.543 -8.491 1.00 0.97 C ATOM 1093 C GLU A 70 -0.259 15.493 -7.395 1.00 0.95 C ATOM 1094 O GLU A 70 0.463 15.681 -6.413 1.00 1.07 O ATOM 1095 CB GLU A 70 1.050 16.959 -8.942 1.00 1.13 C ATOM 1096 CG GLU A 70 1.068 17.885 -10.169 1.00 1.49 C ATOM 1097 CD GLU A 70 0.648 19.323 -9.878 1.00 3.70 C ATOM 1098 OE1 GLU A 70 0.791 19.752 -8.712 1.00 5.02 O ATOM 1099 OE2 GLU A 70 0.178 19.974 -10.834 1.00 4.82 O ATOM 0 H GLU A 70 -0.697 17.954 -7.019 1.00 1.05 H new ATOM 0 HA GLU A 70 -0.899 16.152 -9.355 1.00 0.97 H new ATOM 0 HB2 GLU A 70 1.552 17.460 -8.114 1.00 1.13 H new ATOM 0 HB3 GLU A 70 1.627 16.062 -9.168 1.00 1.13 H new ATOM 0 HG2 GLU A 70 2.073 17.891 -10.590 1.00 1.49 H new ATOM 0 HG3 GLU A 70 0.406 17.473 -10.930 1.00 1.49 H new ATOM 1106 N LEU A 71 -0.938 14.364 -7.566 1.00 0.84 N ATOM 1107 CA LEU A 71 -0.712 13.194 -6.741 1.00 0.76 C ATOM 1108 C LEU A 71 0.474 12.468 -7.379 1.00 0.72 C ATOM 1109 O LEU A 71 0.261 11.629 -8.254 1.00 0.71 O ATOM 1110 CB LEU A 71 -1.969 12.304 -6.729 1.00 0.74 C ATOM 1111 CG LEU A 71 -3.189 12.829 -5.947 1.00 0.84 C ATOM 1112 CD1 LEU A 71 -2.959 12.774 -4.432 1.00 0.87 C ATOM 1113 CD2 LEU A 71 -3.647 14.230 -6.364 1.00 1.00 C ATOM 0 H LEU A 71 -1.657 14.239 -8.279 1.00 0.84 H new ATOM 0 HA LEU A 71 -0.503 13.454 -5.703 1.00 0.76 H new ATOM 0 HB2 LEU A 71 -2.275 12.136 -7.762 1.00 0.74 H new ATOM 0 HB3 LEU A 71 -1.693 11.334 -6.316 1.00 0.74 H new ATOM 0 HG LEU A 71 -4.000 12.150 -6.210 1.00 0.84 H new ATOM 0 HD11 LEU A 71 -3.841 13.152 -3.916 1.00 0.87 H new ATOM 0 HD12 LEU A 71 -2.776 11.743 -4.129 1.00 0.87 H new ATOM 0 HD13 LEU A 71 -2.096 13.387 -4.172 1.00 0.87 H new ATOM 0 HD21 LEU A 71 -4.509 14.524 -5.766 1.00 1.00 H new ATOM 0 HD22 LEU A 71 -2.836 14.940 -6.205 1.00 1.00 H new ATOM 0 HD23 LEU A 71 -3.922 14.224 -7.419 1.00 1.00 H new ATOM 1125 N LYS A 72 1.713 12.815 -7.002 1.00 0.77 N ATOM 1126 CA LYS A 72 2.910 12.124 -7.490 1.00 0.81 C ATOM 1127 C LYS A 72 2.782 10.620 -7.212 1.00 0.70 C ATOM 1128 O LYS A 72 2.055 10.260 -6.292 1.00 0.68 O ATOM 1129 CB LYS A 72 4.135 12.723 -6.773 1.00 1.09 C ATOM 1130 CG LYS A 72 5.508 12.201 -7.225 1.00 0.99 C ATOM 1131 CD LYS A 72 5.833 12.709 -8.641 1.00 1.86 C ATOM 1132 CE LYS A 72 7.068 12.033 -9.247 1.00 3.60 C ATOM 1133 NZ LYS A 72 8.331 12.552 -8.691 1.00 4.53 N ATOM 0 H LYS A 72 1.911 13.578 -6.354 1.00 0.77 H new ATOM 0 HA LYS A 72 3.025 12.255 -8.566 1.00 0.81 H new ATOM 0 HB2 LYS A 72 4.117 13.804 -6.910 1.00 1.09 H new ATOM 0 HB3 LYS A 72 4.032 12.535 -5.704 1.00 1.09 H new ATOM 0 HG2 LYS A 72 6.278 12.531 -6.527 1.00 0.99 H new ATOM 0 HG3 LYS A 72 5.512 11.111 -7.212 1.00 0.99 H new ATOM 0 HD2 LYS A 72 4.975 12.535 -9.290 1.00 1.86 H new ATOM 0 HD3 LYS A 72 5.994 13.786 -8.607 1.00 1.86 H new ATOM 0 HE2 LYS A 72 7.012 10.959 -9.071 1.00 3.60 H new ATOM 0 HE3 LYS A 72 7.064 12.179 -10.327 1.00 3.60 H new ATOM 0 HZ1 LYS A 72 9.133 12.061 -9.135 1.00 4.53 H new ATOM 0 HZ2 LYS A 72 8.401 13.572 -8.881 1.00 4.53 H new ATOM 0 HZ3 LYS A 72 8.351 12.389 -7.664 1.00 4.53 H new ATOM 1147 N PHE A 73 3.520 9.749 -7.920 1.00 0.76 N ATOM 1148 CA PHE A 73 3.432 8.288 -7.791 1.00 0.78 C ATOM 1149 C PHE A 73 3.204 7.853 -6.342 1.00 0.73 C ATOM 1150 O PHE A 73 2.270 7.112 -6.055 1.00 0.79 O ATOM 1151 CB PHE A 73 4.726 7.642 -8.330 1.00 0.86 C ATOM 1152 CG PHE A 73 4.718 6.133 -8.549 1.00 1.63 C ATOM 1153 CD1 PHE A 73 4.580 5.235 -7.468 1.00 3.11 C ATOM 1154 CD2 PHE A 73 4.991 5.621 -9.834 1.00 2.74 C ATOM 1155 CE1 PHE A 73 4.607 3.847 -7.691 1.00 4.61 C ATOM 1156 CE2 PHE A 73 5.072 4.233 -10.044 1.00 4.13 C ATOM 1157 CZ PHE A 73 4.852 3.345 -8.980 1.00 4.88 C ATOM 0 H PHE A 73 4.208 10.048 -8.611 1.00 0.76 H new ATOM 0 HA PHE A 73 2.574 7.954 -8.375 1.00 0.78 H new ATOM 0 HB2 PHE A 73 4.971 8.119 -9.279 1.00 0.86 H new ATOM 0 HB3 PHE A 73 5.534 7.878 -7.637 1.00 0.86 H new ATOM 0 HD1 PHE A 73 4.453 5.616 -6.465 1.00 3.11 H new ATOM 0 HD2 PHE A 73 5.139 6.299 -10.662 1.00 2.74 H new ATOM 0 HE1 PHE A 73 4.439 3.166 -6.870 1.00 4.61 H new ATOM 0 HE2 PHE A 73 5.304 3.849 -11.027 1.00 4.13 H new ATOM 0 HZ PHE A 73 4.871 2.279 -9.152 1.00 4.88 H new ATOM 1167 N ASN A 74 4.050 8.314 -5.416 1.00 0.73 N ATOM 1168 CA ASN A 74 3.946 7.928 -4.015 1.00 0.78 C ATOM 1169 C ASN A 74 2.712 8.534 -3.326 1.00 0.89 C ATOM 1170 O ASN A 74 2.042 7.855 -2.545 1.00 1.17 O ATOM 1171 CB ASN A 74 5.241 8.268 -3.277 1.00 0.82 C ATOM 1172 CG ASN A 74 5.176 7.815 -1.825 1.00 1.10 C ATOM 1173 OD1 ASN A 74 5.243 8.617 -0.904 1.00 2.07 O ATOM 1174 ND2 ASN A 74 5.085 6.507 -1.614 1.00 2.55 N ATOM 0 H ASN A 74 4.816 8.957 -5.618 1.00 0.73 H new ATOM 0 HA ASN A 74 3.804 6.848 -3.977 1.00 0.78 H new ATOM 0 HB2 ASN A 74 6.084 7.788 -3.774 1.00 0.82 H new ATOM 0 HB3 ASN A 74 5.416 9.343 -3.319 1.00 0.82 H new ATOM 0 HD21 ASN A 74 5.069 6.144 -0.661 1.00 2.55 H new ATOM 0 HD22 ASN A 74 5.031 5.865 -2.405 1.00 2.55 H new ATOM 1181 N GLU A 75 2.395 9.799 -3.620 1.00 0.77 N ATOM 1182 CA GLU A 75 1.209 10.459 -3.094 1.00 0.85 C ATOM 1183 C GLU A 75 -0.056 9.761 -3.586 1.00 0.91 C ATOM 1184 O GLU A 75 -1.052 9.717 -2.872 1.00 1.26 O ATOM 1185 CB GLU A 75 1.143 11.920 -3.550 1.00 0.86 C ATOM 1186 CG GLU A 75 2.362 12.761 -3.173 1.00 0.90 C ATOM 1187 CD GLU A 75 2.133 14.186 -3.638 1.00 0.97 C ATOM 1188 OE1 GLU A 75 2.311 14.509 -4.831 1.00 1.56 O ATOM 1189 OE2 GLU A 75 1.651 15.023 -2.853 1.00 2.12 O ATOM 0 H GLU A 75 2.959 10.390 -4.231 1.00 0.77 H new ATOM 0 HA GLU A 75 1.272 10.411 -2.007 1.00 0.85 H new ATOM 0 HB2 GLU A 75 1.023 11.944 -4.633 1.00 0.86 H new ATOM 0 HB3 GLU A 75 0.253 12.381 -3.121 1.00 0.86 H new ATOM 0 HG2 GLU A 75 2.519 12.736 -2.095 1.00 0.90 H new ATOM 0 HG3 GLU A 75 3.260 12.352 -3.636 1.00 0.90 H new ATOM 1196 N TYR A 76 -0.042 9.245 -4.816 1.00 0.74 N ATOM 1197 CA TYR A 76 -1.174 8.495 -5.316 1.00 0.78 C ATOM 1198 C TYR A 76 -1.192 7.112 -4.691 1.00 0.86 C ATOM 1199 O TYR A 76 -2.243 6.686 -4.216 1.00 0.90 O ATOM 1200 CB TYR A 76 -1.186 8.397 -6.835 1.00 0.79 C ATOM 1201 CG TYR A 76 -2.564 7.977 -7.296 1.00 1.19 C ATOM 1202 CD1 TYR A 76 -2.893 6.615 -7.420 1.00 1.54 C ATOM 1203 CD2 TYR A 76 -3.588 8.938 -7.301 1.00 2.74 C ATOM 1204 CE1 TYR A 76 -4.223 6.232 -7.670 1.00 1.91 C ATOM 1205 CE2 TYR A 76 -4.917 8.556 -7.511 1.00 3.41 C ATOM 1206 CZ TYR A 76 -5.233 7.208 -7.736 1.00 2.61 C ATOM 1207 OH TYR A 76 -6.492 6.857 -8.115 1.00 3.43 O ATOM 0 H TYR A 76 0.735 9.336 -5.471 1.00 0.74 H new ATOM 0 HA TYR A 76 -2.076 9.036 -5.031 1.00 0.78 H new ATOM 0 HB2 TYR A 76 -0.919 9.358 -7.275 1.00 0.79 H new ATOM 0 HB3 TYR A 76 -0.442 7.675 -7.171 1.00 0.79 H new ATOM 0 HD1 TYR A 76 -2.124 5.863 -7.323 1.00 1.54 H new ATOM 0 HD2 TYR A 76 -3.348 9.979 -7.142 1.00 2.74 H new ATOM 0 HE1 TYR A 76 -4.468 5.190 -7.811 1.00 1.91 H new ATOM 0 HE2 TYR A 76 -5.700 9.299 -7.500 1.00 3.41 H new ATOM 0 HH TYR A 76 -6.803 7.465 -8.818 1.00 3.43 H new ATOM 1217 N TRP A 77 -0.037 6.425 -4.672 1.00 0.91 N ATOM 1218 CA TRP A 77 0.105 5.151 -3.980 1.00 0.90 C ATOM 1219 C TRP A 77 -0.571 5.255 -2.622 1.00 0.85 C ATOM 1220 O TRP A 77 -1.221 4.296 -2.216 1.00 0.79 O ATOM 1221 CB TRP A 77 1.561 4.674 -3.794 1.00 0.92 C ATOM 1222 CG TRP A 77 1.656 3.705 -2.645 1.00 0.88 C ATOM 1223 CD1 TRP A 77 1.672 4.106 -1.354 1.00 1.42 C ATOM 1224 CD2 TRP A 77 1.323 2.281 -2.595 1.00 2.17 C ATOM 1225 NE1 TRP A 77 1.054 3.138 -0.596 1.00 1.70 N ATOM 1226 CE2 TRP A 77 0.877 1.965 -1.282 1.00 2.04 C ATOM 1227 CE3 TRP A 77 1.354 1.215 -3.508 1.00 3.86 C ATOM 1228 CZ2 TRP A 77 0.417 0.693 -0.919 1.00 3.18 C ATOM 1229 CZ3 TRP A 77 1.150 -0.109 -3.054 1.00 4.79 C ATOM 1230 CH2 TRP A 77 0.522 -0.350 -1.832 1.00 4.52 C ATOM 0 H TRP A 77 0.814 6.742 -5.136 1.00 0.91 H new ATOM 0 HA TRP A 77 -0.369 4.403 -4.616 1.00 0.90 H new ATOM 0 HB2 TRP A 77 1.914 4.198 -4.709 1.00 0.92 H new ATOM 0 HB3 TRP A 77 2.210 5.530 -3.610 1.00 0.92 H new ATOM 0 HD1 TRP A 77 2.096 5.027 -0.982 1.00 1.42 H new ATOM 0 HE1 TRP A 77 0.760 3.278 0.371 1.00 1.70 H new ATOM 0 HE3 TRP A 77 1.533 1.406 -4.556 1.00 3.86 H new ATOM 0 HZ2 TRP A 77 -0.014 0.525 0.057 1.00 3.18 H new ATOM 0 HZ3 TRP A 77 1.483 -0.940 -3.658 1.00 4.79 H new ATOM 0 HH2 TRP A 77 0.125 -1.327 -1.600 1.00 4.52 H new ATOM 1241 N ARG A 78 -0.359 6.367 -1.899 1.00 0.88 N ATOM 1242 CA ARG A 78 -1.000 6.560 -0.602 1.00 0.87 C ATOM 1243 C ARG A 78 -2.426 6.053 -0.664 1.00 0.82 C ATOM 1244 O ARG A 78 -2.748 5.210 0.146 1.00 0.91 O ATOM 1245 CB ARG A 78 -1.035 7.994 -0.067 1.00 0.89 C ATOM 1246 CG ARG A 78 0.247 8.443 0.637 1.00 1.50 C ATOM 1247 CD ARG A 78 0.028 9.813 1.288 1.00 1.61 C ATOM 1248 NE ARG A 78 -1.050 9.800 2.303 1.00 2.18 N ATOM 1249 CZ ARG A 78 -1.631 10.899 2.803 1.00 2.84 C ATOM 1250 NH1 ARG A 78 -1.200 12.116 2.469 1.00 3.20 N ATOM 1251 NH2 ARG A 78 -2.685 10.785 3.609 1.00 4.28 N ATOM 0 H ARG A 78 0.246 7.134 -2.192 1.00 0.88 H new ATOM 0 HA ARG A 78 -0.373 5.999 0.091 1.00 0.87 H new ATOM 0 HB2 ARG A 78 -1.235 8.672 -0.896 1.00 0.89 H new ATOM 0 HB3 ARG A 78 -1.868 8.088 0.629 1.00 0.89 H new ATOM 0 HG2 ARG A 78 0.533 7.712 1.393 1.00 1.50 H new ATOM 0 HG3 ARG A 78 1.067 8.497 -0.080 1.00 1.50 H new ATOM 0 HD2 ARG A 78 0.957 10.141 1.755 1.00 1.61 H new ATOM 0 HD3 ARG A 78 -0.215 10.543 0.516 1.00 1.61 H new ATOM 0 HE ARG A 78 -1.372 8.894 2.644 1.00 2.18 H new ATOM 0 HH11 ARG A 78 -0.417 12.220 1.824 1.00 3.20 H new ATOM 0 HH12 ARG A 78 -1.653 12.942 2.859 1.00 3.20 H new ATOM 0 HH21 ARG A 78 -3.049 9.862 3.845 1.00 4.28 H new ATOM 0 HH22 ARG A 78 -3.128 11.621 3.990 1.00 4.28 H new ATOM 1265 N LEU A 79 -3.247 6.458 -1.638 1.00 0.73 N ATOM 1266 CA LEU A 79 -4.609 5.960 -1.759 1.00 0.68 C ATOM 1267 C LEU A 79 -4.692 4.450 -1.548 1.00 0.71 C ATOM 1268 O LEU A 79 -5.528 4.000 -0.773 1.00 0.72 O ATOM 1269 CB LEU A 79 -5.188 6.327 -3.129 1.00 0.67 C ATOM 1270 CG LEU A 79 -6.695 6.033 -3.176 1.00 0.63 C ATOM 1271 CD1 LEU A 79 -7.463 7.146 -2.471 1.00 0.66 C ATOM 1272 CD2 LEU A 79 -7.154 5.911 -4.634 1.00 0.67 C ATOM 0 H LEU A 79 -2.984 7.134 -2.355 1.00 0.73 H new ATOM 0 HA LEU A 79 -5.197 6.435 -0.974 1.00 0.68 H new ATOM 0 HB2 LEU A 79 -5.012 7.383 -3.333 1.00 0.67 H new ATOM 0 HB3 LEU A 79 -4.677 5.762 -3.909 1.00 0.67 H new ATOM 0 HG LEU A 79 -6.894 5.092 -2.664 1.00 0.63 H new ATOM 0 HD11 LEU A 79 -8.531 6.931 -2.508 1.00 0.66 H new ATOM 0 HD12 LEU A 79 -7.141 7.208 -1.431 1.00 0.66 H new ATOM 0 HD13 LEU A 79 -7.266 8.096 -2.969 1.00 0.66 H new ATOM 0 HD21 LEU A 79 -8.223 5.702 -4.663 1.00 0.67 H new ATOM 0 HD22 LEU A 79 -6.952 6.845 -5.158 1.00 0.67 H new ATOM 0 HD23 LEU A 79 -6.613 5.099 -5.119 1.00 0.67 H new ATOM 1284 N ILE A 80 -3.811 3.697 -2.207 1.00 0.77 N ATOM 1285 CA ILE A 80 -3.730 2.244 -2.157 1.00 0.81 C ATOM 1286 C ILE A 80 -3.270 1.826 -0.759 1.00 0.92 C ATOM 1287 O ILE A 80 -3.839 0.924 -0.152 1.00 0.89 O ATOM 1288 CB ILE A 80 -2.855 1.671 -3.294 1.00 0.95 C ATOM 1289 CG1 ILE A 80 -3.480 1.967 -4.676 1.00 1.08 C ATOM 1290 CG2 ILE A 80 -2.748 0.143 -3.156 1.00 0.99 C ATOM 1291 CD1 ILE A 80 -2.933 3.231 -5.339 1.00 1.76 C ATOM 0 H ILE A 80 -3.103 4.106 -2.817 1.00 0.77 H new ATOM 0 HA ILE A 80 -4.716 1.814 -2.331 1.00 0.81 H new ATOM 0 HB ILE A 80 -1.874 2.140 -3.219 1.00 0.95 H new ATOM 0 HG12 ILE A 80 -3.304 1.116 -5.334 1.00 1.08 H new ATOM 0 HG13 ILE A 80 -4.560 2.064 -4.563 1.00 1.08 H new ATOM 0 HG21 ILE A 80 -2.129 -0.253 -3.962 1.00 0.99 H new ATOM 0 HG22 ILE A 80 -2.295 -0.105 -2.196 1.00 0.99 H new ATOM 0 HG23 ILE A 80 -3.743 -0.298 -3.213 1.00 0.99 H new ATOM 0 HD11 ILE A 80 -3.418 3.374 -6.305 1.00 1.76 H new ATOM 0 HD12 ILE A 80 -3.133 4.092 -4.701 1.00 1.76 H new ATOM 0 HD13 ILE A 80 -1.858 3.129 -5.484 1.00 1.76 H new ATOM 1303 N GLY A 81 -2.265 2.512 -0.218 1.00 1.15 N ATOM 1304 CA GLY A 81 -1.763 2.272 1.127 1.00 1.35 C ATOM 1305 C GLY A 81 -2.805 2.483 2.207 1.00 1.34 C ATOM 1306 O GLY A 81 -2.847 1.787 3.220 1.00 1.56 O ATOM 0 H GLY A 81 -1.773 3.258 -0.710 1.00 1.15 H new ATOM 0 HA2 GLY A 81 -1.388 1.250 1.190 1.00 1.35 H new ATOM 0 HA3 GLY A 81 -0.918 2.934 1.314 1.00 1.35 H new ATOM 1310 N GLU A 82 -3.634 3.482 1.980 1.00 1.19 N ATOM 1311 CA GLU A 82 -4.639 3.940 2.888 1.00 1.32 C ATOM 1312 C GLU A 82 -5.752 