USER MOD reduce.3.24.130724 H: found=0, std=0, add=1136, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1137 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 THR OG1 : rot -174:sc= -0.818 USER MOD Set 1.2: A 126 THR OG1 : rot -71:sc= 0.3 USER MOD Set 2.1: A 22 THR OG1 : rot -87:sc= 1.83 USER MOD Set 2.2: A 97 TYR OH : rot -116:sc= 0.62 USER MOD Set 3.1: A 89 GLN : amide:sc= 1.11 K(o=1.7,f=-10) USER MOD Set 3.2: A 115 LYS NZ :NH3+ -164:sc= 0.618 (180deg=-0.773) USER MOD Set 4.1: A 75 THR OG1 : rot 180:sc= 0.781 USER MOD Set 4.2: A 77 THR OG1 : rot 122:sc= 0.349 USER MOD Set 5.1: A 7 ASN : amide:sc= -2.97! C(o=-3.5!,f=-6.7!) USER MOD Set 5.2: A 130 ASN : amide:sc= -0.546 K(o=-3.5,f=-4.1) USER MOD Single : A 4 HIS : no HD1:sc= 0.252 K(o=0.25,f=-4.3!) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -158:sc= -1.51 (180deg=-4.23!) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 MET CE :methyl 157:sc= -0.215 (180deg=-0.824) USER MOD Single : A 23 ASN : amide:sc= 0.468 K(o=0.47,f=-4.1!) USER MOD Single : A 27 LYS NZ :NH3+ 173:sc= 0.532 (180deg=0.382) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 61:sc= 0.0887 USER MOD Single : A 37 SER OG : rot 180:sc= -0.0189 USER MOD Single : A 47 LYS NZ :NH3+ 151:sc= 1.32 (180deg=1.14) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 157:sc= 0.766 USER MOD Single : A 54 MET CE :methyl 132:sc= -4.46! (180deg=-5.57!) USER MOD Single : A 55 HIS : no HD1:sc= -0.078 X(o=-0.078,f=-0.076) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot -80:sc= 0.976 USER MOD Single : A 67 SER OG : rot 90:sc= 0.116 USER MOD Single : A 81 GLN : amide:sc= 1.16 K(o=1.2,f=-0.69) USER MOD Single : A 85 THR OG1 : rot -96:sc= 0.403! USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 MET CE :methyl 169:sc= -0.496 (180deg=-0.593) USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 100 THR OG1 : rot 69:sc= 0.389 USER MOD Single : A 104 THR OG1 : rot 118:sc= 1.2 USER MOD Single : A 106 MET CE :methyl 156:sc= -0.454 (180deg=-1.25) USER MOD Single : A 109 THR OG1 : rot -91:sc= 1.31 USER MOD Single : A 110 GLN : amide:sc= -0.572 K(o=-0.57,f=-2.4) USER MOD Single : A 114 MET CE :methyl 153:sc= -0.297 (180deg=-1.2) USER MOD Single : A 125 MET CE :methyl -162:sc= -0.134 (180deg=-0.568) USER MOD Single : A 128 ASN : amide:sc=-0.00765 X(o=-0.0076,f=0) USER MOD Single : A 132 ASN : amide:sc= -0.0407 K(o=-0.041,f=-0.98) USER MOD Single : A 133 SER OG : rot 13:sc= 1.46 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 GLN : amide:sc= -0.316 K(o=-0.32,f=-1.5) USER MOD Single : A 137 MET CE :methyl -143:sc= -0.663 (180deg=-2.64) USER MOD Single : A 146 GLN : amide:sc=-0.00452 K(o=-0.0045,f=-0.87) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -6.124 -9.867 16.565 1.00 0.00 N ATOM 21 CA ALA A 2 -5.552 -10.179 15.258 1.00 0.00 C ATOM 22 C ALA A 2 -6.648 -10.190 14.201 1.00 0.00 C ATOM 23 O ALA A 2 -7.585 -10.994 14.268 1.00 0.00 O ATOM 24 CB ALA A 2 -4.817 -11.513 15.265 1.00 0.00 C ATOM 0 HA ALA A 2 -4.824 -9.404 15.020 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.407 -11.708 14.274 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -4.007 -11.478 15.993 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -5.511 -12.309 15.533 1.00 0.00 H new ATOM 