2.910 2.794 1.00 1.27 C ATOM 1313 O GLU A 82 -6.071 2.249 3.774 1.00 1.53 O ATOM 1314 CB GLU A 82 -5.030 5.368 2.514 1.00 1.31 C ATOM 1315 CG GLU A 82 -3.768 6.264 2.534 1.00 1.49 C ATOM 1316 CD GLU A 82 -3.547 7.083 3.788 1.00 2.02 C ATOM 1317 OE1 GLU A 82 -3.857 6.545 4.874 1.00 2.38 O ATOM 1318 OE2 GLU A 82 -2.974 8.189 3.646 1.00 3.12 O ATOM 0 H GLU A 82 -3.615 4.016 1.111 1.00 1.19 H new ATOM 0 HA GLU A 82 -4.323 4.010 3.929 1.00 1.32 H new ATOM 0 HB2 GLU A 82 -5.487 5.385 1.525 1.00 1.31 H new ATOM 0 HB3 GLU A 82 -5.773 5.750 3.215 1.00 1.31 H new ATOM 0 HG2 GLU A 82 -2.895 5.629 2.382 1.00 1.49 H new ATOM 0 HG3 GLU A 82 -3.819 6.945 1.685 1.00 1.49 H new ATOM 1325 N LEU A 83 -6.275 2.663 1.596 1.00 1.04 N ATOM 1326 CA LEU A 83 -7.292 1.641 1.461 1.00 1.05 C ATOM 1327 C LEU A 83 -6.837 0.259 1.955 1.00 1.00 C ATOM 1328 O LEU A 83 -7.637 -0.490 2.520 1.00 1.05 O ATOM 1329 CB LEU A 83 -7.976 1.656 0.101 1.00 1.41 C ATOM 1330 CG LEU A 83 -7.075 1.399 -1.111 1.00 1.07 C ATOM 1331 CD1 LEU A 83 -6.836 -0.067 -1.432 1.00 2.20 C ATOM 1332 CD2 LEU A 83 -7.613 2.081 -2.373 1.00 1.75 C ATOM 0 H LEU A 83 -6.018 3.143 0.733 1.00 1.04 H new ATOM 0 HA LEU A 83 -8.089 1.908 2.155 1.00 1.05 H new ATOM 0 HB2 LEU A 83 -8.766 0.905 0.106 1.00 1.41 H new ATOM 0 HB3 LEU A 83 -8.458 2.625 -0.030 1.00 1.41 H new ATOM 0 HG LEU A 83 -6.119 1.829 -0.813 1.00 1.07 H new ATOM 0 HD11 LEU A 83 -6.188 -0.147 -2.304 1.00 2.20 H new ATOM 0 HD12 LEU A 83 -6.360 -0.553 -0.580 1.00 2.20 H new ATOM 0 HD13 LEU A 83 -7.789 -0.553 -1.642 1.00 2.20 H new ATOM 0 HD21 LEU A 83 -6.946 1.875 -3.210 1.00 1.75 H new ATOM 0 HD22 LEU A 83 -8.608 1.697 -2.598 1.00 1.75 H new ATOM 0 HD23 LEU A 83 -7.668 3.157 -2.210 1.00 1.75 H new ATOM 1344 N ALA A 84 -5.543 -0.048 1.815 1.00 1.07 N ATOM 1345 CA ALA A 84 -4.948 -1.277 2.317 1.00 1.25 C ATOM 1346 C ALA A 84 -5.019 -1.393 3.842 1.00 1.40 C ATOM 1347 O ALA A 84 -4.976 -2.516 4.339 1.00 1.77 O ATOM 1348 CB ALA A 84 -3.506 -1.427 1.826 1.00 1.40 C ATOM 0 H ALA A 84 -4.876 0.563 1.343 1.00 1.07 H new ATOM 0 HA ALA A 84 -5.543 -2.097 1.914 1.00 1.25 H new ATOM 0 HB1 ALA A 84 -3.084 -2.353 2.215 1.00 1.40 H new ATOM 0 HB2 ALA A 84 -3.493 -1.452 0.736 1.00 1.40 H new ATOM 0 HB3 ALA A 84 -2.913 -0.583 2.176 1.00 1.40 H new ATOM 1354 N LYS A 85 -5.102 -0.287 4.601 1.00 1.26 N ATOM 1355 CA LYS A 85 -5.621 -0.362 5.969 1.00 1.31 C ATOM 1356 C LYS A 85 -7.151 -0.287 6.021 1.00 1.26 C ATOM 1357 O LYS A 85 -7.751 -1.003 6.820 1.00 1.30 O ATOM 1358 CB LYS A 85 -4.895 0.532 6.993 1.00 1.73 C ATOM 1359 CG LYS A 85 -5.371 1.983 7.105 1.00 1.28 C ATOM 1360 CD LYS A 85 -4.614 2.894 6.148 1.00 2.24 C ATOM 1361 CE LYS A 85 -3.250 3.332 6.662 1.00 1.41 C ATOM 1362 NZ LYS A 85 -3.008 4.780 6.497 1.00 1.66 N ATOM 0 H LYS A 85 -4.823 0.646 4.297 1.00 1.26 H new ATOM 0 HA LYS A 85 -5.366 -1.364 6.316 1.00 1.31 H new ATOM 0 HB2 LYS A 85 -4.988 0.068 7.975 1.00 1.73 H new ATOM 0 HB3 LYS A 85 -3.834 0.541 6.744 1.00 1.73 H new ATOM 0 HG2 LYS A 85 -6.438 2.034 6.890 1.00 1.28 H new ATOM 0 HG3 LYS A 85 -5.234 2.334 8.128 1.00 1.28 H new ATOM 0 HD2 LYS A 85 -4.484 2.378 5.197 1.00 2.24 H new ATOM 0 HD3 LYS A 85 -5.218 3.779 5.950 1.00 2.24 H new ATOM 0 HE2 LYS A 85 -3.165 3.073 7.717 1.00 1.41 H new ATOM 0 HE3 LYS A 85 -2.474 2.777 6.135 1.00 1.41 H new ATOM 0 HZ1 LYS A 85 -1.989 4.972 6.571 1.00 1.66 H new ATOM 0 HZ2 LYS A 85 -3.351 5.085 5.564 1.00 1.66 H new ATOM 0 HZ3 LYS A 85 -3.514 5.303 7.240 1.00 1.66 H new ATOM 1376 N GLU A 86 -7.793 0.585 5.223 1.00 1.24 N ATOM 1377 CA GLU A 86 -9.226 0.867 5.318 1.00 1.25 C ATOM 1378 C GLU A 86 -10.049 -0.416 5.262 1.00 1.18 C ATOM 1379 O GLU A 86 -11.003 -0.541 6.027 1.00 1.29 O ATOM 1380 CB GLU A 86 -9.725 1.858 4.254 1.00 1.24 C ATOM 1381 CG GLU A 86 -9.096 3.260 4.389 1.00 1.36 C ATOM 1382 CD GLU A 86 -9.686 4.070 5.541 1.00 1.72 C ATOM 1383 OE1 GLU A 86 -10.771 4.662 5.358 1.00 2.05 O ATOM 1384 OE2 GLU A 86 -9.046 4.088 6.619 1.00 2.54 O ATOM 0 H GLU A 86 -7.323 1.115 4.490 1.00 1.24 H new ATOM 0 HA GLU A 86 -9.367 1.343 6.289 1.00 1.25 H new ATOM 0 HB2 GLU A 86 -9.503 1.461 3.264 1.00 1.24 H new ATOM 0 HB3 GLU A 86 -10.809 1.944 4.327 1.00 1.24 H new ATOM 0 HG2 GLU A 86 -8.021 3.157 4.538 1.00 1.36 H new ATOM 0 HG3 GLU A 86 -9.238 3.807 3.457 1.00 1.36 H new ATOM 1391 N ILE A 87 -9.656 -1.373 4.415 1.00 1.11 N ATOM 1392 CA ILE A 87 -10.143 -2.752 4.441 1.00 1.18 C ATOM 1393 C ILE A 87 -10.601 -3.173 5.845 1.00 1.07 C ATOM 1394 O ILE A 87 -11.726 -3.640 6.009 1.00 1.22 O ATOM 1395 CB ILE A 87 -9.051 -3.685 3.877 1.00 1.31 C ATOM 1396 CG1 ILE A 87 -9.431 -5.174 3.865 1.00 1.81 C ATOM 1397 CG2 ILE A 87 -7.728 -3.586 4.635 1.00 1.58 C ATOM 1398 CD1 ILE A 87 -10.357 -5.494 2.704 1.00 1.02 C ATOM 0 H ILE A 87 -8.974 -1.204 3.676 1.00 1.11 H new ATOM 0 HA ILE A 87 -11.027 -2.828 3.808 1.00 1.18 H new ATOM 0 HB ILE A 87 -8.944 -3.326 2.853 1.00 1.31 H new ATOM 0 HG12 ILE A 87 -8.529 -5.782 3.793 1.00 1.81 H new ATOM 0 HG13 ILE A 87 -9.917 -5.436 4.805 1.00 1.81 H new ATOM 0 HG21 ILE A 87 -7.002 -4.266 4.190 1.00 1.58 H new ATOM 0 HG22 ILE A 87 -7.351 -2.565 4.578 1.00 1.58 H new ATOM 0 HG23 ILE A 87 -7.886 -3.856 5.679 1.00 1.58 H new ATOM 0 HD11 ILE A 87 -10.609 -6.554 2.721 1.00 1.02 H new ATOM 0 HD12 ILE A 87 -11.269 -4.903 2.792 1.00 1.02 H new ATOM 0 HD13 ILE A 87 -9.859 -5.255 1.765 1.00 1.02 H new ATOM 1410 N ARG A 88 -9.753 -2.950 6.858 1.00 1.05 N ATOM 1411 CA ARG A 88 -10.002 -3.355 8.229 1.00 1.14 C ATOM 1412 C ARG A 88 -10.144 -2.157 9.196 1.00 1.28 C ATOM 1413 O ARG A 88 -11.079 -2.114 9.996 1.00 1.56 O ATOM 1414 CB ARG A 88 -8.994 -4.450 8.614 1.00 1.64 C ATOM 1415 CG ARG A 88 -7.534 -3.989 8.727 1.00 2.02 C ATOM 1416 CD ARG A 88 -6.850 -4.591 9.958 1.00 2.25 C ATOM 1417 NE ARG A 88 -7.589 -4.295 11.199 1.00 2.45 N ATOM 1418 CZ ARG A 88 -7.063 -4.180 12.423 1.00 3.30 C ATOM 1419 NH1 ARG A 88 -5.766 -3.882 12.579 1.00 4.65 N ATOM 1420 NH2 ARG A 88 -7.900 -4.354 13.449 1.00 3.94 N ATOM 0 H ARG A 88 -8.860 -2.473 6.735 1.00 1.05 H new ATOM 0 HA ARG A 88 -10.987 -3.813 8.321 1.00 1.14 H new ATOM 0 HB2 ARG A 88 -9.297 -4.880 9.569 1.00 1.64 H new ATOM 0 HB3 ARG A 88 -9.049 -5.248 7.874 1.00 1.64 H new ATOM 0 HG2 ARG A 88 -6.989 -4.279 7.828 1.00 2.02 H new ATOM 0 HG3 ARG A 88 -7.498 -2.901 8.785 1.00 2.02 H new ATOM 0 HD2 ARG A 88 -6.766 -5.671 9.835 1.00 2.25 H new ATOM 0 HD3 ARG A 88 -5.836 -4.199 10.037 1.00 2.25 H new ATOM 0 HE ARG A 88 -8.597 -4.166 11.116 1.00 2.45 H new ATOM 0 HH11 ARG A 88 -5.173 -3.741 11.761 1.00 4.65 H new ATOM 0 HH12 ARG A 88 -5.372 -3.796 13.516 1.00 4.65 H new ATOM 0 HH21 ARG A 88 -8.883 -4.563 13.275 1.00 3.94 H new ATOM 0 HH22 ARG A 88 -7.556 -4.278 14.406 1.00 3.94 H new ATOM 1434 N LYS A 89 -9.302 -1.120 9.096 1.00 1.50 N ATOM 1435 CA LYS A 89 -9.476 0.120 9.851 1.00 1.70 C ATOM 1436 C LYS A 89 -10.882 0.666 9.608 1.00 1.88 C ATOM 1437 O LYS A 89 -11.643 0.917 10.544 1.00 2.40 O ATOM 1438 CB LYS A 89 -8.416 1.150 9.425 1.00 1.76 C ATOM 1439 CG LYS A 89 -8.717 2.578 9.904 1.00 1.68 C ATOM 1440 CD LYS A 89 -7.550 3.489 9.505 1.00 1.98 C ATOM 1441 CE LYS A 89 -7.834 4.982 9.716 1.00 2.28 C ATOM 1442 NZ LYS A 89 -8.882 5.471 8.796 1.00 3.05 N ATOM 0 H LYS A 89 -8.483 -1.121 8.489 1.00 1.50 H new ATOM 0 HA LYS A 89 -9.351 -0.080 10.915 1.00 1.70 H new ATOM 0 HB2 LYS A 89 -7.446 0.842 9.815 1.00 1.76 H new ATOM 0 HB3 LYS A 89 -8.338 1.150 8.338 1.00 1.76 H new ATOM 0 HG2 LYS A 89 -9.645 2.937 9.460 1.00 1.68 H new ATOM 0 HG3 LYS A 89 -8.854 2.592 10.985 1.00 1.68 H new ATOM 0 HD2 LYS A 89 -6.669 3.210 10.083 1.00 1.98 H new ATOM 0 HD3 LYS A 89 -7.310 3.319 8.456 1.00 1.98 H new ATOM 0 HE2 LYS A 89 -8.146 5.152 10.747 1.00 2.28 H new ATOM 0 HE3 LYS A 89 -6.918 5.553 9.562 1.00 2.28 H new ATOM 0 HZ1 LYS A 89 -8.818 6.506 8.716 1.00 3.05 H new ATOM 0 HZ2 LYS A 89 -8.748 5.042 7.858 1.00 3.05 H new ATOM 0 HZ3 LYS A 89 -9.818 5.209 9.166 1.00 3.05 H new ATOM 1710 N LEU B 6 -15.901 -7.179 -1.264 1.00 1.80 N ATOM 1711 CA LEU B 6 -15.083 -6.103 -1.783 1.00 1.64 C ATOM 1712 C LEU B 6 -14.745 -6.296 -3.282 1.00 1.57 C ATOM 1713 O LEU B 6 -14.883 -7.404 -3.797 1.00 1.88 O ATOM 1714 CB LEU B 6 -13.875 -6.034 -0.836 1.00 1.86 C ATOM 1715 CG LEU B 6 -13.277 -7.345 -0.300 1.00 1.81 C ATOM 1716 CD1 LEU B 6 -12.911 -8.362 -1.389 1.00 2.69 C ATOM 1717 CD2 LEU B 6 -11.995 -6.971 0.435 1.00 3.37 C ATOM 0 HA LEU B 6 -15.596 -5.142 -1.791 1.00 1.64 H new ATOM 0 HB2 LEU B 6 -13.080 -5.496 -1.354 1.00 1.86 H new ATOM 0 HB3 LEU B 6 -14.163 -5.428 0.023 1.00 1.86 H new ATOM 0 HG LEU B 6 -14.030 -7.820 0.329 1.00 1.81 H new ATOM 0 HD11 LEU B 6 -12.496 -9.257 -0.926 1.00 2.69 H new ATOM 0 HD12 LEU B 6 -13.804 -8.627 -1.955 1.00 2.69 H new ATOM 0 HD13 LEU B 6 -12.172 -7.925 -2.061 1.00 2.69 H new ATOM 0 HD21 LEU B 6 -11.530 -7.871 0.836 1.00 3.37 H new ATOM 0 HD22 LEU B 6 -11.307 -6.485 -0.257 1.00 3.37 H new ATOM 0 HD23 LEU B 6 -12.230 -6.289 1.252 1.00 3.37 H new ATOM 1729 N THR B 7 -14.392 -5.209 -3.994 1.00 1.44 N ATOM 1730 CA THR B 7 -14.172 -5.151 -5.447 1.00 1.37 C ATOM 1731 C THR B 7 -12.795 -5.680 -5.868 1.00 1.35 C ATOM 1732 O THR B 7 -12.165 -6.418 -5.121 1.00 2.05 O ATOM 1733 CB THR B 7 -14.453 -3.732 -6.001 1.00 1.31 C ATOM 1734 OG1 THR B 7 -14.630 -3.807 -7.405 1.00 1.37 O ATOM 1735 CG2 THR B 7 -13.387 -2.643 -5.764 1.00 1.19 C ATOM 0 H THR B 7 -14.246 -4.304 -3.547 1.00 1.44 H new ATOM 0 HA THR B 7 -14.895 -5.829 -5.901 1.00 1.37 H new ATOM 0 HB THR B 7 -15.333 -3.423 -5.437 1.00 1.31 H new ATOM 0 HG1 THR B 7 -14.810 -2.912 -7.760 1.00 1.37 H new ATOM 0 HG21 THR B 7 -13.721 -1.705 -6.207 1.00 1.19 H new ATOM 0 HG22 THR B 7 -13.239 -2.506 -4.693 1.00 1.19 H new ATOM 0 HG23 THR B 7 -12.447 -2.947 -6.225 1.00 1.19 H new ATOM 1743 N GLU B 8 -12.321 -5.311 -7.066 1.00 1.01 N ATOM 1744 CA GLU B 8 -11.103 -5.876 -7.625 1.00 0.97 C ATOM 1745 C GLU B 8 -9.851 -5.307 -6.951 1.00 0.80 C ATOM 1746 O GLU B 8 -9.156 -6.020 -6.240 1.00 0.85 O ATOM 1747 CB GLU B 8 -11.061 -5.750 -9.146 1.00 1.10 C ATOM 1748 CG GLU B 8 -9.974 -6.698 -9.667 1.00 1.48 C ATOM 1749 CD GLU B 8 -9.863 -6.590 -11.183 1.00 1.79 C ATOM 1750 OE1 GLU B 8 -9.653 -5.447 -11.645 1.00 1.71 O ATOM 1751 OE2 GLU B 8 -10.036 -7.630 -11.850 1.00 2.68 O ATOM 0 H GLU B 8 -12.772 -4.618 -7.664 1.00 1.01 H new ATOM 0 HA GLU B 8 -11.113 -6.944 -7.407 1.00 0.97 H new ATOM 0 HB2 GLU B 8 -12.029 -6.006 -9.577 1.00 1.10 H new ATOM 0 HB3 GLU B 8 -10.843 -4.723 -9.438 1.00 1.10 H new ATOM 0 HG2 GLU B 8 -9.017 -6.453 -9.207 1.00 1.48 H new ATOM 0 HG3 GLU B 8 -10.210 -7.724 -9.385 1.00 1.48 H new ATOM 1758 N LEU B 9 -9.555 -4.013 -7.124 1.00 0.71 N ATOM 1759 CA LEU B 9 -8.423 -3.393 -6.427 1.00 0.70 C ATOM 1760 C LEU B 9 -8.464 -3.737 -4.929 1.00 0.72 C ATOM 1761 O LEU B 9 -7.453 -4.098 -4.326 1.00 0.74 O ATOM 1762 CB LEU B 9 -8.426 -1.878 -6.696 1.00 0.74 C ATOM 1763 CG LEU B 9 -7.666 -1.585 -8.003 1.00 0.81 C ATOM 1764 CD1 LEU B 9 -8.171 -0.332 -8.721 1.00 1.00 C ATOM 1765 CD2 LEU B 9 -6.183 -1.369 -7.685 1.00 1.04 C ATOM 0 H LEU B 9 -10.076 -3.382 -7.733 1.00 0.71 H new ATOM 0 HA LEU B 9 -7.482 -3.790 -6.808 1.00 0.70 H new ATOM 0 HB2 LEU B 9 -9.451 -1.513 -6.769 1.00 0.74 H new ATOM 0 HB3 LEU B 9 -7.958 -1.350 -5.865 1.00 0.74 H new ATOM 0 HG LEU B 9 -7.827 -2.442 -8.657 1.00 0.81 H new ATOM 0 HD11 LEU B 9 -7.596 -0.179 -9.634 1.00 1.00 H new ATOM 0 HD12 LEU B 9 -9.224 -0.456 -8.972 1.00 1.00 H new ATOM 0 HD13 LEU B 9 -8.053 0.533 -8.069 1.00 1.00 H new ATOM 0 HD21 LEU B 9 -5.640 -1.161 -8.607 1.00 1.04 H new ATOM 0 HD22 LEU B 9 -6.076 -0.526 -7.003 1.00 1.04 H new ATOM 0 HD23 LEU B 9 -5.776 -2.266 -7.219 1.00 1.04 H new ATOM 1777 N GLU B 10 -9.673 -3.691 -4.369 1.00 0.74 N ATOM 1778 CA GLU B 10 -10.048 -4.256 -3.087 1.00 0.77 C ATOM 1779 C GLU B 10 -9.508 -5.684 -2.856 1.00 0.93 C ATOM 1780 O GLU B 10 -8.761 -5.906 -1.906 1.00 1.36 O ATOM 1781 CB GLU B 10 -11.577 -4.194 -2.978 1.00 0.83 C ATOM 1782 CG GLU B 10 -11.992 -3.318 -1.788 1.00 1.80 C ATOM 1783 CD GLU B 10 -13.490 -3.036 -1.623 1.00 2.29 C ATOM 1784 OE1 GLU B 10 -14.184 -2.894 -2.652 1.00 2.56 O ATOM 1785 OE2 GLU B 10 -13.931 -2.932 -0.461 1.00 3.52 O ATOM 0 H GLU B 10 -10.457 -3.230 -4.831 1.00 0.74 H new ATOM 0 HA GLU B 10 -9.585 -3.666 -2.296 1.00 0.77 H new ATOM 0 HB2 GLU B 10 -11.998 -3.791 -3.899 1.00 0.83 H new ATOM 0 HB3 GLU B 10 -11.981 -5.199 -2.856 1.00 0.83 H new ATOM 0 HG2 GLU B 10 -11.634 -3.794 -0.875 1.00 1.80 H new ATOM 0 HG3 GLU B 10 -11.474 -2.363 -1.873 1.00 1.80 H new ATOM 1792 N GLU B 11 -9.879 -6.674 -3.671 1.00 0.81 N ATOM 1793 CA GLU B 11 -9.429 -8.046 -3.465 1.00 0.82 C ATOM 1794 C GLU B 11 -7.901 -8.129 -3.595 1.00 0.80 C ATOM 1795 O GLU B 11 -7.242 -8.847 -2.841 1.00 0.91 O ATOM 1796 CB GLU B 11 -10.229 -9.051 -4.315 1.00 1.13 C ATOM 1797 CG GLU B 11 -9.953 -9.167 -5.807 1.00 1.41 C ATOM 1798 CD GLU B 11 -8.611 -9.811 -6.144 1.00 2.88 C ATOM 1799 OE1 GLU B 11 -8.474 -11.013 -5.833 1.00 3.39 O ATOM 1800 OE2 GLU B 11 -7.744 -9.089 -6.686 1.00 4.29 O ATOM 0 H GLU B 11 -10.490 -6.548 -4.478 1.00 0.81 H new ATOM 0 HA GLU B 11 -9.649 -8.354 -2.443 1.00 0.82 H new ATOM 0 HB2 GLU B 11 -10.078 -10.038 -3.879 1.00 1.13 H new ATOM 0 HB3 GLU B 11 -11.285 -8.808 -4.197 1.00 1.13 H new ATOM 0 HG2 GLU B 11 -10.750 -9.750 -6.269 1.00 1.41 H new ATOM 0 HG3 GLU B 11 -9.988 -8.172 -6.251 1.00 1.41 H new ATOM 1807 N SER B 12 -7.329 -7.322 -4.493 1.00 0.75 N ATOM 1808 CA SER B 12 -5.895 -7.264 -4.710 1.00 0.80 C ATOM 1809 C SER B 12 -5.165 -6.753 -3.463 1.00 0.82 C ATOM 1810 O SER B 12 -4.089 -7.253 -3.139 1.00 0.97 O ATOM 1811 CB SER B 12 -5.580 -6.420 -5.947 1.00 0.89 C ATOM 1812 OG SER B 12 -6.393 -6.805 -7.040 1.00 2.30 O ATOM 0 H SER B 12 -7.859 -6.688 -5.091 1.00 0.75 H new ATOM 0 HA SER B 12 -5.529 -8.274 -4.895 1.00 0.80 H new ATOM 0 HB2 SER B 12 -5.740 -5.365 -5.723 1.00 0.89 H new ATOM 0 HB3 SER B 12 -4.529 -6.534 -6.212 1.00 0.89 H new ATOM 0 HG SER B 12 -6.630 -7.752 -6.954 1.00 2.30 H new ATOM 1818 N ILE B 13 -5.730 -5.778 -2.738 1.00 0.79 N ATOM 1819 CA ILE B 13 -5.206 -5.459 -1.411 1.00 0.94 C ATOM 1820 C ILE B 13 -5.540 -6.562 -0.404 1.00 0.98 C ATOM 1821 O ILE B 13 -4.703 -6.878 0.438 1.00 1.12 O ATOM 1822 CB ILE B 13 -5.517 -4.026 -0.929 1.00 1.02 C ATOM 1823 CG1 ILE B 13 -6.993 -3.597 -0.932 1.00 0.95 C ATOM 1824 CG2 ILE B 13 -4.726 -3.048 -1.813 1.00 1.03 C ATOM 1825 CD1 ILE B 13 -7.826 -3.985 0.293 1.00 1.07 C ATOM 0 H ILE B 13 -6.525 -5.214 -3.039 1.00 0.79 H new ATOM 0 HA ILE B 13 -4.120 -5.444 -1.498 1.00 0.94 H new ATOM 0 HB ILE B 13 -5.228 -4.010 0.122 1.00 1.02 H new ATOM 0 HG12 ILE B 13 -7.032 -2.513 -1.040 1.00 0.95 H new ATOM 0 HG13 ILE B 13 -7.469 -4.023 -1.815 1.00 0.95 H new ATOM 0 HG21 ILE B 13 -4.927 -2.025 -1.494 1.00 1.03 H new ATOM 0 HG22 ILE B 13 -3.660 -3.254 -1.720 1.00 1.03 H new ATOM 0 HG23 ILE B 13 -5.030 -3.170 -2.853 1.00 1.03 H new ATOM 0 HD11 ILE B 13 -8.847 -3.625 0.168 1.00 1.07 H new ATOM 0 HD12 ILE B 13 -7.834 -5.070 0.399 1.00 1.07 H new ATOM 0 HD13 ILE B 13 -7.390 -3.537 1.186 1.00 1.07 H new ATOM 1837 N GLU B 14 -6.718 -7.186 -0.498 1.00 0.88 N ATOM 1838 CA GLU B 14 -7.097 -8.258 0.412 1.00 0.88 C ATOM 1839 C GLU B 14 -6.010 -9.338 0.433 1.00 0.89 C ATOM 1840 O GLU B 14 -5.443 -9.580 1.489 1.00 0.88 O ATOM 1841 CB GLU B 14 -8.493 -8.821 0.106 1.00 0.94 C ATOM 1842 CG GLU B 14 -9.170 -9.393 1.363 1.00 1.04 C ATOM 1843 CD GLU B 14 -8.339 -10.458 2.071 1.00 1.68 C ATOM 1844 OE1 GLU B 14 -8.018 -11.463 1.403 1.00 2.65 O ATOM 1845 OE2 GLU B 14 -8.016 -10.232 3.256 1.00 2.25 O ATOM 0 H GLU B 14 -7.424 -6.962 -1.199 1.00 0.88 H new ATOM 0 HA GLU B 14 -7.172 -7.842 1.417 1.00 0.88 H new ATOM 0 HB2 GLU B 14 -9.117 -8.033 -0.316 1.00 0.94 H new ATOM 0 HB3 GLU B 14 -8.412 -9.602 -0.650 1.00 0.94 H new ATOM 0 HG2 GLU B 14 -9.372 -8.579 2.059 1.00 1.04 H new ATOM 0 HG3 GLU B 14 -10.133 -9.821 1.084 1.00 1.04 H new ATOM 1852 N THR B 15 -5.658 -9.934 -0.711 1.00 0.92 N ATOM 1853 CA THR B 15 -4.678 -11.030 -0.759 1.00 0.95 C ATOM 1854 C THR B 15 -3.402 -10.725 0.057 1.00 0.96 C ATOM 1855 O THR B 15 -2.932 -11.551 0.847 1.00 1.00 O ATOM 1856 CB THR B 15 -4.393 -11.477 -2.207 1.00 0.99 C ATOM 1857 OG1 THR B 15 -3.383 -12.465 -2.232 1.00 1.36 O ATOM 1858 CG2 THR B 15 -3.950 -10.347 -3.132 1.00 0.81 C ATOM 0 H THR B 15 -6.038 -9.676 -1.622 1.00 0.92 H new ATOM 0 HA THR B 15 -5.131 -11.888 -0.262 1.00 0.95 H new ATOM 0 HB THR B 15 -5.345 -11.861 -2.573 1.00 0.99 H new ATOM 0 HG1 THR B 15 -3.216 -12.738 -3.158 1.00 1.36 H new ATOM 0 HG21 THR B 15 -3.770 -10.744 -4.131 1.00 0.81 H new ATOM 0 HG22 THR B 15 -4.731 -9.588 -3.179 1.00 0.81 H new ATOM 0 HG23 THR B 15 -3.033 -9.901 -2.748 1.00 0.81 H new ATOM 1866 N VAL B 16 -2.858 -9.512 -0.069 1.00 0.96 N ATOM 1867 CA VAL B 16 -1.686 -9.114 0.704 1.00 0.97 C ATOM 1868 C VAL B 16 -2.060 -8.839 2.165 1.00 0.90 C ATOM 1869 O VAL B 16 -1.283 -9.164 3.061 1.00 0.88 O ATOM 1870 CB VAL B 16 -0.895 -7.962 0.054 1.00 1.04 C ATOM 1871 CG1 VAL B 16 -0.274 -8.408 -1.276 1.00 1.23 C ATOM 1872 CG2 VAL B 16 -1.723 -6.699 -0.191 1.00 1.09 C ATOM 0 H VAL B 16 -3.212 -8.792 -0.699 1.00 0.96 H new ATOM 0 HA VAL B 16 -0.997 -9.958 0.702 1.00 0.97 H new ATOM 0 HB VAL B 16 -0.119 -7.708 0.777 1.00 1.04 H new ATOM 0 HG11 VAL B 16 0.279 -7.578 -1.716 1.00 1.23 H new ATOM 0 HG12 VAL B 16 0.404 -9.243 -1.099 1.00 1.23 H new ATOM 0 HG13 VAL B 16 -1.063 -8.720 -1.960 1.00 1.23 H new ATOM 0 HG21 VAL B 16 -1.095 -5.936 -0.650 1.00 1.09 H new ATOM 0 HG22 VAL B 16 -2.555 -6.933 -0.855 1.00 1.09 H new ATOM 0 HG23 VAL B 16 -2.110 -6.328 0.758 1.00 1.09 H new ATOM 1882 N VAL B 17 -3.239 -8.272 2.432 1.00 0.89 N ATOM 1883 CA VAL B 17 -3.724 -8.054 3.788 1.00 0.83 C ATOM 1884 C VAL B 17 -3.882 -9.387 4.529 1.00 0.81 C ATOM 1885 O VAL B 17 -3.393 -9.503 5.648 1.00 0.82 O ATOM 1886 CB VAL B 17 -4.999 -7.197 3.773 1.00 0.85 C ATOM 1887 CG1 VAL B 17 -5.672 -7.130 5.150 1.00 0.86 C ATOM 1888 CG2 VAL B 17 -4.652 -5.772 3.322 1.00 0.99 C ATOM 0 H VAL B 17 -3.883 -7.952 1.708 1.00 0.89 H new ATOM 0 HA VAL B 17 -2.984 -7.485 4.352 1.00 0.83 H new ATOM 0 HB VAL B 17 -5.697 -7.666 3.079 1.00 0.85 H new ATOM 0 HG11 VAL B 17 -6.568 -6.513 5.087 1.00 0.86 H new ATOM 0 HG12 VAL B 17 -5.945 -8.135 5.471 1.00 0.86 H new ATOM 0 HG13 VAL B 17 -4.981 -6.694 5.872 1.00 0.86 H new ATOM 0 HG21 VAL B 17 -5.556 -5.163 3.311 1.00 0.99 H new ATOM 0 HG22 VAL B 17 -3.930 -5.337 4.013 1.00 0.99 H new ATOM 0 HG23 VAL B 17 -4.223 -5.802 2.321 1.00 0.99 H new ATOM 1898 N THR B 18 -4.518 -10.407 3.948 1.00 0.84 N ATOM 1899 CA THR B 18 -4.622 -11.715 4.585 1.00 0.90 C ATOM 1900 C THR B 18 -3.227 -12.302 4.840 1.00 0.92 C ATOM 1901 O THR B 18 -2.962 -12.789 5.940 1.00 0.97 O ATOM 1902 CB THR B 18 -5.580 -12.659 3.835 1.00 0.99 C ATOM 1903 OG1 THR B 18 -5.670 -13.903 4.506 1.00 1.04 O ATOM 1904 CG2 THR B 18 -5.195 -12.908 2.378 1.00 1.15 C ATOM 0 H THR B 18 -4.969 -10.348 3.035 1.00 0.84 H new ATOM 0 HA THR B 18 -5.085 -11.587 5.564 1.00 0.90 H new ATOM 0 HB THR B 18 -6.544 -12.150 3.827 1.00 0.99 H new ATOM 0 HG1 THR B 18 -6.283 -14.493 4.020 1.00 1.04 H new ATOM 0 HG21 THR B 18 -5.919 -13.582 1.921 1.00 1.15 H new ATOM 0 HG22 THR B 18 -5.188 -11.962 1.837 1.00 1.15 H new ATOM 0 HG23 THR B 18 -4.203 -13.358 2.336 1.00 1.15 H new ATOM 1912 N THR B 19 -2.313 -12.231 3.862 1.00 0.95 N ATOM 1913 CA THR B 19 -0.936 -12.680 4.055 1.00 1.02 C ATOM 1914 C THR B 19 -0.299 -11.961 5.255 1.00 0.97 C ATOM 1915 O THR B 19 0.258 -12.588 6.158 1.00 1.02 O ATOM 1916 CB THR B 19 -0.154 -12.469 2.750 1.00 1.10 C ATOM 1917 OG1 THR B 19 -0.824 -13.137 1.701 1.00 1.17 O ATOM 1918 CG2 THR B 19 1.255 -13.054 2.830 1.00 1.18 C ATOM 0 H THR B 19 -2.508 -11.866 2.930 1.00 0.95 H new ATOM 0 HA THR B 19 -0.914 -13.744 4.290 1.00 1.02 H new ATOM 0 HB THR B 19 -0.088 -11.395 2.578 1.00 1.10 H new ATOM 0 HG1 THR B 19 -1.544 -12.568 1.358 1.00 1.17 H new ATOM 0 HG21 THR B 19 1.774 -12.883 1.887 1.00 1.18 H new ATOM 0 HG22 THR B 19 1.804 -12.571 3.639 1.00 1.18 H new ATOM 0 HG23 THR B 19 1.194 -14.125 3.022 1.00 1.18 H new ATOM 1926 N PHE B 20 -0.416 -10.632 5.280 1.00 0.90 N ATOM 1927 CA PHE B 20 -0.047 -9.815 6.427 1.00 0.89 C ATOM 1928 C PHE B 20 -0.673 -10.370 7.714 1.00 0.89 C ATOM 1929 O PHE B 20 0.072 -10.675 8.632 1.00 0.92 O ATOM 1930 CB PHE B 20 -0.375 -8.337 6.164 1.00 0.91 C ATOM 1931 CG PHE B 20 -0.471 -7.460 7.398 1.00 1.63 C ATOM 1932 CD1 PHE B 20 0.691 -6.968 8.018 1.00 2.78 C ATOM 1933 CD2 PHE B 20 -1.733 -7.122 7.922 1.00 2.86 C ATOM 1934 CE1 PHE B 20 0.583 -6.091 9.111 1.00 3.68 C ATOM 1935 CE2 PHE B 20 -1.832 -6.351 9.094 1.00 3.74 C ATOM 1936 CZ PHE B 20 -0.670 -5.828 9.685 1.00 3.79 C ATOM 0 H PHE B 20 -0.774 -10.091 4.493 1.00 0.90 H new ATOM 0 HA PHE B 20 1.032 -9.863 6.576 1.00 0.89 H new ATOM 0 HB2 PHE B 20 0.389 -7.925 5.505 1.00 0.91 H new ATOM 0 HB3 PHE B 20 -1.322 -8.283 5.627 1.00 0.91 H new ATOM 0 HD1 PHE B 20 1.664 -7.263 7.655 1.00 2.78 H new ATOM 0 HD2 PHE B 20 -2.630 -7.456 7.422 1.00 2.86 H new ATOM 0 HE1 PHE B 20 1.468 -5.618 9.511 1.00 3.68 H new ATOM 0 HE2 PHE B 20 -2.798 -6.162 9.538 1.00 3.74 H new ATOM 0 HZ PHE B 20 -0.741 -5.225 10.578 1.00 3.79 H new ATOM 1946 N PHE B 21 -1.997 -10.549 7.794 1.00 0.90 N ATOM 1947 CA PHE B 21 -2.669 -11.105 8.973 1.00 0.97 C ATOM 1948 C PHE B 21 -1.995 -12.399 9.434 1.00 0.96 C ATOM 1949 O PHE B 21 -1.603 -12.517 10.596 1.00 0.95 O ATOM 1950 CB PHE B 21 -4.159 -11.397 8.699 1.00 1.19 C ATOM 1951 CG PHE B 21 -5.161 -10.328 9.101 1.00 1.37 C ATOM 1952 CD1 PHE B 21 -5.116 -9.064 8.491 1.00 2.94 C ATOM 1953 CD2 PHE B 21 -6.266 -10.667 9.907 1.00 2.21 C ATOM 1954 CE1 PHE B 21 -6.165 -8.148 8.673 1.00 4.21 C ATOM 1955 CE2 PHE B 21 -7.308 -9.744 10.108 1.00 3.05 C ATOM 1956 CZ PHE B 21 -7.260 -8.485 9.487 1.00 3.91 C ATOM 0 H PHE B 21 -2.636 -10.310 7.036 1.00 0.90 H new ATOM 0 HA PHE B 21 -2.592 -10.350 9.756 1.00 0.97 H new ATOM 0 HB2 PHE B 21 -4.276 -11.585 7.632 1.00 1.19 H new ATOM 0 HB3 PHE B 21 -4.423 -12.319 9.216 1.00 1.19 H new ATOM 0 HD1 PHE B 21 -4.269 -8.794 7.878 1.00 2.94 H new ATOM 0 HD2 PHE B 21 -6.313 -11.640 10.373 1.00 2.21 H new ATOM 0 HE1 PHE B 21 -6.130 -7.184 8.187 1.00 4.21 H new ATOM 0 HE2 PHE B 21 -8.145 -10.003 10.740 1.00 3.05 H new ATOM 0 HZ PHE B 21 -8.063 -7.778 9.635 1.00 3.91 H new ATOM 1966 N THR B 22 -1.915 -13.397 8.548 1.00 1.05 N ATOM 1967 CA THR B 22 -1.446 -14.721 8.927 1.00 1.17 C ATOM 1968 C THR B 22 -0.017 -14.646 9.467 1.00 1.12 C ATOM 1969 O THR B 22 0.266 -15.208 10.522 1.00 1.23 O ATOM 1970 CB THR B 22 -1.590 -15.702 7.755 1.00 1.32 C ATOM 1971 OG1 THR B 22 -0.999 -15.161 6.595 1.00 1.83 O ATOM 1972 CG2 THR B 22 -3.067 -15.987 7.464 1.00 2.04 C ATOM 0 H THR B 22 -2.171 -13.307 7.565 1.00 1.05 H new ATOM 0 HA THR B 22 -2.069 -15.106 9.734 1.00 1.17 H new ATOM 0 HB THR B 22 -1.090 -16.630 8.032 1.00 1.32 H new ATOM 0 HG1 THR B 22 -0.666 -14.260 6.788 1.00 1.83 H new ATOM 0 HG21 THR B 22 -3.146 -16.684 6.630 1.00 2.04 H new ATOM 0 HG22 THR B 22 -3.534 -16.423 8.347 1.00 2.04 H new ATOM 0 HG23 THR B 22 -3.573 -15.056 7.208 1.00 2.04 H new ATOM 1980 N PHE B 23 0.868 -13.918 8.785 1.00 1.05 N ATOM 1981 CA PHE B 23 2.241 -13.747 9.249 1.00 1.04 C ATOM 1982 C PHE B 23 2.270 -12.946 10.553 1.00 0.90 C ATOM 1983 O PHE B 23 2.881 -13.345 11.535 1.00 0.98 O ATOM 1984 CB PHE B 23 3.091 -13.086 8.154 1.00 1.16 C ATOM 1985 CG PHE B 23 3.597 -14.055 7.099 1.00 1.44 C ATOM 1986 CD1 PHE B 23 2.692 -14.848 6.366 1.00 2.86 C ATOM 1987 CD2 PHE B 23 4.982 -14.274 6.957 1.00 1.93 C ATOM 1988 CE1 PHE B 23 3.160 -15.909 5.575 1.00 3.54 C ATOM 1989 CE2 PHE B 23 5.451 -15.296 6.115 1.00 2.50 C ATOM 1990 CZ PHE B 23 4.540 -16.126 5.439 1.00 3.00 C ATOM 0 H PHE B 23 0.657 -13.438 7.910 1.00 1.05 H new ATOM 0 HA PHE B 23 2.672 -14.726 9.459 1.00 1.04 H new ATOM 0 HB2 PHE B 23 2.500 -12.310 7.667 1.00 1.16 H new ATOM 0 HB3 PHE B 23 3.944 -12.592 8.619 1.00 1.16 H new ATOM 0 HD1 PHE B 23 1.634 -14.639 6.413 1.00 2.86 H new ATOM 0 HD2 PHE B 23 5.684 -13.655 7.496 1.00 1.93 H new ATOM 0 HE1 PHE B 23 2.459 -16.558 5.071 1.00 3.54 H new ATOM 0 HE2 PHE B 23 6.513 -15.444 5.987 1.00 2.50 H new ATOM 0 HZ PHE B 23 4.902 -16.930 4.815 1.00 3.00 H new ATOM 2000 N ALA B 24 1.577 -11.815 10.578 1.00 0.76 N ATOM 2001 CA ALA B 24 1.503 -10.883 11.690 1.00 0.72 C ATOM 2002 C ALA B 24 1.003 -11.587 12.937 1.00 0.79 C ATOM 2003 O ALA B 24 1.303 -11.157 14.050 1.00 0.82 O ATOM 2004 CB ALA B 24 0.572 -9.714 11.352 1.00 0.77 C ATOM 0 H ALA B 24 1.022 -11.509 9.779 1.00 0.76 H new ATOM 0 HA ALA B 24 2.505 -10.496 11.875 1.00 0.72 H new ATOM 0 HB1 ALA B 24 0.529 -9.027 12.197 1.00 0.77 H new ATOM 0 HB2 ALA B 24 0.951 -9.189 10.476 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -0.428 -10.094 11.143 1.00 0.77 H new ATOM 2010 N ARG B 25 0.170 -12.615 12.790 1.00 0.87 N ATOM 2011 CA ARG B 25 -0.331 -13.354 13.931 1.00 1.07 C ATOM 2012 C ARG B 25 0.811 -13.955 14.754 1.00 1.14 C ATOM 2013 O ARG B 25 0.598 -14.178 15.943 1.00 1.36 O ATOM 2014 CB ARG B 25 -1.356 -14.395 13.453 1.00 1.19 C ATOM 2015 CG ARG B 25 -1.881 -15.305 14.572 1.00 2.76 C ATOM 2016 CD ARG B 25 -2.890 -16.315 14.018 1.00 3.18 C ATOM 2017 NE ARG B 25 -3.321 -17.253 15.069 1.00 4.60 N ATOM 2018 CZ ARG B 25 -4.142 -18.299 14.880 1.00 5.61 C ATOM 2019 NH1 ARG B 25 -4.647 -18.538 13.665 1.00 5.49 N ATOM 2020 NH2 ARG B 25 -4.458 -19.097 15.907 1.00 7.16 N ATOM 0 H ARG B 25 -0.169 -12.950 11.888 1.00 0.87 H new ATOM 0 HA ARG B 25 -0.846 -12.675 14.611 1.00 1.07 H new ATOM 0 HB2 ARG B 25 -2.198 -13.878 12.993 1.00 1.19 H new ATOM 0 HB3 ARG B 25 -0.900 -15.012 12.679 1.00 1.19 H new ATOM 0 HG2 ARG B 25 -1.049 -15.833 15.039 1.00 2.76 H new ATOM 0 HG3 ARG B 25 -2.352 -14.701 15.348 1.00 2.76 H new ATOM 0 HD2 ARG B 25 -3.756 -15.788 13.617 1.00 3.18 H new ATOM 0 HD3 ARG B 25 -2.442 -16.868 13.192 1.00 3.18 H new ATOM 0 HE ARG B 25 -2.969 -17.096 16.013 1.00 4.60 H new ATOM 0 HH11 ARG B 25 -4.408 -17.927 12.884 1.00 5.49 H new ATOM 0 HH12 ARG B 25 -5.271 -19.332 13.519 1.00 5.49 H new ATOM 0 HH21 ARG B 25 -4.075 -18.911 16.834 1.00 7.16 H new ATOM 0 HH22 ARG B 25 -5.082 -19.891 15.763 1.00 7.16 H new ATOM 2034 N GLN B 26 1.981 -14.227 14.152 1.00 1.07 N ATOM 2035 CA GLN B 26 2.904 -15.212 14.695 1.00 1.18 C ATOM 2036 C GLN B 26 3.146 -15.140 16.210 1.00 1.33 C ATOM 2037 O GLN B 26 2.826 -16.101 16.906 1.00 1.46 O ATOM 2038 CB GLN B 26 4.255 -15.054 13.981 1.00 1.16 C ATOM 2039 CG GLN B 26 4.908 -16.367 13.603 1.00 1.36 C ATOM 2040 CD GLN B 26 4.510 -16.823 12.203 1.00 1.32 C ATOM 2041 OE1 GLN B 26 3.427 -17.364 12.006 1.00 1.62 O ATOM 2042 NE2 GLN B 26 5.378 -16.606 11.221 1.00 1.72 N ATOM 0 H GLN B 26 2.300 -13.776 13.294 1.00 1.07 H new ATOM 0 HA GLN B 26 2.433 -16.179 14.521 1.00 1.18 H new ATOM 0 HB2 GLN B 26 4.111 -14.459 13.079 1.00 1.16 H new ATOM 0 HB3 GLN B 26 4.933 -14.495 14.627 1.00 1.16 H new ATOM 0 HG2 GLN B 26 5.992 -16.261 13.655 1.00 1.36 H new ATOM 0 HG3 GLN B 26 4.628 -17.132 14.327 1.00 1.36 H new ATOM 0 HE21 GLN B 26 6.270 -16.153 11.420 1.00 1.72 H new ATOM 0 HE22 GLN B 26 5.152 -16.892 10.268 1.00 1.72 H new ATOM 2051 N GLU B 27 3.769 -14.061 16.706 1.00 1.35 N ATOM 2052 CA GLU B 27 4.235 -14.070 18.087 1.00 1.48 C ATOM 2053 C GLU B 27 3.167 -13.542 19.048 1.00 1.54 C ATOM 2054 O GLU B 27 2.470 -14.299 19.718 1.00 1.65 O ATOM 2055 CB GLU B 27 5.534 -13.246 18.157 1.00 1.60 C ATOM 2056 CG GLU B 27 6.694 -13.902 17.394 1.00 1.85 C ATOM 2057 CD GLU B 27 7.941 -13.026 17.432 1.00 2.25 C ATOM 2058 OE1 GLU B 27 7.863 -11.902 16.890 1.00 2.65 O ATOM 2059 OE2 GLU B 27 8.945 -13.476 18.022 1.00 3.48 O ATOM 0 H GLU B 27 3.954 -13.202 16.188 1.00 1.35 H new ATOM 0 HA GLU B 27 4.436 -15.093 18.404 1.00 1.48 H new ATOM 0 HB2 GLU B 27 5.351 -12.252 17.748 1.00 1.60 H new ATOM 0 HB3 GLU B 27 5.820 -13.114 19.201 1.00 1.60 H new ATOM 0 HG2 GLU B 27 6.916 -14.876 17.831 1.00 1.85 H new ATOM 0 HG3 GLU B 27 6.400 -14.077 16.359 1.00 1.85 H new ATOM 2066 N GLY B 28 2.986 -12.217 19.048 1.00 1.76 N ATOM 2067 CA GLY B 28 1.794 -11.500 19.465 1.00 1.98 C ATOM 2068 C GLY B 28 0.866 -11.263 18.282 1.00 1.53 C ATOM 2069 O GLY B 28 1.352 -11.208 17.153 1.00 1.47 O ATOM 0 H GLY B 28 3.721 -11.583 18.735 1.00 1.76 H new ATOM 0 HA2 GLY B 28 1.272 -12.069 20.234 1.00 1.98 H new ATOM 0 HA3 GLY B 28 2.075 -10.545 19.910 1.00 1.98 H new ATOM 2073 N ARG B 29 -0.389 -10.893 18.568 1.00 1.64 N ATOM 2074 CA ARG B 29 -1.135 -9.839 17.872 1.00 1.59 C ATOM 2075 C ARG B 29 -0.899 -9.706 16.357 1.00 1.28 C ATOM 2076 O ARG B 29 0.153 -9.219 15.912 1.00 1.02 O ATOM 2077 CB ARG B 29 -0.982 -8.492 18.600 1.00 1.83 C ATOM 2078 CG ARG B 29 -1.830 -8.430 19.884 1.00 2.17 C ATOM 2079 CD ARG B 29 -3.311 -8.138 19.584 1.00 3.28 C ATOM 2080 NE ARG B 29 -4.186 -8.502 20.714 1.00 4.20 N ATOM 2081 CZ ARG B 29 -4.507 -7.721 21.760 1.00 4.29 C ATOM 2082 NH1 ARG B 29 -3.944 -6.516 21.894 1.00 3.74 N ATOM 2083 NH2 ARG B 29 -5.388 -8.157 22.670 1.00 5.46 N ATOM 0 H ARG B 29 -0.929 -11.333 19.313 1.00 1.64 H new ATOM 0 HA ARG B 29 -2.172 -10.170 17.922 1.00 1.59 H new ATOM 0 HB2 ARG B 29 0.067 -8.332 18.850 1.00 1.83 H new ATOM 0 HB3 ARG B 29 -1.277 -7.683 17.931 1.00 1.83 H new ATOM 0 HG2 ARG B 29 -1.748 -9.377 20.418 1.00 2.17 H new ATOM 0 HG3 ARG B 29 -1.434 -7.657 20.543 1.00 2.17 H new ATOM 0 HD2 ARG B 29 -3.433 -7.079 19.358 1.00 3.28 H new ATOM 0 HD3 ARG B 29 -3.617 -8.691 18.696 1.00 3.28 H new ATOM 0 HE ARG B 29 -4.588 -9.440 20.701 1.00 4.20 H new ATOM 0 HH11 ARG B 29 -3.270 -6.188 21.202 1.00 3.74 H new ATOM 0 HH12 ARG B 29 -4.188 -5.924 22.688 1.00 3.74 H new ATOM 0 HH21 ARG B 29 -5.813 -9.079 22.568 1.00 5.46 H new ATOM 0 HH22 ARG B 29 -5.634 -7.567 23.465 1.00 5.46 H new ATOM 2097 N LYS B 30 -1.888 -10.158 15.577 1.00 1.46 N ATOM 2098 CA LYS B 30 -1.959 -10.081 14.120 1.00 1.45 C ATOM 2099 C LYS B 30 -2.075 -8.647 13.561 1.00 1.48 C ATOM 2100 O LYS B 30 -2.899 -8.383 12.690 1.00 1.98 O ATOM 2101 CB LYS B 30 -3.085 -11.017 13.623 1.00 1.82 C ATOM 2102 CG LYS B 30 -4.495 -10.549 14.040 1.00 2.16 C ATOM 2103 CD LYS B 30 -5.575 -11.576 13.681 1.00 2.56 C ATOM 2104 CE LYS B 30 -6.962 -10.959 13.939 1.00 3.19 C ATOM 2105 NZ LYS B 30 -8.070 -11.897 13.661 1.00 4.07 N ATOM 0 H LYS B 30 -2.709 -10.615 15.975 1.00 1.46 H new ATOM 0 HA LYS B 30 -1.004 -10.424 13.723 1.00 1.45 H new ATOM 0 HB2 LYS B 30 -3.039 -11.085 12.536 1.00 1.82 H new ATOM 0 HB3 LYS B 30 -2.913 -12.020 14.012 1.00 1.82 H new ATOM 0 HG2 LYS B 30 -4.512 -10.366 15.114 1.00 2.16 H new ATOM 0 HG3 LYS B 30 -4.721 -9.601 13.552 1.00 2.16 H new ATOM 0 HD2 LYS B 30 -5.482 -11.869 12.635 1.00 2.56 H new ATOM 0 HD3 LYS B 30 -5.448 -12.479 14.278 1.00 2.56 H new ATOM 0 HE2 LYS B 30 -7.021 -10.632 14.977 1.00 3.19 H new ATOM 0 HE3 LYS B 30 -7.080 -10.071 13.318 1.00 3.19 H new ATOM 0 HZ1 LYS B 30 -8.978 -11.428 13.852 1.00 4.07 H new ATOM 0 HZ2 LYS B 30 -8.035 -12.190 12.664 1.00 4.07 H new ATOM 0 HZ3 LYS B 30 -7.978 -12.734 14.271 1.00 4.07 H new ATOM 2119 N ASP B 31 -1.247 -7.722 14.052 1.00 1.43 N ATOM 2120 CA ASP B 31 -1.241 -6.314 13.661 1.00 1.57 C ATOM 2121 C ASP B 31 0.193 -5.799 13.759 1.00 1.41 C ATOM 2122 O ASP B 31 0.776 -5.340 12.781 1.00 1.78 O ATOM 2123 CB ASP B 31 -2.196 -5.529 14.577 1.00 1.73 C ATOM 2124 CG ASP B 31 -2.507 -4.127 14.065 1.00 3.14 C ATOM 2125 OD1 ASP B 31 -1.571 -3.433 13.602 1.00 4.43 O ATOM 2126 OD2 ASP B 31 -3.705 -3.769 14.154 1.00 3.74 O ATOM 0 H ASP B 31 -0.541 -7.941 14.755 1.00 1.43 H new ATOM 0 HA ASP B 31 -1.589 -6.186 12.636 1.00 1.57 H new ATOM 0 HB2 ASP B 31 -3.128 -6.085 14.681 1.00 1.73 H new ATOM 0 HB3 ASP B 31 -1.756 -5.456 15.572 1.00 1.73 H new ATOM 2131 N SER B 32 0.778 -5.950 14.951 1.00 1.13 N ATOM 2132 CA SER B 32 2.131 -5.558 15.286 1.00 1.19 C ATOM 2133 C SER B 32 3.114 -6.632 14.825 1.00 1.21 C ATOM 2134 O SER B 32 3.045 -7.766 15.312 1.00 1.33 O ATOM 2135 CB SER B 32 2.189 -5.383 16.808 1.00 1.27 C ATOM 2136 OG SER B 32 1.399 -6.377 17.447 1.00 1.73 O ATOM 0 H SER B 32 0.288 -6.371 15.741 1.00 1.13 H new ATOM 0 HA SER B 32 2.405 -4.627 14.789 1.00 1.19 H new ATOM 0 HB2 SER B 32 3.221 -5.453 17.150 1.00 1.27 H new ATOM 0 HB3 SER B 32 1.829 -4.391 17.081 1.00 1.27 H new ATOM 0 HG SER B 32 1.593 -7.253 17.052 1.00 1.73 H new ATOM 2142 N LEU B 33 4.018 -6.292 13.907 1.00 1.16 N ATOM 2143 CA LEU B 33 5.154 -7.126 13.530 1.00 1.14 C ATOM 2144 C LEU B 33 6.372 -6.665 14.321 1.00 1.11 C ATOM 2145 O LEU B 33 6.612 -5.475 14.478 1.00 1.25 O ATOM 2146 CB LEU B 33 5.403 -7.072 12.018 1.00 1.14 C ATOM 2147 CG LEU B 33 4.350 -7.838 11.210 1.00 1.22 C ATOM 2148 CD1 LEU B 33 2.987 -7.148 11.228 1.00 2.22 C ATOM 2149 CD2 LEU B 33 4.807 -8.011 9.759 1.00 2.09 C ATOM 0 H LEU B 33 3.979 -5.411 13.395 1.00 1.16 H new ATOM 0 HA LEU B 33 4.944 -8.169 13.769 1.00 1.14 H new ATOM 0 HB2 LEU B 33 5.415 -6.031 11.694 1.00 1.14 H new ATOM 0 HB3 LEU B 33 6.389 -7.484 11.803 1.00 1.14 H new ATOM 0 HG LEU B 33 4.241 -8.813 11.685 1.00 1.22 H new ATOM 0 HD11 LEU B 33 2.277 -7.730 10.641 1.00 2.22 H new ATOM 0 HD12 LEU B 33 2.632 -7.071 12.256 1.00 2.22 H new ATOM 0 HD13 LEU B 33 3.079 -6.150 10.800 1.00 2.22 H new ATOM 0 HD21 LEU B 33 4.047 -8.557 9.201 1.00 2.09 H new ATOM 0 HD22 LEU B 33 4.957 -7.031 9.305 1.00 2.09 H new ATOM 0 HD23 LEU B 33 5.744 -8.568 9.736 1.00 2.09 H new ATOM 2161 N SER B 34 7.129 -7.635 14.811 1.00 1.25 N ATOM 2162 CA SER B 34 8.344 -7.525 15.587 1.00 1.22 C ATOM 2163 C SER B 34 9.510 -7.288 14.615 1.00 1.14 C ATOM 2164 O SER B 34 9.300 -7.061 13.423 1.00 1.54 O ATOM 2165 CB SER B 34 8.474 -8.802 16.436 1.00 1.66 C ATOM 2166 OG SER B 34 7.195 -9.379 16.646 1.00 2.54 O ATOM 0 H SER B 34 6.879 -8.612 14.657 1.00 1.25 H new ATOM 0 HA SER B 34 8.341 -6.683 16.279 1.00 1.22 H new ATOM 0 HB2 SER B 34 9.126 -9.517 15.934 1.00 1.66 H new ATOM 0 HB3 SER B 34 8.937 -8.566 17.394 1.00 1.66 H new ATOM 0 HG SER B 34 7.275 -10.356 16.660 1.00 2.54 H new ATOM 2172 N VAL B 35 10.754 -7.328 15.101 1.00 1.11 N ATOM 2173 CA VAL B 35 11.906 -7.452 14.191 1.00 1.17 C ATOM 2174 C VAL B 35 12.312 -8.944 14.110 1.00 1.41 C ATOM 2175 O VAL B 35 13.479 -9.326 13.961 1.00 2.45 O ATOM 2176 CB VAL B 35 12.991 -6.527 14.779 1.00 1.58 C ATOM 2177 CG1 VAL B 35 13.515 -6.971 16.154 1.00 1.73 C ATOM 2178 CG2 VAL B 35 14.164 -6.277 13.835 1.00 2.51 C ATOM 0 H VAL B 35 10.991 -7.278 16.092 1.00 1.11 H new ATOM 0 HA VAL B 35 11.706 -7.148 13.163 1.00 1.17 H new ATOM 0 HB VAL B 35 12.463 -5.584 14.916 1.00 1.58 H new ATOM 0 HG11 VAL B 35 14.274 -6.269 16.498 1.00 1.73 H new ATOM 0 HG12 VAL B 35 12.691 -6.993 16.867 1.00 1.73 H new ATOM 0 HG13 VAL B 35 13.952 -7.966 16.073 1.00 1.73 H new ATOM 0 HG21 VAL B 35 14.886 -5.618 14.318 1.00 2.51 H new ATOM 0 HG22 VAL B 35 14.644 -7.225 13.592 1.00 2.51 H new ATOM 0 HG23 VAL B 35 13.801 -5.809 12.920 1.00 2.51 H new ATOM 2188 N ASN B 36 11.224 -9.710 14.008 1.00 1.17 N ATOM 2189 CA ASN B 36 10.821 -11.084 13.732 1.00 1.12 C ATOM 2190 C ASN B 36 9.334 -10.897 13.359 1.00 1.62 C ATOM 2191 O ASN B 36 8.833 -9.783 13.485 1.00 3.68 O ATOM 2192 CB ASN B 36 11.000 -11.978 14.967 1.00 1.67 C ATOM 2193 CG ASN B 36 12.107 -13.001 14.738 1.00 1.87 C ATOM 2194 OD1 ASN B 36 13.242 -12.804 15.159 1.00 2.78 O ATOM 2195 ND2 ASN B 36 11.804 -14.089 14.037 1.00 1.70 N ATOM 0 H ASN B 36 10.352 -9.207 14.170 1.00 1.17 H new ATOM 0 HA ASN B 36 11.407 -11.579 12.958 1.00 1.12 H new ATOM 0 HB2 ASN B 36 11.240 -11.364 15.835 1.00 1.67 H new ATOM 0 HB3 ASN B 36 10.064 -12.491 15.189 1.00 1.67 H new ATOM 0 HD21 ASN B 36 12.523 -14.784 13.838 1.00 1.70 H new ATOM 0 HD22 ASN B 36 10.852 -14.229 13.698 1.00 1.70 H new ATOM 2202 N GLU B 37 8.610 -11.883 12.853 1.00 1.00 N ATOM 2203 CA GLU B 37 7.444 -11.686 11.992 1.00 0.85 C ATOM 2204 C GLU B 37 7.836 -10.887 10.749 1.00 0.75 C ATOM 2205 O GLU B 37 7.795 -11.416 9.640 1.00 0.81 O ATOM 2206 CB GLU B 37 6.259 -11.020 12.706 1.00 0.97 C ATOM 2207 CG GLU B 37 5.509 -11.989 13.611 1.00 0.87 C ATOM 2208 CD GLU B 37 4.412 -11.269 14.368 1.00 0.93 C ATOM 2209 OE1 GLU B 37 3.902 -10.235 13.891 1.00 1.48 O ATOM 2210 OE2 GLU B 37 3.971 -11.655 15.474 1.00 1.60 O ATOM 0 H GLU B 37 8.817 -12.866 13.031 1.00 1.00 H new ATOM 0 HA GLU B 37 7.103 -12.680 11.701 1.00 0.85 H new ATOM 0 HB2 GLU B 37 6.621 -10.179 13.298 1.00 0.97 H new ATOM 0 HB3 GLU B 37 5.572 -10.614 11.963 1.00 0.97 H new ATOM 0 HG2 GLU B 37 5.079 -12.794 13.015 1.00 0.87 H new ATOM 0 HG3 GLU B 37 6.203 -12.449 14.315 1.00 0.87 H new ATOM 2217 N PHE B 38 8.236 -9.619 10.913 1.00 0.70 N ATOM 2218 CA PHE B 38 8.677 -8.825 9.782 1.00 0.67 C ATOM 2219 C PHE B 38 9.840 -9.540 9.107 1.00 0.68 C ATOM 2220 O PHE B 38 9.814 -9.779 7.902 1.00 0.73 O ATOM 2221 CB PHE B 38 9.045 -7.406 10.226 1.00 0.70 C ATOM 2222 CG PHE B 38 8.726 -6.351 9.191 1.00 0.73 C ATOM 2223 CD1 PHE B 38 9.288 -6.420 7.903 1.00 1.61 C ATOM 2224 CD2 PHE B 38 7.807 -5.332 9.495 1.00 2.02 C ATOM 2225 CE1 PHE B 38 8.996 -5.429 6.954 1.00 1.69 C ATOM 2226 CE2 PHE B 38 7.520 -4.335 8.550 1.00 2.20 C ATOM 2227 CZ PHE B 38 8.105 -4.393 7.276 1.00 1.27 C ATOM 0 H PHE B 38 8.260 -9.135 11.810 1.00 0.70 H new ATOM 0 HA PHE B 38 7.869 -8.721 9.058 1.00 0.67 H new ATOM 0 HB2 PHE B 38 8.513 -7.172 11.148 1.00 0.70 H new ATOM 0 HB3 PHE B 38 10.110 -7.370 10.455 1.00 0.70 H new ATOM 0 HD1 PHE B 38 9.945 -7.237 7.645 1.00 1.61 H new ATOM 0 HD2 PHE B 38 7.320 -5.316 10.459 1.00 2.02 H new ATOM 0 HE1 PHE B 38 9.456 -5.463 5.977 1.00 1.69 H new ATOM 0 HE2 PHE B 38 6.851 -3.526 8.803 1.00 2.20 H new ATOM 0 HZ PHE B 38 7.869 -3.638 6.541 1.00 1.27 H new ATOM 2237 N LYS B 39 10.844 -9.932 9.896 1.00 0.77 N ATOM 2238 CA LYS B 39 12.000 -10.622 9.358 1.00 0.94 C ATOM 2239 C LYS B 39 11.581 -11.896 8.622 1.00 0.97 C ATOM 2240 O LYS B 39 11.961 -12.097 7.473 1.00 0.96 O ATOM 2241 CB LYS B 39 13.051 -10.852 10.442 1.00 1.15 C ATOM 2242 CG LYS B 39 14.439 -11.043 9.811 1.00 1.33 C ATOM 2243 CD LYS B 39 15.502 -10.869 10.911 1.00 1.79 C ATOM 2244 CE LYS B 39 15.777 -9.372 11.147 1.00 2.89 C ATOM 2245 NZ LYS B 39 15.960 -8.993 12.564 1.00 4.40 N ATOM 0 H LYS B 39 10.872 -9.780 10.904 1.00 0.77 H new ATOM 0 HA LYS B 39 12.478 -9.989 8.610 1.00 0.94 H new ATOM 0 HB2 LYS B 39 13.069 -10.003 11.126 1.00 1.15 H new ATOM 0 HB3 LYS B 39 12.788 -11.731 11.031 1.00 1.15 H new ATOM 0 HG2 LYS B 39 14.518 -12.033 9.361 1.00 1.33 H new ATOM 0 HG3 LYS B 39 14.596 -10.317 9.014 1.00 1.33 H new ATOM 0 HD2 LYS B 39 15.160 -11.334 11.835 1.00 1.79 H new ATOM 0 HD3 LYS B 39 16.423 -11.375 10.621 1.00 1.79 H new ATOM 0 HE2 LYS B 39 16.671 -9.089 10.591 1.00 2.89 H new ATOM 0 HE3 LYS B 39 14.949 -8.795 10.735 1.00 2.89 H new ATOM 0 HZ1 LYS B 39 16.173 -7.977 12.627 1.00 4.40 H new ATOM 0 HZ2 LYS B 39 15.088 -9.197 13.093 1.00 4.40 H new ATOM 0 HZ3 LYS B 39 16.747 -9.538 12.970 1.00 4.40 H new ATOM 2259 N GLU B 40 10.739 -12.724 9.241 1.00 1.01 N ATOM 2260 CA GLU B 40 10.189 -13.893 8.570 1.00 1.00 C ATOM 2261 C GLU B 40 9.518 -13.507 7.251 1.00 0.98 C ATOM 2262 O GLU B 40 9.635 -14.234 6.271 1.00 0.96 O ATOM 2263 CB GLU B 40 9.190 -14.604 9.482 1.00 1.04 C ATOM 2264 CG GLU B 40 9.874 -15.160 10.739 1.00 1.20 C ATOM 2265 CD GLU B 40 8.946 -15.086 11.938 1.00 2.37 C ATOM 2266 OE1 GLU B 40 7.811 -15.597 11.817 1.00 3.14 O ATOM 2267 OE2 GLU B 40 9.378 -14.460 12.932 1.00 3.61 O ATOM 0 H GLU B 40 10.426 -12.604 10.204 1.00 1.01 H new ATOM 0 HA GLU B 40 11.011 -14.572 8.345 1.00 1.00 H new ATOM 0 HB2 GLU B 40 8.402 -13.909 9.772 1.00 1.04 H new ATOM 0 HB3 GLU B 40 8.712 -15.418 8.936 1.00 1.04 H new ATOM 0 HG2 GLU B 40 10.172 -16.194 10.568 1.00 1.20 H new ATOM 0 HG3 GLU B 40 10.784 -14.595 10.943 1.00 1.20 H new ATOM 2274 N LEU B 41 8.823 -12.369 7.204 1.00 1.03 N ATOM 2275 CA LEU B 41 8.101 -11.944 6.020 1.00 1.05 C ATOM 2276 C LEU B 41 9.106 -11.584 4.929 1.00 1.01 C ATOM 2277 O LEU B 41 8.965 -12.047 3.799 1.00 0.98 O ATOM 2278 CB LEU B 41 7.118 -10.817 6.389 1.00 1.24 C ATOM 2279 CG LEU B 41 6.136 -10.450 5.263 1.00 1.27 C ATOM 2280 CD1 LEU B 41 4.793 -10.012 5.862 1.00 2.42 C ATOM 2281 CD2 LEU B 41 6.682 -9.304 4.402 1.00 1.53 C ATOM 0 H LEU B 41 8.750 -11.722 7.989 1.00 1.03 H new ATOM 0 HA LEU B 41 7.485 -12.746 5.614 1.00 1.05 H new ATOM 0 HB2 LEU B 41 6.550 -11.118 7.269 1.00 1.24 H new ATOM 0 HB3 LEU B 41 7.686 -9.929 6.665 1.00 1.24 H new ATOM 0 HG LEU B 41 6.004 -11.334 4.639 1.00 1.27 H new ATOM 0 HD11 LEU B 41 4.103 -9.754 5.059 1.00 2.42 H new ATOM 0 HD12 LEU B 41 4.374 -10.828 6.452 1.00 2.42 H new ATOM 0 HD13 LEU B 41 4.946 -9.143 6.502 1.00 2.42 H new ATOM 0 HD21 LEU B 41 5.966 -9.067 3.615 1.00 1.53 H new ATOM 0 HD22 LEU B 41 6.840 -8.424 5.025 1.00 1.53 H new ATOM 0 HD23 LEU B 41 7.628 -9.605 3.953 1.00 1.53 H new ATOM 2293 N VAL B 42 10.145 -10.803 5.253 1.00 1.01 N ATOM 2294 CA VAL B 42 11.129 -10.421 4.245 1.00 0.99 C ATOM 2295 C VAL B 42 11.885 -11.650 3.756 1.00 0.94 C ATOM 2296 O VAL B 42 11.964 -11.899 2.557 1.00 0.99 O ATOM 2297 CB VAL B 42 12.077 -9.291 4.687 1.00 0.97 C ATOM 2298 CG1 VAL B 42 11.467 -7.919 4.366 1.00 0.79 C ATOM 2299 CG2 VAL B 42 12.580 -9.301 6.120 1.00 1.00 C ATOM 0 H VAL B 42 10.320 -10.432 6.187 1.00 1.01 H new ATOM 0 HA VAL B 42 10.572 -9.996 3.410 1.00 0.99 H new ATOM 0 HB VAL B 42 12.973 -9.492 4.099 1.00 0.97 H new ATOM 0 HG11 VAL B 42 12.151 -7.133 4.686 1.00 0.79 H new ATOM 0 HG12 VAL B 42 11.298 -7.838 3.292 1.00 0.79 H new ATOM 0 HG13 VAL B 42 10.519 -7.810 4.892 1.00 0.79 H new ATOM 0 HG21 VAL B 42 13.236 -8.446 6.281 1.00 1.00 H new ATOM 0 HG22 VAL B 42 11.733 -9.243 6.803 1.00 1.00 H new ATOM 0 HG23 VAL B 42 13.133 -10.222 6.305 1.00 1.00 H new ATOM 2309 N THR B 43 12.423 -12.425 4.693 1.00 0.89 N ATOM 2310 CA THR B 43 13.135 -13.653 4.413 1.00 0.87 C ATOM 2311 C THR B 43 12.292 -14.600 3.549 1.00 0.89 C ATOM 2312 O THR B 43 12.769 -15.097 2.531 1.00 0.91 O ATOM 2313 CB THR B 43 13.511 -14.261 5.770 1.00 0.88 C ATOM 2314 OG1 THR B 43 14.399 -13.382 6.434 1.00 0.88 O ATOM 2315 CG2 THR B 43 14.181 -15.632 5.651 1.00 0.94 C ATOM 0 H THR B 43 12.371 -12.206 5.688 1.00 0.89 H new ATOM 0 HA THR B 43 14.037 -13.466 3.830 1.00 0.87 H new ATOM 0 HB THR B 43 12.584 -14.399 6.327 1.00 0.88 H new ATOM 0 HG1 THR B 43 13.885 -12.726 6.949 1.00 0.88 H new ATOM 0 HG21 THR B 43 14.422 -16.007 6.646 1.00 0.94 H new ATOM 0 HG22 THR B 43 13.503 -16.327 5.156 1.00 0.94 H new ATOM 0 HG23 THR B 43 15.096 -15.540 5.067 1.00 0.94 H new ATOM 2323 N GLN B 44 11.065 -14.900 3.983 1.00 0.91 N ATOM 2324 CA GLN B 44 10.236 -15.922 3.365 1.00 0.92 C ATOM 2325 C GLN B 44 9.514 -15.403 2.116 1.00 1.02 C ATOM 2326 O GLN B 44 9.642 -15.983 1.042 1.00 1.03 O ATOM 2327 CB GLN B 44 9.253 -16.472 4.411 1.00 0.98 C ATOM 2328 CG GLN B 44 8.625 -17.796 3.961 1.00 1.06 C ATOM 2329 CD GLN B 44 7.502 -18.255 4.887 1.00 1.22 C ATOM 2330 OE1 GLN B 44 6.525 -18.841 4.436 1.00 1.68 O ATOM 2331 NE2 GLN B 44 7.608 -17.983 6.185 1.00 1.68 N ATOM 0 H GLN B 44 10.623 -14.436 4.776 1.00 0.91 H new ATOM 0 HA GLN B 44 10.877 -16.733 3.020 1.00 0.92 H new ATOM 0 HB2 GLN B 44 9.774 -16.620 5.357 1.00 0.98 H new ATOM 0 HB3 GLN B 44 8.466 -15.739 4.591 1.00 0.98 H new ATOM 0 HG2 GLN B 44 8.234 -17.684 2.950 1.00 1.06 H new ATOM 0 HG3 GLN B 44 9.396 -18.565 3.921 1.00 1.06 H new ATOM 0 HE21 GLN B 44 8.431 -17.494 6.538 1.00 1.68 H new ATOM 0 HE22 GLN B 44 6.867 -18.263 6.827 1.00 1.68 H new ATOM 2340 N GLN B 45 8.675 -14.375 2.279 1.00 1.15 N ATOM 2341 CA GLN B 45 7.628 -14.069 1.310 1.00 1.33 C ATOM 2342 C GLN B 45 8.122 -13.291 0.095 1.00 1.35 C ATOM 2343 O GLN B 45 7.679 -13.584 -1.013 1.00 1.54 O ATOM 2344 CB GLN B 45 6.466 -13.322 1.982 1.00 1.53 C ATOM 2345 CG GLN B 45 5.537 -14.270 2.752 1.00 2.17 C ATOM 2346 CD GLN B 45 4.575 -15.021 1.830 1.00 1.82 C ATOM 2347 OE1 GLN B 45 4.834 -15.210 0.648 1.00 2.51 O ATOM 2348 NE2 GLN B 45 3.433 -15.443 2.358 1.00 2.50 N ATOM 0 H GLN B 45 8.704 -13.741 3.077 1.00 1.15 H new ATOM 0 HA GLN B 45 7.279 -15.032 0.937 1.00 1.33 H new ATOM 0 HB2 GLN B 45 6.865 -12.572 2.665 1.00 1.53 H new ATOM 0 HB3 GLN B 45 5.892 -12.789 1.224 1.00 1.53 H new ATOM 0 HG2 GLN B 45 6.137 -14.989 3.309 1.00 2.17 H new ATOM 0 HG3 GLN B 45 4.964 -13.699 3.483 1.00 2.17 H new ATOM 0 HE21 GLN B 45 3.235 -15.276 3.345 1.00 2.50 H new ATOM 0 HE22 GLN B 45 2.753 -15.934 1.777 1.00 2.50 H new ATOM 2357 N LEU B 46 8.958 -12.265 0.312 1.00 1.20 N ATOM 2358 CA LEU B 46 9.248 -11.233 -0.690 1.00 1.15 C ATOM 2359 C LEU B 46 9.388 -11.802 -2.106 1.00 1.62 C ATOM 2360 O LEU B 46 8.585 -11.419 -2.948 1.00 2.39 O ATOM 2361 CB LEU B 46 10.403 -10.316 -0.255 1.00 0.96 C ATOM 2362 CG LEU B 46 9.940 -9.043 0.480 1.00 1.31 C ATOM 2363 CD1 LEU B 46 9.547 -7.946 -0.510 1.00 1.68 C ATOM 2364 CD2 LEU B 46 8.775 -9.256 1.455 1.00 1.94 C ATOM 0 H LEU B 46 9.454 -12.129 1.193 1.00 1.20 H new ATOM 0 HA LEU B 46 8.374 -10.585 -0.747 1.00 1.15 H new ATOM 0 HB2 LEU B 46 11.075 -10.876 0.395 1.00 0.96 H new ATOM 0 HB3 LEU B 46 10.978 -10.028 -1.135 1.00 0.96 H new ATOM 0 HG LEU B 46 10.806 -8.744 1.071 1.00 1.31 H new ATOM 0 HD11 LEU B 46 9.225 -7.060 0.037 1.00 1.68 H new ATOM 0 HD12 LEU B 46 10.405 -7.695 -1.134 1.00 1.68 H new ATOM 0 HD13 LEU B 46 8.731 -8.300 -1.140 1.00 1.68 H new ATOM 0 HD21 LEU B 46 8.517 -8.308 1.926 1.00 1.94 H new ATOM 0 HD22 LEU B 46 7.911 -9.638 0.912 1.00 1.94 H new ATOM 0 HD23 LEU B 46 9.068 -9.974 2.221 1.00 1.94 H new ATOM 2376 N PRO B 47 10.292 -12.760 -2.369 1.00 1.61 N ATOM 2377 CA PRO B 47 11.518 -13.028 -1.642 1.00 1.84 C ATOM 2378 C PRO B 47 12.650 -12.159 -2.208 1.00 1.67 C ATOM 2379 O PRO B 47 13.608 -11.861 -1.501 1.00 2.05 O ATOM 2380 CB PRO B 47 11.798 -14.508 -1.907 1.00 2.15 C ATOM 2381 CG PRO B 47 11.303 -14.702 -3.341 1.00 1.93 C ATOM 2382 CD PRO B 47 10.117 -13.740 -3.432 1.00 2.00 C ATOM 0 HA PRO B 47 11.441 -12.807 -0.577 1.00 1.84 H new ATOM 0 HB2 PRO B 47 12.858 -14.741 -1.811 1.00 2.15 H new ATOM 0 HB3 PRO B 47 11.266 -15.151 -1.206 1.00 2.15 H new ATOM 0 HG2 PRO B 47 12.076 -14.459 -4.070 1.00 1.93 H new ATOM 0 HG3 PRO B 47 11.001 -15.733 -3.527 1.00 1.93 H new ATOM 0 HD2 PRO B 47 10.087 -13.253 -4.407 1.00 2.00 H new ATOM 0 HD3 PRO B 47 9.175 -14.275 -3.314 1.00 2.00 H new ATOM 2390 N HIS B 48 12.561 -11.789 -3.494 1.00 1.46 N ATOM 2391 CA HIS B 48 13.652 -11.210 -4.261 1.00 1.48 C ATOM 2392 C HIS B 48 13.515 -9.690 -4.314 1.00 1.36 C ATOM 2393 O HIS B 48 14.502 -8.981 -4.130 1.00 2.08 O ATOM 2394 CB HIS B 48 13.639 -11.839 -5.664 1.00 1.44 C ATOM 2395 CG HIS B 48 14.826 -11.527 -6.545 1.00 1.73 C ATOM 2396 ND1 HIS B 48 14.898 -11.803 -7.891 1.00 2.26 N ATOM 2397 CD2 HIS B 48 16.055 -11.056 -6.156 1.00 2.66 C ATOM 2398 CE1 HIS B 48 16.140 -11.497 -8.304 1.00 2.53 C ATOM 2399 NE2 HIS B 48 16.883 -11.039 -7.284 1.00 2.73 N ATOM 0 H HIS B 48 11.702 -11.891 -4.035 1.00 1.46 H new ATOM 0 HA HIS B 48 14.610 -11.422 -3.787 1.00 1.48 H new ATOM 0 HB2 HIS B 48 13.569 -12.921 -5.554 1.00 1.44 H new ATOM 0 HB3 HIS B 48 12.735 -11.512 -6.178 1.00 1.44 H new ATOM 0 HD2 HIS B 48 16.333 -10.753 -5.158 1.00 2.66 H new ATOM 0 HE1 HIS B 48 16.493 -11.605 -9.319 1.00 2.53 H new ATOM 0 HE2 HIS B 48 17.857 -10.739 -7.323 1.00 2.73 H new ATOM 2407 N LEU B 49 12.291 -9.206 -4.563 1.00 0.97 N ATOM 2408 CA LEU B 49 11.919 -7.797 -4.680 1.00 0.85 C ATOM 2409 C LEU B 49 12.783 -6.835 -3.850 1.00 0.91 C ATOM 2410 O LEU B 49 13.376 -5.910 -4.403 1.00 1.07 O ATOM 2411 CB LEU B 49 10.441 -7.682 -4.295 1.00 0.76 C ATOM 2412 CG LEU B 49 9.720 -6.447 -4.836 1.00 0.61 C ATOM 2413 CD1 LEU B 49 9.587 -6.473 -6.361 1.00 0.70 C ATOM 2414 CD2 LEU B 49 8.307 -6.445 -4.255 1.00 0.65 C ATOM 0 H LEU B 49 11.491 -9.825 -4.695 1.00 0.97 H new ATOM 0 HA LEU B 49 12.094 -7.487 -5.710 1.00 0.85 H new ATOM 0 HB2 LEU B 49 9.920 -8.571 -4.649 1.00 0.76 H new ATOM 0 HB3 LEU B 49 10.365 -7.680 -3.208 1.00 0.76 H new ATOM 0 HG LEU B 49 10.298 -5.566 -4.556 1.00 0.61 H new ATOM 0 HD11 LEU B 49 9.068 -5.575 -6.696 1.00 0.70 H new ATOM 0 HD12 LEU B 49 10.579 -6.509 -6.812 1.00 0.70 H new ATOM 0 HD13 LEU B 49 9.019 -7.354 -6.662 1.00 0.70 H new ATOM 0 HD21 LEU B 49 7.764 -5.574 -4.622 1.00 0.65 H new ATOM 0 HD22 LEU B 49 7.787 -7.353 -4.561 1.00 0.65 H new ATOM 0 HD23 LEU B 49 8.361 -6.407 -3.167 1.00 0.65 H new ATOM 2426 N LEU B 50 12.845 -7.033 -2.528 1.00 0.92 N ATOM 2427 CA LEU B 50 13.703 -6.250 -1.648 1.00 1.00 C ATOM 2428 C LEU B 50 14.993 -7.018 -1.384 1.00 1.00 C ATOM 2429 O LEU B 50 14.976 -8.066 -0.743 1.00 1.57 O ATOM 2430 CB LEU B 50 13.003 -5.925 -0.320 1.00 1.24 C ATOM 2431 CG LEU B 50 11.909 -4.855 -0.452 1.00 0.87 C ATOM 2432 CD1 LEU B 50 11.153 -4.750 0.878 1.00 1.27 C ATOM 2433 CD2 LEU B 50 12.470 -3.469 -0.801 1.00 0.90 C ATOM 0 H LEU B 50 12.298 -7.744 -2.043 1.00 0.92 H new ATOM 0 HA LEU B 50 13.929 -5.305 -2.142 1.00 1.00 H new ATOM 0 HB2 LEU B 50 12.562 -6.837 0.082 1.00 1.24 H new ATOM 0 HB3 LEU B 50 13.747 -5.586 0.401 1.00 1.24 H new ATOM 0 HG LEU B 50 11.253 -5.163 -1.266 1.00 0.87 H new ATOM 0 HD11 LEU B 50 10.374 -3.993 0.795 1.00 1.27 H new ATOM 0 HD12 LEU B 50 10.700 -5.712 1.116 1.00 1.27 H new ATOM 0 HD13 LEU B 50 11.848 -4.470 1.670 1.00 1.27 H new ATOM 0 HD21 LEU B 50 11.651 -2.755 -0.881 1.00 0.90 H new ATOM 0 HD22 LEU B 50 13.157 -3.147 -0.018 1.00 0.90 H new ATOM 0 HD23 LEU B 50 13.001 -3.520 -1.752 1.00 0.90 H new ATOM 2445 N LYS B 51 16.113 -6.451 -1.833 1.00 1.06 N ATOM 2446 CA LYS B 51 17.441 -6.858 -1.396 1.00 1.36 C ATOM 2447 C LYS B 51 17.784 -6.161 -0.071 1.00 1.47 C ATOM 2448 O LYS B 51 16.996 -5.367 0.436 1.00 2.11 O ATOM 2449 CB LYS B 51 18.463 -6.621 -2.527 1.00 1.69 C ATOM 2450 CG LYS B 51 18.532 -5.202 -3.124 1.00 1.86 C ATOM 2451 CD LYS B 51 19.073 -4.173 -2.124 1.00 3.08 C ATOM 2452 CE LYS B 51 19.270 -2.787 -2.748 1.00 3.91 C ATOM 2453 NZ LYS B 51 19.761 -1.832 -1.733 1.00 5.31 N ATOM 0 H LYS B 51 16.120 -5.692 -2.514 1.00 1.06 H new ATOM 0 HA LYS B 51 17.473 -7.928 -1.190 1.00 1.36 H new ATOM 0 HB2 LYS B 51 19.452 -6.877 -2.148 1.00 1.69 H new ATOM 0 HB3 LYS B 51 18.241 -7.318 -3.335 1.00 1.69 H new ATOM 0 HG2 LYS B 51 19.168 -5.214 -4.009 1.00 1.86 H new ATOM 0 HG3 LYS B 51 17.537 -4.899 -3.450 1.00 1.86 H new ATOM 0 HD2 LYS B 51 18.384 -4.093 -1.283 1.00 3.08 H new ATOM 0 HD3 LYS B 51 20.024 -4.526 -1.725 1.00 3.08 H new ATOM 0 HE2 LYS B 51 19.981 -2.850 -3.572 1.00 3.91 H new ATOM 0 HE3 LYS B 51 18.328 -2.432 -3.166 1.00 3.91 H new ATOM 0 HZ1 LYS B 51 19.729 -0.867 -2.120 1.00 5.31 H new ATOM 0 HZ2 LYS B 51 19.159 -1.885 -0.886 1.00 5.31 H new ATOM 0 HZ3 LYS B 51 20.741 -2.070 -1.477 1.00 5.31 H new ATOM 2467 N ASP B 52 18.964 -6.460 0.485 1.00 1.56 N ATOM 2468 CA ASP B 52 19.532 -5.878 1.707 1.00 1.75 C ATOM 2469 C ASP B 52 18.707 -6.149 2.971 1.00 1.72 C ATOM 2470 O ASP B 52 18.986 -5.613 4.040 1.00 2.12 O ATOM 2471 CB ASP B 52 20.024 -4.426 1.539 1.00 2.01 C ATOM 2472 CG ASP B 52 18.959 -3.334 1.570 1.00 3.09 C ATOM 2473 OD1 ASP B 52 18.246 -3.214 2.587 1.00 4.31 O ATOM 2474 OD2 ASP B 52 18.934 -2.541 0.603 1.00 3.76 O ATOM 0 H ASP B 52 19.584 -7.155 0.070 1.00 1.56 H new ATOM 0 HA ASP B 52 20.451 -6.437 1.885 1.00 1.75 H new ATOM 0 HB2 ASP B 52 20.747 -4.218 2.328 1.00 2.01 H new ATOM 0 HB3 ASP B 52 20.557 -4.355 0.591 1.00 2.01 H new ATOM 2479 N VAL B 53 17.801 -7.126 2.881 1.00 1.61 N ATOM 2480 CA VAL B 53 17.038 -7.684 3.987 1.00 1.59 C ATOM 2481 C VAL B 53 17.923 -8.189 5.135 1.00 1.61 C ATOM 2482 O VAL B 53 17.452 -8.303 6.265 1.00 1.91 O ATOM 2483 CB VAL B 53 16.110 -8.786 3.451 1.00 1.65 C ATOM 2484 CG1 VAL B 53 15.023 -8.178 2.558 1.00 2.38 C ATOM 2485 CG2 VAL B 53 16.859 -9.893 2.694 1.00 1.75 C ATOM 0 H VAL B 53 17.573 -7.567 1.990 1.00 1.61 H new ATOM 0 HA VAL B 53 16.438 -6.885 4.422 1.00 1.59 H new ATOM 0 HB VAL B 53 15.653 -9.257 4.321 1.00 1.65 H new ATOM 0 HG11 VAL B 53 14.373 -8.970 2.185 1.00 2.38 H new ATOM 0 HG12 VAL B 53 14.433 -7.466 3.136 1.00 2.38 H new ATOM 0 HG13 VAL B 53 15.488 -7.665 1.717 1.00 2.38 H new ATOM 0 HG21 VAL B 53 16.147 -10.639 2.342 1.00 1.75 H new ATOM 0 HG22 VAL B 53 17.383 -9.461 1.841 1.00 1.75 H new ATOM 0 HG23 VAL B 53 17.580 -10.366 3.361 1.00 1.75 H new ATOM 2495 N GLY B 54 19.209 -8.461 4.883 1.00 1.78 N ATOM 2496 CA GLY B 54 20.185 -8.654 5.950 1.00 2.36 C ATOM 2497 C GLY B 54 20.064 -7.540 6.994 1.00 2.18 C ATOM 2498 O GLY B 54 20.012 -7.805 8.193 1.00 2.60 O ATOM 0 H GLY B 54 19.594 -8.552 3.943 1.00 1.78 H new ATOM 0 HA2 GLY B 54 20.028 -9.623 6.424 1.00 2.36 H new ATOM 0 HA3 GLY B 54 21.192 -8.662 5.533 1.00 2.36 H new ATOM 2502 N SER B 55 19.949 -6.296 6.524 1.00 1.72 N ATOM 2503 CA SER B 55 19.717 -5.120 7.341 1.00 1.65 C ATOM 2504 C SER B 55 18.217 -4.829 7.466 1.00 1.37 C ATOM 2505 O SER B 55 17.823 -3.666 7.435 1.00 1.53 O ATOM 2506 CB SER B 55 20.447 -3.930 6.700 1.00 1.82 C ATOM 2507 OG SER B 55 21.809 -4.250 6.483 1.00 2.55 O ATOM 0 H SER B 55 20.018 -6.081 5.529 1.00 1.72 H new ATOM 0 HA SER B 55 20.101 -5.292 8.347 1.00 1.65 H new ATOM 0 HB2 SER B 55 19.972 -3.670 5.754 1.00 1.82 H new ATOM 0 HB3 SER B 55 20.370 -3.056 7.347 1.00 1.82 H new ATOM 0 HG SER B 55 22.263 -3.485 6.073 1.00 2.55 H new ATOM 2513 N LEU B 56 17.358 -5.845 7.628 1.00 1.13 N ATOM 2514 CA LEU B 56 15.933 -5.642 7.830 1.00 0.98 C ATOM 2515 C LEU B 56 15.709 -4.589 8.910 1.00 0.99 C ATOM 2516 O LEU B 56 14.962 -3.639 8.711 1.00 0.84 O ATOM 2517 CB LEU B 56 15.285 -6.987 8.173 1.00 1.01 C ATOM 2518 CG LEU B 56 13.791 -6.918 8.506 1.00 1.00 C ATOM 2519 CD1 LEU B 56 13.526 -6.392 9.917 1.00 1.07 C ATOM 2520 CD2 LEU B 56 13.031 -6.106 7.453 1.00 0.92 C ATOM 0 H LEU B 56 17.639 -6.825 7.621 1.00 1.13 H new ATOM 0 HA LEU B 56 15.463 -5.267 6.921 1.00 0.98 H new ATOM 0 HB2 LEU B 56 15.424 -7.666 7.331 1.00 1.01 H new ATOM 0 HB3 LEU B 56 15.812 -7.421 9.023 1.00 1.01 H new ATOM 0 HG LEU B 56 13.414 -7.941 8.484 1.00 1.00 H new ATOM 0 HD11 LEU B 56 12.452 -6.364 10.099 1.00 1.07 H new ATOM 0 HD12 LEU B 56 14.001 -7.049 10.645 1.00 1.07 H new ATOM 0 HD13 LEU B 56 13.937 -5.387 10.014 1.00 1.07 H new ATOM 0 HD21 LEU B 56 11.973 -6.073 7.713 1.00 0.92 H new ATOM 0 HD22 LEU B 56 13.429 -5.092 7.419 1.00 0.92 H new ATOM 0 HD23 LEU B 56 13.150 -6.575 6.476 1.00 0.92 H new ATOM 2532 N ASP B 57 16.397 -4.741 10.039 1.00 1.29 N ATOM 2533 CA ASP B 57 16.382 -3.844 11.178 1.00 1.43 C ATOM 2534 C ASP B 57 16.500 -2.358 10.772 1.00 1.28 C ATOM 2535 O ASP B 57 15.834 -1.502 11.357 1.00 1.21 O ATOM 2536 CB ASP B 57 17.464 -4.320 12.164 1.00 1.89 C ATOM 2537 CG ASP B 57 17.233 -5.756 12.658 1.00 3.60 C ATOM 2538 OD1 ASP B 57 16.904 -6.637 11.825 1.00 4.40 O ATOM 2539 OD2 ASP B 57 17.366 -5.990 13.874 1.00 4.83 O ATOM 0 H ASP B 57 17.013 -5.541 10.186 1.00 1.29 H new ATOM 0 HA ASP B 57 15.414 -3.886 11.678 1.00 1.43 H new ATOM 0 HB2 ASP B 57 18.440 -4.260 11.682 1.00 1.89 H new ATOM 0 HB3 ASP B 57 17.490 -3.646 13.020 1.00 1.89 H new ATOM 2544 N GLU B 58 17.290 -2.035 9.740 1.00 1.30 N ATOM 2545 CA GLU B 58 17.348 -0.685 9.178 1.00 1.28 C ATOM 2546 C GLU B 58 15.996 -0.313 8.560 1.00 0.99 C ATOM 2547 O GLU B 58 15.438 0.753 8.839 1.00 0.95 O ATOM 2548 CB GLU B 58 18.472 -0.615 8.131 1.00 1.46 C ATOM 2549 CG GLU B 58 18.506 0.691 7.331 1.00 1.78 C ATOM 2550 CD GLU B 58 19.479 0.566 6.166 1.00 1.94 C ATOM 2551 OE1 GLU B 58 20.678 0.365 6.444 1.00 2.88 O ATOM 2552 OE2 GLU B 58 18.991 0.598 5.013 1.00 1.91 O ATOM 0 H GLU B 58 17.905 -2.703 9.274 1.00 1.30 H new ATOM 0 HA GLU B 58 17.564 0.032 9.970 1.00 1.28 H new ATOM 0 HB2 GLU B 58 19.430 -0.745 8.634 1.00 1.46 H new ATOM 0 HB3 GLU B 58 18.360 -1.449 7.438 1.00 1.46 H new ATOM 0 HG2 GLU B 58 17.509 0.924 6.958 1.00 1.78 H new ATOM 0 HG3 GLU B 58 18.805 1.515 7.978 1.00 1.78 H new ATOM 2559 N LYS B 59 15.475 -1.190 7.694 1.00 0.84 N ATOM 2560 CA LYS B 59 14.189 -0.969 7.050 1.00 0.67 C ATOM 2561 C LYS B 59 13.152 -0.714 8.142 1.00 0.58 C ATOM 2562 O LYS B 59 12.471 0.306 8.130 1.00 0.59 O ATOM 2563 CB LYS B 59 13.741 -2.156 6.172 1.00 0.74 C ATOM 2564 CG LYS B 59 14.790 -2.888 5.322 1.00 1.84 C ATOM 2565 CD LYS B 59 15.353 -2.106 4.130 1.00 1.62 C ATOM 2566 CE LYS B 59 16.459 -1.134 4.574 1.00 2.41 C ATOM 2567 NZ LYS B 59 17.444 -0.875 3.511 1.00 3.35 N ATOM 0 H LYS B 59 15.932 -2.062 7.427 1.00 0.84 H new ATOM 0 HA LYS B 59 14.286 -0.113 6.382 1.00 0.67 H new ATOM 0 HB2 LYS B 59 13.275 -2.893 6.827 1.00 0.74 H new ATOM 0 HB3 LYS B 59 12.965 -1.793 5.498 1.00 0.74 H new ATOM 0 HG2 LYS B 59 15.620 -3.172 5.969 1.00 1.84 H new ATOM 0 HG3 LYS B 59 14.347 -3.811 4.949 1.00 1.84 H new ATOM 0 HD2 LYS B 59 15.752 -2.801 3.391 1.00 1.62 H new ATOM 0 HD3 LYS B 59 14.551 -1.551 3.645 1.00 1.62 H new ATOM 0 HE2 LYS B 59 16.007 -0.192 4.883 1.00 2.41 H new ATOM 0 HE3 LYS B 59 16.970 -1.544 5.446 1.00 2.41 H new ATOM 0 HZ1 LYS B 59 18.338 -0.558 3.936 1.00 3.35 H new ATOM 0 HZ2 LYS B 59 17.608 -1.748 2.970 1.00 3.35 H new ATOM 0 HZ3 LYS B 59 17.082 -0.136 2.875 1.00 3.35 H new ATOM 2581 N MET B 60 13.052 -1.622 9.115 1.00 0.69 N ATOM 2582 CA MET B 60 12.004 -1.516 10.117 1.00 0.92 C ATOM 2583 C MET B 60 12.158 -0.226 10.915 1.00 0.81 C ATOM 2584 O MET B 60 11.169 0.467 11.115 1.00 0.80 O ATOM 2585 CB MET B 60 11.815 -2.794 10.948 1.00 1.59 C ATOM 2586 CG MET B 60 12.845 -3.069 12.050 1.00 1.02 C ATOM 2587 SD MET B 60 12.273 -3.032 13.773 1.00 1.66 S ATOM 2588 CE MET B 60 12.019 -1.270 14.064 1.00 2.02 C ATOM 0 H MET B 60 13.674 -2.423 9.225 1.00 0.69 H new ATOM 0 HA MET B 60 11.046 -1.435 9.603 1.00 0.92 H new ATOM 0 HB2 MET B 60 10.828 -2.755 11.409 1.00 1.59 H new ATOM 0 HB3 MET B 60 11.814 -3.644 10.266 1.00 1.59 H new ATOM 0 HG2 MET B 60 13.281 -4.050 11.863 1.00 1.02 H new ATOM 0 HG3 MET B 60 13.648 -2.339 11.948 1.00 1.02 H new ATOM 0 HE1 MET B 60 11.772 -1.106 15.113 1.00 2.02 H new ATOM 0 HE2 MET B 60 12.930 -0.725 13.817 1.00 2.02 H new ATOM 0 HE3 MET B 60 11.201 -0.912 13.438 1.00 2.02 H new ATOM 2598 N LYS B 61 13.380 0.159 11.304 1.00 0.88 N ATOM 2599 CA LYS B 61 13.601 1.470 11.906 1.00 0.92 C ATOM 2600 C LYS B 61 13.061 2.607 11.026 1.00 0.83 C ATOM 2601 O LYS B 61 12.528 3.589 11.547 1.00 0.86 O ATOM 2602 CB LYS B 61 15.090 1.660 12.231 1.00 1.11 C ATOM 2603 CG LYS B 61 15.422 1.022 13.584 1.00 1.99 C ATOM 2604 CD LYS B 61 16.887 1.269 13.966 1.00 1.91 C ATOM 2605 CE LYS B 61 17.098 1.088 15.478 1.00 2.50 C ATOM 2606 NZ LYS B 61 16.676 2.279 16.252 1.00 3.54 N ATOM 0 H LYS B 61 14.219 -0.414 11.212 1.00 0.88 H new ATOM 0 HA LYS B 61 13.039 1.511 12.839 1.00 0.92 H new ATOM 0 HB2 LYS B 61 15.701 1.210 11.449 1.00 1.11 H new ATOM 0 HB3 LYS B 61 15.332 2.723 12.252 1.00 1.11 H new ATOM 0 HG2 LYS B 61 14.768 1.432 14.353 1.00 1.99 H new ATOM 0 HG3 LYS B 61 15.230 -0.050 13.541 1.00 1.99 H new ATOM 0 HD2 LYS B 61 17.531 0.579 13.420 1.00 1.91 H new ATOM 0 HD3 LYS B 61 17.179 2.277 13.672 1.00 1.91 H new ATOM 0 HE2 LYS B 61 16.537 0.218 15.819 1.00 2.50 H new ATOM 0 HE3 LYS B 61 18.151 0.885 15.674 1.00 2.50 H new ATOM 0 HZ1 LYS B 61 16.241 1.975 17.147 1.00 3.54 H new ATOM 0 HZ2 LYS B 61 17.505 2.873 16.454 1.00 3.54 H new ATOM 0 HZ3 LYS B 61 15.985 2.825 15.699 1.00 3.54 H new ATOM 2620 N SER B 62 13.189 2.476 9.705 1.00 0.82 N ATOM 2621 CA SER B 62 12.661 3.452 8.763 1.00 0.84 C ATOM 2622 C SER B 62 11.124 3.448 8.742 1.00 0.80 C ATOM 2623 O SER B 62 10.513 4.513 8.745 1.00 0.98 O ATOM 2624 CB SER B 62 13.259 3.225 7.369 1.00 0.89 C ATOM 2625 OG SER B 62 14.667 3.085 7.451 1.00 1.96 O ATOM 0 H SER B 62 13.662 1.689 9.262 1.00 0.82 H new ATOM 0 HA SER B 62 12.960 4.446 9.096 1.00 0.84 H new ATOM 0 HB2 SER B 62 12.824 2.332 6.921 1.00 0.89 H new ATOM 0 HB3 SER B 62 13.008 4.062 6.718 1.00 0.89 H new ATOM 0 HG SER B 62 14.887 2.207 7.826 1.00 1.96 H new ATOM 2631 N LEU B 63 10.477 2.277 8.711 1.00 0.73 N ATOM 2632 CA LEU B 63 9.012 2.208 8.697 1.00 0.83 C ATOM 2633 C LEU B 63 8.408 2.650 10.035 1.00 0.84 C ATOM 2634 O LEU B 63 7.393 3.348 10.065 1.00 0.88 O ATOM 2635 CB LEU B 63 8.508 0.791 8.398 1.00 1.02 C ATOM 2636 CG LEU B 63 8.614 0.341 6.934 1.00 1.23 C ATOM 2637 CD1 LEU B 63 10.007 -0.174 6.593 1.00 1.61 C ATOM 2638 CD2 LEU B 63 7.627 -0.807 6.719 1.00 1.36 C ATOM 0 H LEU B 63 10.942 1.369 8.695 1.00 0.73 H new ATOM 0 HA LEU B 63 8.694 2.886 7.905 1.00 0.83 H new ATOM 0 HB2 LEU B 63 9.067 0.089 9.016 1.00 1.02 H new ATOM 0 HB3 LEU B 63 7.464 0.724 8.705 1.00 1.02 H new ATOM 0 HG LEU B 63 8.399 1.200 6.298 1.00 1.23 H new ATOM 0 HD11 LEU B 63 10.036 -0.481 5.548 1.00 1.61 H new ATOM 0 HD12 LEU B 63 10.738 0.617 6.759 1.00 1.61 H new ATOM 0 HD13 LEU B 63 10.245 -1.027 7.228 1.00 1.61 H new ATOM 0 HD21 LEU B 63 7.683 -1.146 5.684 1.00 1.36 H new ATOM 0 HD22 LEU B 63 7.878 -1.632 7.385 1.00 1.36 H new ATOM 0 HD23 LEU B 63 6.616 -0.462 6.934 1.00 1.36 H new ATOM 2650 N ASP B 64 9.002 2.188 11.137 1.00 0.84 N ATOM 2651 CA ASP B 64 8.494 2.210 12.505 1.00 0.90 C ATOM 2652 C ASP B 64 8.260 3.595 13.111 1.00 0.94 C ATOM 2653 O ASP B 64 7.793 3.657 14.238 1.00 1.02 O ATOM 2654 CB ASP B 64 9.254 1.254 13.441 1.00 0.94 C ATOM 2655 CG ASP B 64 8.429 0.872 14.670 1.00 1.11 C ATOM 2656 OD1 ASP B 64 7.190 0.783 14.536 1.00 1.34 O ATOM 2657 OD2 ASP B 64 9.004 0.670 15.758 1.00 1.46 O ATOM 0 H ASP B 64 9.924 1.755 11.089 1.00 0.84 H new ATOM 0 HA ASP B 64 7.483 1.815 12.407 1.00 0.90 H new ATOM 0 HB2 ASP B 64 9.526 0.352 12.893 1.00 0.94 H new ATOM 0 HB3 ASP B 64 10.184 1.725 13.761 1.00 0.94 H new ATOM 2662 N VAL B 65 8.688 4.687 12.462 1.00 0.95 N ATOM 2663 CA VAL B 65 9.470 5.839 12.939 1.00 0.98 C ATOM 2664 C VAL B 65 9.318 6.329 14.392 1.00 1.08 C ATOM 2665 O VAL B 65 10.246 6.962 14.889 1.00 1.23 O ATOM 2666 CB VAL B 65 9.170 7.037 12.012 1.00 1.05 C ATOM 2667 CG1 VAL B 65 9.573 6.763 10.559 1.00 1.22 C ATOM 2668 CG2 VAL B 65 7.688 7.444 12.044 1.00 1.54 C ATOM 0 H VAL B 65 8.468 4.798 11.472 1.00 0.95 H new ATOM 0 HA VAL B 65 10.490 5.454 12.916 1.00 0.98 H new ATOM 0 HB VAL B 65 9.773 7.858 12.401 1.00 1.05 H new ATOM 0 HG11 VAL B 65 9.342 7.635 9.947 1.00 1.22 H new ATOM 0 HG12 VAL B 65 10.643 6.558 10.510 1.00 1.22 H new ATOM 0 HG13 VAL B 65 9.021 5.901 10.185 1.00 1.22 H new ATOM 0 HG21 VAL B 65 7.529 8.290 11.376 1.00 1.54 H new ATOM 0 HG22 VAL B 65 7.073 6.605 11.719 1.00 1.54 H new ATOM 0 HG23 VAL B 65 7.410 7.726 13.060 1.00 1.54 H new ATOM 2678 N ASN B 66 8.233 6.034 15.111 1.00 1.13 N ATOM 2679 CA ASN B 66 8.295 6.018 16.575 1.00 1.34 C ATOM 2680 C ASN B 66 9.423 5.101 17.060 1.00 1.46 C ATOM 2681 O ASN B 66 10.048 5.398 18.073 1.00 1.87 O ATOM 2682 CB ASN B 66 6.960 5.627 17.234 1.00 1.52 C ATOM 2683 CG ASN B 66 6.200 4.522 16.506 1.00 1.50 C ATOM 2684 OD1 ASN B 66 6.430 3.323 16.680 1.00 1.57 O ATOM 2685 ND2 ASN B 66 5.269 4.929 15.651 1.00 2.41 N ATOM 0 H ASN B 66 7.320 5.808 14.716 1.00 1.13 H new ATOM 0 HA ASN B 66 8.506 7.042 16.885 1.00 1.34 H new ATOM 0 HB2 ASN B 66 7.154 5.305 18.257 1.00 1.52 H new ATOM 0 HB3 ASN B 66 6.325 6.511 17.293 1.00 1.52 H new ATOM 0 HD21 ASN B 66 4.728 4.245 15.123 1.00 2.41 H new ATOM 0 HD22 ASN B 66 5.095 5.926 15.523 1.00 2.41 H new ATOM 2692 N GLN B 67 9.693 4.008 16.337 1.00 1.28 N ATOM 2693 CA GLN B 67 10.714 3.032 16.699 1.00 1.50 C ATOM 2694 C GLN B 67 10.404 2.451 18.080 1.00 1.42 C ATOM 2695 O GLN B 67 11.236 2.487 18.984 1.00 1.60 O ATOM 2696 CB GLN B 67 12.136 3.586 16.541 1.00 2.10 C ATOM 2697 CG GLN B 67 12.377 3.978 15.075 1.00 2.89 C ATOM 2698 CD GLN B 67 13.844 4.219 14.744 1.00 2.87 C ATOM 2699 OE1 GLN B 67 14.742 3.950 15.543 1.00 2.32 O ATOM 2700 NE2 GLN B 67 14.116 4.678 13.528 1.00 4.21 N ATOM 0 H GLN B 67 9.200 3.778 15.474 1.00 1.28 H new ATOM 0 HA GLN B 67 10.683 2.201 15.995 1.00 1.50 H new ATOM 0 HB2 GLN B 67 12.273 4.453 17.187 1.00 2.10 H new ATOM 0 HB3 GLN B 67 12.865 2.838 16.852 1.00 2.10 H new ATOM 0 HG2 GLN B 67 11.992 3.190 14.428 1.00 2.89 H new ATOM 0 HG3 GLN B 67 11.809 4.881 14.850 1.00 2.89 H new ATOM 0 HE21 GLN B 67 13.356 4.894 12.883 1.00 4.21 H new ATOM 0 HE22 GLN B 67 15.085 4.814 13.239 1.00 4.21 H new ATOM 2709 N ASP B 68 9.189 1.909 18.213 1.00 1.33 N ATOM 2710 CA ASP B 68 8.760 1.172 19.396 1.00 1.31 C ATOM 2711 C ASP B 68 9.281 -0.269 19.305 1.00 1.35 C ATOM 2712 O ASP B 68 9.692 -0.812 20.328 1.00 2.13 O ATOM 2713 CB ASP B 68 7.235 1.283 19.632 1.00 1.34 C ATOM 2714 CG ASP B 68 6.379 0.859 18.454 1.00 1.23 C ATOM 2715 OD1 ASP B 68 6.895 0.209 17.531 1.00 1.37 O ATOM 2716 OD2 ASP B 68 5.238 1.328 18.240 1.00 1.44 O ATOM 0 H ASP B 68 8.471 1.973 17.491 1.00 1.33 H new ATOM 0 HA ASP B 68 9.197 1.621 20.288 1.00 1.31 H new ATOM 0 HB2 ASP B 68 6.969 0.673 20.495 1.00 1.34 H new ATOM 0 HB3 ASP B 68 6.994 2.315 19.886 1.00 1.34 H new ATOM 2721 N SER B 69 9.352 -0.827 18.084 1.00 1.13 N ATOM 2722 CA SER B 69 9.718 -2.198 17.702 1.00 1.06 C ATOM 2723 C SER B 69 8.507 -2.994 17.200 1.00 1.03 C ATOM 2724 O SER B 69 8.675 -4.110 16.711 1.00 1.28 O ATOM 2725 CB SER B 69 10.455 -2.993 18.792 1.00 1.14 C ATOM 2726 OG SER B 69 11.609 -2.300 19.228 1.00 1.90 O ATOM 0 H SER B 69 9.132 -0.271 17.258 1.00 1.13 H new ATOM 0 HA SER B 69 10.429 -2.067 16.886 1.00 1.06 H new ATOM 0 HB2 SER B 69 9.788 -3.165 19.637 1.00 1.14 H new ATOM 0 HB3 SER B 69 10.738 -3.972 18.405 1.00 1.14 H new ATOM 0 HG SER B 69 11.348 -1.586 19.847 1.00 1.90 H new ATOM 2732 N GLU B 70 7.306 -2.418 17.292 1.00 0.95 N ATOM 2733 CA GLU B 70 6.042 -3.027 16.927 1.00 0.94 C ATOM 2734 C GLU B 70 5.537 -2.278 15.705 1.00 0.85 C ATOM 2735 O GLU B 70 4.960 -1.194 15.838 1.00 0.94 O ATOM 2736 CB GLU B 70 5.035 -2.911 18.081 1.00 1.14 C ATOM 2737 CG GLU B 70 5.358 -3.864 19.240 1.00 1.66 C ATOM 2738 CD GLU B 70 6.593 -3.420 20.013 1.00 3.87 C ATOM 2739 OE1 GLU B 70 6.542 -2.288 20.538 1.00 4.56 O ATOM 2740 OE2 GLU B 70 7.554 -4.217 20.053 1.00 5.39 O ATOM 0 H GLU B 70 7.192 -1.467 17.642 1.00 0.95 H new ATOM 0 HA GLU B 70 6.167 -4.089 16.713 1.00 0.94 H new ATOM 0 HB2 GLU B 70 5.026 -1.885 18.450 1.00 1.14 H new ATOM 0 HB3 GLU B 70 4.033 -3.124 17.708 1.00 1.14 H new ATOM 0 HG2 GLU B 70 4.505 -3.915 19.917 1.00 1.66 H new ATOM 0 HG3 GLU B 70 5.516 -4.870 18.850 1.00 1.66 H new ATOM 2747 N LEU B 71 5.775 -2.853 14.530 1.00 0.85 N ATOM 2748 CA LEU B 71 5.363 -2.365 13.227 1.00 0.82 C ATOM 2749 C LEU B 71 3.868 -2.666 13.093 1.00 0.89 C ATOM 2750 O LEU B 71 3.502 -3.763 12.674 1.00 0.98 O ATOM 2751 CB LEU B 71 6.178 -3.086 12.136 1.00 0.83 C ATOM 2752 CG LEU B 71 7.653 -2.656 11.986 1.00 0.83 C ATOM 2753 CD1 LEU B 71 7.792 -1.346 11.204 1.00 0.84 C ATOM 2754 CD2 LEU B 71 8.412 -2.573 13.315 1.00 0.95 C ATOM 0 H LEU B 71 6.294 -3.728 14.463 1.00 0.85 H new ATOM 0 HA LEU B 71 5.538 -1.295 13.118 1.00 0.82 H new ATOM 0 HB2 LEU B 71 6.153 -4.156 12.342 1.00 0.83 H new ATOM 0 HB3 LEU B 71 5.678 -2.934 11.179 1.00 0.83 H new ATOM 0 HG LEU B 71 8.121 -3.455 11.411 1.00 0.83 H new ATOM 0 HD11 LEU B 71 8.846 -1.081 11.122 1.00 0.84 H new ATOM 0 HD12 LEU B 71 7.371 -1.471 10.206 1.00 0.84 H new ATOM 0 HD13 LEU B 71 7.258 -0.552 11.726 1.00 0.84 H new ATOM 0 HD21 LEU B 71 9.441 -2.265 13.128 1.00 0.95 H new ATOM 0 HD22 LEU B 71 7.928 -1.845 13.966 1.00 0.95 H new ATOM 0 HD23 LEU B 71 8.408 -3.550 13.798 1.00 0.95 H new ATOM 2766 N LYS B 72 3.011 -1.723 13.492 1.00 0.98 N ATOM 2767 CA LYS B 72 1.554 -1.861 13.489 1.00 1.11 C ATOM 2768 C LYS B 72 0.993 -1.524 12.106 1.00 1.00 C ATOM 2769 O LYS B 72 1.743 -1.065 11.239 1.00 0.91 O ATOM 2770 CB LYS B 72 0.964 -0.950 14.579 1.00 1.40 C ATOM 2771 CG LYS B 72 0.997 0.539 14.191 1.00 1.52 C ATOM 2772 CD LYS B 72 1.180 1.457 15.406 1.00 2.26 C ATOM 2773 CE LYS B 72 -0.002 1.364 16.381 1.00 2.28 C ATOM 2774 NZ LYS B 72 0.181 2.244 17.556 1.00 3.14 N ATOM 0 H LYS B 72 3.322 -0.815 13.836 1.00 0.98 H new ATOM 0 HA LYS B 72 1.275 -2.892 13.709 1.00 1.11 H new ATOM 0 HB2 LYS B 72 -0.066 -1.247 14.777 1.00 1.40 H new ATOM 0 HB3 LYS B 72 1.520 -1.092 15.506 1.00 1.40 H new ATOM 0 HG2 LYS B 72 1.810 0.710 13.485 1.00 1.52 H new ATOM 0 HG3 LYS B 72 0.070 0.799 13.679 1.00 1.52 H new ATOM 0 HD2 LYS B 72 2.100 1.191 15.926 1.00 2.26 H new ATOM 0 HD3 LYS B 72 1.291 2.487 15.068 1.00 2.26 H new ATOM 0 HE2 LYS B 72 -0.922 1.636 15.863 1.00 2.28 H new ATOM 0 HE3 LYS B 72 -0.117 0.333 16.714 1.00 2.28 H new ATOM 0 HZ1 LYS B 72 -0.638 2.152 18.190 1.00 3.14 H new ATOM 0 HZ2 LYS B 72 1.045 1.968 18.065 1.00 3.14 H new ATOM 0 HZ3 LYS B 72 0.265 3.231 17.240 1.00 3.14 H new ATOM 2788 N PHE B 73 -0.320 -1.664 11.885 1.00 1.12 N ATOM 2789 CA PHE B 73 -0.861 -1.415 10.545 1.00 1.13 C ATOM 2790 C PHE B 73 -1.155 0.074 10.240 1.00 1.15 C ATOM 2791 O PHE B 73 -2.118 0.398 9.549 1.00 1.40 O ATOM 2792 CB PHE B 73 -2.103 -2.307 10.338 1.00 1.41 C ATOM 2793 CG PHE B 73 -3.437 -1.806 10.880 1.00 1.55 C ATOM 2794 CD1 PHE B 73 -3.562 -1.333 12.201 1.00 2.86 C ATOM 2795 CD2 PHE B 73 -4.558 -1.774 10.030 1.00 2.65 C ATOM 2796 CE1 PHE B 73 -4.791 -0.837 12.667 1.00 4.20 C ATOM 2797 CE2 PHE B 73 -5.782 -1.266 10.493 1.00 3.91 C ATOM 2798 CZ PHE B 73 -5.903 -0.797 11.811 1.00 4.50 C ATOM 0 H PHE B 73 -1.005 -1.938 12.589 1.00 1.12 H new ATOM 0 HA PHE B 73 -0.087 -1.680 9.825 1.00 1.13 H new ATOM 0 HB2 PHE B 73 -2.219 -2.476 9.267 1.00 1.41 H new ATOM 0 HB3 PHE B 73 -1.899 -3.276 10.794 1.00 1.41 H new ATOM 0 HD1 PHE B 73 -2.707 -1.352 12.860 1.00 2.86 H new ATOM 0 HD2 PHE B 73 -4.476 -2.142 9.018 1.00 2.65 H new ATOM 0 HE1 PHE B 73 -4.880 -0.486 13.685 1.00 4.20 H new ATOM 0 HE2 PHE B 73 -6.635 -1.236 9.832 1.00 3.91 H new ATOM 0 HZ PHE B 73 -6.846 -0.408 12.164 1.00 4.50 H new ATOM 2808 N ASN B 74 -0.168 0.941 10.497 1.00 1.19 N ATOM 2809 CA ASN B 74 0.388 1.895 9.537 1.00 1.04 C ATOM 2810 C ASN B 74 1.750 2.359 10.069 1.00 1.08 C ATOM 2811 O ASN B 74 2.071 3.544 10.113 1.00 1.51 O ATOM 2812 CB ASN B 74 -0.557 3.104 9.405 1.00 1.26 C ATOM 2813 CG ASN B 74 -0.142 4.106 8.324 1.00 1.62 C ATOM 2814 OD1 ASN B 74 -0.584 4.029 7.185 1.00 2.08 O ATOM 2815 ND2 ASN B 74 0.652 5.110 8.653 1.00 2.14 N ATOM 0 H ASN B 74 0.279 0.997 11.412 1.00 1.19 H new ATOM 0 HA ASN B 74 0.501 1.430 8.558 1.00 1.04 H new ATOM 0 HB2 ASN B 74 -1.562 2.744 9.185 1.00 1.26 H new ATOM 0 HB3 ASN B 74 -0.606 3.620 10.364 1.00 1.26 H new ATOM 0 HD21 ASN B 74 0.894 5.817 7.959 1.00 2.14 H new ATOM 0 HD22 ASN B 74 1.022 5.178 9.601 1.00 2.14 H new ATOM 2822 N GLU B 75 2.614 1.434 10.461 1.00 0.92 N ATOM 2823 CA GLU B 75 3.997 1.392 10.063 1.00 0.84 C ATOM 2824 C GLU B 75 4.128 0.452 8.869 1.00 0.74 C ATOM 2825 O GLU B 75 4.553 0.852 7.788 1.00 0.72 O ATOM 2826 CB GLU B 75 4.837 1.088 11.294 1.00 0.90 C ATOM 2827 CG GLU B 75 4.651 2.259 12.293 1.00 1.02 C ATOM 2828 CD GLU B 75 4.389 1.824 13.718 1.00 0.91 C ATOM 2829 OE1 GLU B 75 4.259 0.629 14.028 1.00 1.66 O ATOM 2830 OE2 GLU B 75 4.443 2.646 14.648 1.00 1.85 O ATOM 0 H GLU B 75 2.354 0.671 11.086 1.00 0.92 H new ATOM 0 HA GLU B 75 4.386 2.342 9.697 1.00 0.84 H new ATOM 0 HB2 GLU B 75 4.526 0.146 11.746 1.00 0.90 H new ATOM 0 HB3 GLU B 75 5.887 0.980 11.023 1.00 0.90 H new ATOM 0 HG2 GLU B 75 5.545 2.883 12.274 1.00 1.02 H new ATOM 0 HG3 GLU B 75 3.821 2.880 11.956 1.00 1.02 H new ATOM 2837 N TYR B 76 3.723 -0.808 9.079 1.00 0.74 N ATOM 2838 CA TYR B 76 3.896 -1.893 8.122 1.00 0.74 C ATOM 2839 C TYR B 76 3.499 -1.503 6.702 1.00 0.74 C ATOM 2840 O TYR B 76 4.243 -1.830 5.778 1.00 0.77 O ATOM 2841 CB TYR B 76 3.119 -3.137 8.577 1.00 0.83 C ATOM 2842 CG TYR B 76 3.017 -4.212 7.507 1.00 1.03 C ATOM 2843 CD1 TYR B 76 4.109 -5.061 7.253 1.00 2.25 C ATOM 2844 CD2 TYR B 76 1.898 -4.246 6.652 1.00 2.41 C ATOM 2845 CE1 TYR B 76 4.084 -5.940 6.156 1.00 2.83 C ATOM 2846 CE2 TYR B 76 1.877 -5.119 5.551 1.00 2.97 C ATOM 2847 CZ TYR B 76 2.969 -5.964 5.301 1.00 2.67 C ATOM 2848 OH TYR B 76 2.922 -6.836 4.255 1.00 3.57 O ATOM 0 H TYR B 76 3.257 -1.100 9.938 1.00 0.74 H new ATOM 0 HA TYR B 76 4.961 -2.122 8.095 1.00 0.74 H new ATOM 0 HB2 TYR B 76 3.604 -3.557 9.458 1.00 0.83 H new ATOM 0 HB3 TYR B 76 2.115 -2.839 8.878 1.00 0.83 H new ATOM 0 HD1 TYR B 76 4.971 -5.038 7.904 1.00 2.25 H new ATOM 0 HD2 TYR B 76 1.054 -3.600 6.843 1.00 2.41 H new ATOM 0 HE1 TYR B 76 4.921 -6.596 5.971 1.00 2.83 H new ATOM 0 HE2 TYR B 76 1.019 -5.140 4.896 1.00 2.97 H new ATOM 0 HH TYR B 76 2.079 -6.718 3.769 1.00 3.57 H new ATOM 2858 N TRP B 77 2.354 -0.820 6.530 1.00 0.76 N ATOM 2859 CA TRP B 77 1.887 -0.422 5.207 1.00 0.77 C ATOM 2860 C TRP B 77 3.058 0.123 4.372 1.00 0.67 C ATOM 2861 O TRP B 77 3.221 -0.296 3.222 1.00 0.66 O ATOM 2862 CB TRP B 77 0.685 0.560 5.241 1.00 0.85 C ATOM 2863 CG TRP B 77 0.481 1.253 3.919 1.00 0.82 C ATOM 2864 CD1 TRP B 77 0.676 0.611 2.747 1.00 1.56 C ATOM 2865 CD2 TRP B 77 0.645 2.664 3.572 1.00 1.84 C ATOM 2866 NE1 TRP B 77 1.430 1.449 1.949 1.00 1.74 N ATOM 2867 CE2 TRP B 77 1.531 2.715 2.469 1.00 1.86 C ATOM 2868 CE3 TRP B 77 0.075 3.897 3.949 1.00 3.45 C ATOM 2869 CZ2 TRP B 77 2.114 3.907 2.018 1.00 3.02 C ATOM 2870 CZ3 TRP B 77 0.338 5.040 3.161 1.00 4.31 C ATOM 2871 CH2 TRP B 77 1.519 5.107 2.410 1.00 4.06 C ATOM 0 H TRP B 77 1.741 -0.536 7.295 1.00 0.76 H new ATOM 0 HA TRP B 77 1.501 -1.319 4.722 1.00 0.77 H new ATOM 0 HB2 TRP B 77 -0.220 0.015 5.507 1.00 0.85 H new ATOM 0 HB3 TRP B 77 0.849 1.306 6.019 1.00 0.85 H new ATOM 0 HD1 TRP B 77 0.312 -0.371 2.484 1.00 1.56 H new ATOM 0 HE1 TRP B 77 1.863 1.160 1.072 1.00 1.74 H new ATOM 0 HE3 TRP B 77 -0.552 3.967 4.825 1.00 3.45 H new ATOM 0 HZ2 TRP B 77 2.992 3.897 1.390 1.00 3.02 H new ATOM 0 HZ3 TRP B 77 -0.367 5.857 3.138 1.00 4.31 H new ATOM 0 HH2 TRP B 77 1.955 6.058 2.143 1.00 4.06 H new ATOM 2882 N ARG B 78 3.885 1.010 4.948 1.00 0.65 N ATOM 2883 CA ARG B 78 4.997 1.624 4.231 1.00 0.61 C ATOM 2884 C ARG B 78 5.735 0.611 3.351 1.00 0.56 C ATOM 2885 O ARG B 78 6.088 0.952 2.231 1.00 0.61 O ATOM 2886 CB ARG B 78 5.988 2.321 5.175 1.00 0.62 C ATOM 2887 CG ARG B 78 5.559 3.715 5.676 1.00 0.93 C ATOM 2888 CD ARG B 78 5.042 3.715 7.120 1.00 2.23 C ATOM 2889 NE ARG B 78 4.706 5.073 7.579 1.00 3.14 N ATOM 2890 CZ ARG B 78 4.618 5.484 8.860 1.00 4.56 C ATOM 2891 NH1 ARG B 78 5.175 4.796 9.861 1.00 5.49 N ATOM 2892 NH2 ARG B 78 3.960 6.615 9.138 1.00 5.72 N ATOM 0 H ARG B 78 3.797 1.315 5.917 1.00 0.65 H new ATOM 0 HA ARG B 78 4.555 2.385 3.588 1.00 0.61 H new ATOM 0 HB2 ARG B 78 6.153 1.678 6.040 1.00 0.62 H new ATOM 0 HB3 ARG B 78 6.945 2.417 4.662 1.00 0.62 H new ATOM 0 HG2 ARG B 78 6.407 4.395 5.602 1.00 0.93 H new ATOM 0 HG3 ARG B 78 4.780 4.104 5.020 1.00 0.93 H new ATOM 0 HD2 ARG B 78 4.160 3.079 7.191 1.00 2.23 H new ATOM 0 HD3 ARG B 78 5.798 3.286 7.777 1.00 2.23 H new ATOM 0 HE ARG B 78 4.522 5.771 6.858 1.00 3.14 H new ATOM 0 HH11 ARG B 78 5.684 3.934 9.666 1.00 5.49 H new ATOM 0 HH12 ARG B 78 5.091 5.133 10.820 1.00 5.49 H new ATOM 0 HH21 ARG B 78 3.533 7.155 8.385 1.00 5.72 H new ATOM 0 HH22 ARG B 78 3.886 6.938 10.103 1.00 5.72 H new ATOM 2906 N LEU B 79 5.905 -0.639 3.797 1.00 0.56 N ATOM 2907 CA LEU B 79 6.515 -1.671 2.975 1.00 0.60 C ATOM 2908 C LEU B 79 5.869 -1.753 1.584 1.00 0.64 C ATOM 2909 O LEU B 79 6.572 -1.611 0.592 1.00 0.73 O ATOM 2910 CB LEU B 79 6.487 -3.027 3.698 1.00 0.76 C ATOM 2911 CG LEU B 79 7.585 -3.984 3.201 1.00 0.76 C ATOM 2912 CD1 LEU B 79 9.002 -3.548 3.614 1.00 0.72 C ATOM 2913 CD2 LEU B 79 7.285 -5.401 3.703 1.00 0.92 C ATOM 0 H LEU B 79 5.625 -0.953 4.726 1.00 0.56 H new ATOM 0 HA LEU B 79 7.558 -1.397 2.817 1.00 0.60 H new ATOM 0 HB2 LEU B 79 6.608 -2.866 4.769 1.00 0.76 H new ATOM 0 HB3 LEU B 79 5.512 -3.492 3.553 1.00 0.76 H new ATOM 0 HG LEU B 79 7.571 -3.961 2.111 1.00 0.76 H new ATOM 0 HD11 LEU B 79 9.729 -4.265 3.232 1.00 0.72 H new ATOM 0 HD12 LEU B 79 9.214 -2.562 3.201 1.00 0.72 H new ATOM 0 HD13 LEU B 79 9.068 -3.508 4.701 1.00 0.72 H new ATOM 0 HD21 LEU B 79 8.060 -6.083 3.353 1.00 0.92 H new ATOM 0 HD22 LEU B 79 7.264 -5.404 4.793 1.00 0.92 H new ATOM 0 HD23 LEU B 79 6.317 -5.725 3.320 1.00 0.92 H new ATOM 2925 N ILE B 80 4.548 -1.937 1.465 1.00 0.69 N ATOM 2926 CA ILE B 80 3.889 -2.059 0.176 1.00 0.85 C ATOM 2927 C ILE B 80 3.894 -0.681 -0.502 1.00 1.04 C ATOM 2928 O ILE B 80 3.999 -0.585 -1.725 1.00 1.25 O ATOM 2929 CB ILE B 80 2.477 -2.668 0.324 1.00 0.93 C ATOM 2930 CG1 ILE B 80 2.401 -3.709 1.461 1.00 1.07 C ATOM 2931 CG2 ILE B 80 2.098 -3.329 -1.009 1.00 1.38 C ATOM 2932 CD1 ILE B 80 1.047 -4.420 1.541 1.00 1.45 C ATOM 0 H ILE B 80 3.915 -2.004 2.262 1.00 0.69 H new ATOM 0 HA ILE B 80 4.430 -2.754 -0.465 1.00 0.85 H new ATOM 0 HB ILE B 80 1.782 -1.868 0.580 1.00 0.93 H new ATOM 0 HG12 ILE B 80 3.186 -4.452 1.317 1.00 1.07 H new ATOM 0 HG13 ILE B 80 2.601 -3.214 2.411 1.00 1.07 H new ATOM 0 HG21 ILE B 80 1.103 -3.767 -0.928 1.00 1.38 H new ATOM 0 HG22 ILE B 80 2.102 -2.580 -1.801 1.00 1.38 H new ATOM 0 HG23 ILE B 80 2.820 -4.111 -1.246 1.00 1.38 H new ATOM 0 HD11 ILE B 80 1.061 -5.138 2.361 1.00 1.45 H new ATOM 0 HD12 ILE B 80 0.260 -3.686 1.715 1.00 1.45 H new ATOM 0 HD13 ILE B 80 0.855 -4.943 0.604 1.00 1.45 H new ATOM 2944 N GLY B 81 3.856 0.377 0.326 1.00 1.13 N ATOM 2945 CA GLY B 81 4.137 1.756 -0.045 1.00 1.41 C ATOM 2946 C GLY B 81 5.332 1.844 -0.968 1.00 1.33 C ATOM 2947 O GLY B 81 5.322 2.513 -2.002 1.00 1.67 O ATOM 0 H GLY B 81 3.617 0.280 1.313 1.00 1.13 H new ATOM 0 HA2 GLY B 81 3.264 2.188 -0.534 1.00 1.41 H new ATOM 0 HA3 GLY B 81 4.324 2.346 0.853 1.00 1.41 H new ATOM 2951 N GLU B 82 6.375 1.169 -0.513 1.00 0.99 N ATOM 2952 CA GLU B 82 7.664 1.121 -1.132 1.00 0.97 C ATOM 2953 C GLU B 82 7.620 0.107 -2.278 1.00 1.02 C ATOM 2954 O GLU B 82 7.817 0.519 -3.405 1.00 1.14 O ATOM 2955 CB GLU B 82 8.703 0.870 -0.040 1.00 0.85 C ATOM 2956 CG GLU B 82 8.633 1.960 1.058 1.00 0.84 C ATOM 2957 CD GLU B 82 9.660 3.062 0.850 1.00 1.26 C ATOM 2958 OE1 GLU B 82 9.335 3.983 0.066 1.00 2.42 O ATOM 2959 OE2 GLU B 82 10.730 2.988 1.486 1.00 1.73 O ATOM 0 H GLU B 82 6.330 0.616 0.343 1.00 0.99 H new ATOM 0 HA GLU B 82 7.959 2.058 -1.603 1.00 0.97 H new ATOM 0 HB2 GLU B 82 8.537 -0.111 0.406 1.00 0.85 H new ATOM 0 HB3 GLU B 82 9.700 0.856 -0.479 1.00 0.85 H new ATOM 0 HG2 GLU B 82 7.634 2.396 1.070 1.00 0.84 H new ATOM 0 HG3 GLU B 82 8.791 1.500 2.033 1.00 0.84 H new ATOM 2966 N LEU B 83 7.315 -1.179 -2.060 1.00 0.95 N ATOM 2967 CA LEU B 83 7.374 -2.234 -3.088 1.00 0.98 C ATOM 2968 C LEU B 83 6.888 -1.781 -4.473 1.00 0.91 C ATOM 2969 O LEU B 83 7.599 -1.910 -5.472 1.00 0.91 O ATOM 2970 CB LEU B 83 6.507 -3.437 -2.684 1.00 1.42 C ATOM 2971 CG LEU B 83 7.215 -4.528 -1.875 1.00 0.66 C ATOM 2972 CD1 LEU B 83 7.587 -4.141 -0.460 1.00 2.27 C ATOM 2973 CD2 LEU B 83 6.302 -5.761 -1.789 1.00 1.63 C ATOM 0 H LEU B 83 7.015 -1.525 -1.149 1.00 0.95 H new ATOM 0 HA LEU B 83 8.430 -2.495 -3.155 1.00 0.98 H new ATOM 0 HB2 LEU B 83 5.661 -3.072 -2.103 1.00 1.42 H new ATOM 0 HB3 LEU B 83 6.101 -3.888 -3.589 1.00 1.42 H new ATOM 0 HG LEU B 83 8.147 -4.718 -2.407 1.00 0.66 H new ATOM 0 HD11 LEU B 83 8.082 -4.980 0.028 1.00 2.27 H new ATOM 0 HD12 LEU B 83 8.261 -3.285 -0.482 1.00 2.27 H new ATOM 0 HD13 LEU B 83 6.686 -3.879 0.094 1.00 2.27 H new ATOM 0 HD21 LEU B 83 6.799 -6.542 -1.214 1.00 1.63 H new ATOM 0 HD22 LEU B 83 5.368 -5.488 -1.298 1.00 1.63 H new ATOM 0 HD23 LEU B 83 6.091 -6.128 -2.793 1.00 1.63 H new ATOM 2985 N ALA B 84 5.649 -1.283 -4.529 1.00 0.96 N ATOM 2986 CA ALA B 84 5.019 -0.850 -5.771 1.00 0.99 C ATOM 2987 C ALA B 84 5.799 0.278 -6.444 1.00 0.99 C ATOM 2988 O ALA B 84 5.786 0.418 -7.664 1.00 1.29 O ATOM 2989 CB ALA B 84 3.601 -0.392 -5.454 1.00 1.08 C ATOM 0 H ALA B 84 5.055 -1.170 -3.707 1.00 0.96 H new ATOM 0 HA ALA B 84 5.006 -1.687 -6.469 1.00 0.99 H new ATOM 0 HB1 ALA B 84 3.111 -0.063 -6.371 1.00 1.08 H new ATOM 0 HB2 ALA B 84 3.040 -1.219 -5.019 1.00 1.08 H new ATOM 0 HB3 ALA B 84 3.636 0.435 -4.745 1.00 1.08 H new ATOM 2995 N LYS B 85 6.471 1.102 -5.648 1.00 0.77 N ATOM 2996 CA LYS B 85 7.426 2.081 -6.119 1.00 0.76 C ATOM 2997 C LYS B 85 8.743 1.383 -6.510 1.00 0.69 C ATOM 2998 O LYS B 85 9.270 1.666 -7.579 1.00 0.70 O ATOM 2999 CB LYS B 85 7.520 3.171 -5.037 1.00 1.03 C ATOM 3000 CG LYS B 85 8.788 4.024 -5.034 1.00 0.80 C ATOM 3001 CD LYS B 85 9.075 4.514 -3.601 1.00 1.33 C ATOM 3002 CE LYS B 85 7.905 5.278 -2.961 1.00 0.78 C ATOM 3003 NZ LYS B 85 8.156 5.582 -1.539 1.00 1.73 N ATOM 0 H LYS B 85 6.360 1.103 -4.634 1.00 0.77 H new ATOM 0 HA LYS B 85 7.123 2.581 -7.039 1.00 0.76 H new ATOM 0 HB2 LYS B 85 6.663 3.835 -5.147 1.00 1.03 H new ATOM 0 HB3 LYS B 85 7.429 2.692 -4.062 1.00 1.03 H new ATOM 0 HG2 LYS B 85 9.631 3.442 -5.406 1.00 0.80 H new ATOM 0 HG3 LYS B 85 8.668 4.876 -5.704 1.00 0.80 H new ATOM 0 HD2 LYS B 85 9.322 3.656 -2.976 1.00 1.33 H new ATOM 0 HD3 LYS B 85 9.953 5.160 -3.617 1.00 1.33 H new ATOM 0 HE2 LYS B 85 7.737 6.207 -3.506 1.00 0.78 H new ATOM 0 HE3 LYS B 85 6.994 4.687 -3.050 1.00 0.78 H new ATOM 0 HZ1 LYS B 85 7.289 5.414 -0.990 1.00 1.73 H new ATOM 0 HZ2 LYS B 85 8.916 4.969 -1.182 1.00 1.73 H new ATOM 0 HZ3 LYS B 85 8.440 6.578 -1.442 1.00 1.73 H new ATOM 3017 N GLU B 86 9.293 0.476 -5.699 1.00 0.71 N ATOM 3018 CA GLU B 86 10.583 -0.156 -5.958 1.00 0.75 C ATOM 3019 C GLU B 86 10.612 -0.857 -7.311 1.00 0.77 C ATOM 3020 O GLU B 86 11.599 -0.733 -8.029 1.00 0.94 O ATOM 3021 CB GLU B 86 11.003 -1.105 -4.824 1.00 0.80 C ATOM 3022 CG GLU B 86 11.075 -0.393 -3.464 1.00 0.95 C ATOM 3023 CD GLU B 86 11.806 0.952 -3.514 1.00 1.61 C ATOM 3024 OE1 GLU B 86 13.051 0.923 -3.417 1.00 1.87 O ATOM 3025 OE2 GLU B 86 11.119 1.987 -3.676 1.00 2.66 O ATOM 0 H GLU B 86 8.849 0.159 -4.837 1.00 0.71 H new ATOM 0 HA GLU B 86 11.320 0.647 -5.992 1.00 0.75 H new ATOM 0 HB2 GLU B 86 10.294 -1.930 -4.762 1.00 0.80 H new ATOM 0 HB3 GLU B 86 11.976 -1.538 -5.057 1.00 0.80 H new ATOM 0 HG2 GLU B 86 10.063 -0.233 -3.093 1.00 0.95 H new ATOM 0 HG3 GLU B 86 11.578 -1.044 -2.749 1.00 0.95 H new ATOM 3032 N ILE B 87 9.535 -1.550 -7.701 1.00 0.67 N ATOM 3033 CA ILE B 87 9.488 -2.136 -9.035 1.00 0.68 C ATOM 3034 C ILE B 87 9.722 -1.076 -10.131 1.00 0.84 C ATOM 3035 O ILE B 87 10.289 -1.380 -11.177 1.00 1.04 O ATOM 3036 CB ILE B 87 8.181 -2.935 -9.210 1.00 0.69 C ATOM 3037 CG1 ILE B 87 8.385 -4.068 -10.229 1.00 0.81 C ATOM 3038 CG2 ILE B 87 7.007 -2.046 -9.635 1.00 0.84 C ATOM 3039 CD1 ILE B 87 7.342 -5.158 -10.007 1.00 0.74 C ATOM 0 H ILE B 87 8.708 -1.713 -7.126 1.00 0.67 H new ATOM 0 HA ILE B 87 10.310 -2.843 -9.148 1.00 0.68 H new ATOM 0 HB ILE B 87 7.929 -3.360 -8.238 1.00 0.69 H new ATOM 0 HG12 ILE B 87 8.304 -3.676 -11.243 1.00 0.81 H new ATOM 0 HG13 ILE B 87 9.387 -4.485 -10.127 1.00 0.81 H new ATOM 0 HG21 ILE B 87 6.110 -2.656 -9.745 1.00 0.84 H new ATOM 0 HG22 ILE B 87 6.836 -1.282 -8.877 1.00 0.84 H new ATOM 0 HG23 ILE B 87 7.239 -1.567 -10.586 1.00 0.84 H new ATOM 0 HD11 ILE B 87 7.492 -5.958 -10.732 1.00 0.74 H new ATOM 0 HD12 ILE B 87 7.443 -5.559 -8.998 1.00 0.74 H new ATOM 0 HD13 ILE B 87 6.344 -4.738 -10.132 1.00 0.74 H new ATOM 3051 N ARG B 88 9.286 0.169 -9.894 1.00 0.88 N ATOM 3052 CA ARG B 88 9.510 1.303 -10.780 1.00 1.17 C ATOM 3053 C ARG B 88 10.897 1.938 -10.595 1.00 1.19 C ATOM 3054 O ARG B 88 11.473 2.430 -11.568 1.00 1.70 O ATOM 3055 CB ARG B 88 8.386 2.342 -10.574 1.00 1.35 C ATOM 3056 CG ARG B 88 8.565 3.640 -11.376 1.00 1.75 C ATOM 3057 CD ARG B 88 8.432 3.371 -12.874 1.00 2.05 C ATOM 3058 NE ARG B 88 8.836 4.530 -13.682 1.00 2.23 N ATOM 3059 CZ ARG B 88 10.085 4.763 -14.127 1.00 2.68 C ATOM 3060 NH1 ARG B 88 11.120 4.039 -13.686 1.00 3.61 N ATOM 3061 NH2 ARG B 88 10.293 5.731 -15.026 1.00 3.21 N ATOM 0 H ARG B 88 8.755 0.414 -9.058 1.00 0.88 H new ATOM 0 HA ARG B 88 9.485 0.937 -11.806 1.00 1.17 H new ATOM 0 HB2 ARG B 88 7.434 1.888 -10.849 1.00 1.35 H new ATOM 0 HB3 ARG B 88 8.327 2.590 -9.514 1.00 1.35 H new ATOM 0 HG2 ARG B 88 7.819 4.371 -11.065 1.00 1.75 H new ATOM 0 HG3 ARG B 88 9.543 4.072 -11.164 1.00 1.75 H new ATOM 0 HD2 ARG B 88 9.045 2.511 -13.143 1.00 2.05 H new ATOM 0 HD3 ARG B 88 7.399 3.111 -13.105 1.00 2.05 H new ATOM 0 HE ARG B 88 8.115 5.210 -13.924 1.00 2.23 H new ATOM 0 HH11 ARG B 88 10.969 3.297 -13.002 1.00 3.61 H new ATOM 0 HH12 ARG B 88 12.060 4.229 -14.034 1.00 3.61 H new ATOM 0 HH21 ARG B 88 9.509 6.286 -15.369 1.00 3.21 H new ATOM 0 HH22 ARG B 88 11.236 5.915 -15.369 1.00 3.21 H new ATOM 3075 N LYS B 89 11.355 2.062 -9.347 1.00 0.86 N ATOM 3076 CA LYS B 89 12.376 3.013 -8.916 1.00 1.07 C ATOM 3077 C LYS B 89 13.801 2.490 -9.121 1.00 1.53 C ATOM 3078 O LYS B 89 14.064 1.308 -8.921 1.00 2.14 O ATOM 3079 CB LYS B 89 12.116 3.320 -7.437 1.00 1.11 C ATOM 3080 CG LYS B 89 12.868 4.546 -6.919 1.00 1.92 C ATOM 3081 CD LYS B 89 12.347 4.842 -5.506 1.00 2.42 C ATOM 3082 CE LYS B 89 12.773 6.212 -4.976 1.00 3.46 C ATOM 3083 NZ LYS B 89 12.159 7.302 -5.763 1.00 4.28 N ATOM 0 H LYS B 89 11.011 1.481 -8.583 1.00 0.86 H new ATOM 0 HA LYS B 89 12.306 3.914 -9.525 1.00 1.07 H new ATOM 0 HB2 LYS B 89 11.047 3.472 -7.290 1.00 1.11 H new ATOM 0 HB3 LYS B 89 12.399 2.453 -6.840 1.00 1.11 H new ATOM 0 HG2 LYS B 89 13.942 4.358 -6.901 1.00 1.92 H new ATOM 0 HG3 LYS B 89 12.705 5.401 -7.575 1.00 1.92 H new ATOM 0 HD2 LYS B 89 11.259 4.784 -5.509 1.00 2.42 H new ATOM 0 HD3 LYS B 89 12.706 4.070 -4.825 1.00 2.42 H new ATOM 0 HE2 LYS B 89 12.483 6.307 -3.930 1.00 3.46 H new ATOM 0 HE3 LYS B 89 13.859 6.299 -5.015 1.00 3.46 H new ATOM 0 HZ1 LYS B 89 12.265 8.202 -5.252 1.00 4.28 H new ATOM 0 HZ2 LYS B 89 12.631 7.371 -6.687 1.00 4.28 H new ATOM 0 HZ3 LYS B 89 11.148 7.101 -5.904 1.00 4.28 H new