30 N GLY A 3 -6.540 -9.292 13.240 1.00 0.00 N ATOM 31 CA GLY A 3 -7.545 -9.185 12.208 1.00 0.00 C ATOM 32 C GLY A 3 -6.960 -9.332 10.822 1.00 0.00 C ATOM 33 O GLY A 3 -5.986 -8.664 10.474 1.00 0.00 O ATOM 0 H GLY A 3 -5.769 -8.630 13.155 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -8.305 -9.951 12.363 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -8.045 -8.220 12.289 1.00 0.00 H new ATOM 37 N HIS A 4 -7.540 -10.218 10.034 1.00 0.00 N ATOM 38 CA HIS A 4 -7.110 -10.407 8.659 1.00 0.00 C ATOM 39 C HIS A 4 -8.047 -9.689 7.707 1.00 0.00 C ATOM 40 O HIS A 4 -9.130 -10.181 7.393 1.00 0.00 O ATOM 41 CB HIS A 4 -7.036 -11.892 8.308 1.00 0.00 C ATOM 42 CG HIS A 4 -5.776 -12.547 8.772 1.00 0.00 C ATOM 43 ND1 HIS A 4 -5.676 -13.248 9.949 1.00 0.00 N ATOM 44 CD2 HIS A 4 -4.551 -12.593 8.206 1.00 0.00 C ATOM 45 CE1 HIS A 4 -4.443 -13.694 10.088 1.00 0.00 C ATOM 46 NE2 HIS A 4 -3.735 -13.310 9.044 1.00 0.00 N ATOM 0 H HIS A 4 -8.312 -10.820 10.322 1.00 0.00 H new ATOM 0 HA HIS A 4 -6.112 -9.982 8.557 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -7.889 -12.406 8.751 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -7.121 -12.007 7.227 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -4.266 -12.147 7.265 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -4.074 -14.277 10.919 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -2.748 -13.512 8.886 1.00 0.00 H new ATOM 55 N THR A 5 -7.636 -8.513 7.273 1.00 0.00 N ATOM 56 CA THR A 5 -8.425 -7.728 6.343 1.00 0.00 C ATOM 57 C THR A 5 -7.938 -7.959 4.917 1.00 0.00 C ATOM 58 O THR A 5 -6.793 -7.650 4.589 1.00 0.00 O ATOM 59 CB THR A 5 -8.337 -6.228 6.680 1.00 0.00 C ATOM 60 OG1 THR A 5 -8.618 -6.023 8.073 1.00 0.00 O ATOM 61 CG2 THR A 5 -9.317 -5.426 5.840 1.00 0.00 C ATOM 0 H THR A 5 -6.756 -8.079 7.551 1.00 0.00 H new ATOM 0 HA THR A 5 -9.464 -8.046 6.428 1.00 0.00 H new ATOM 0 HB THR A 5 -7.326 -5.886 6.456 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.653 -5.062 8.262 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.236 -4.370 6.096 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.087 -5.562 4.783 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.332 -5.770 6.037 1.00 0.00 H new ATOM 69 N ASP A 6 -8.802 -8.518 4.081 1.00 0.00 N ATOM 70 CA ASP A 6 -8.450 -8.806 2.697 1.00 0.00 C ATOM 71 C ASP A 6 -9.320 -7.997 1.753 1.00 0.00 C ATOM 72 O ASP A 6 -10.384 -8.451 1.329 1.00 0.00 O ATOM 73 CB ASP A 6 -8.609 -10.298 2.383 1.00 0.00 C ATOM 74 CG ASP A 6 -7.552 -11.163 3.040 1.00 0.00 C ATOM 75 OD1 ASP A 6 -7.747 -11.569 4.206 1.00 0.00 O ATOM 76 OD2 ASP A 6 -6.536 -11.458 2.380 1.00 0.00 O ATOM 0 H ASP A 6 -9.753 -8.782 4.337 1.00 0.00 H new ATOM 0 HA ASP A 6 -7.405 -8.530 2.557 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -9.595 -10.628 2.711 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -8.567 -10.442 1.303 1.00 0.00 H new ATOM 81 N ASN A 7 -8.885 -6.791 1.442 1.00 0.00 N ATOM 82 CA ASN A 7 -9.639 -5.932 0.545 1.00 0.00 C ATOM 83 C ASN A 7 -9.073 -5.990 -0.862 1.00 0.00 C ATOM 84 O ASN A 7 -7.930 -5.604 -1.112 1.00 0.00 O ATOM 85 CB ASN A 7 -9.684 -4.498 1.068 1.00 0.00 C ATOM 86 CG ASN A 7 -10.863 -4.269 2.000 1.00 0.00 C ATOM 87 OD1 ASN A 7 -10.743 -3.603 3.026 1.00 0.00 O ATOM 88 ND2 ASN A 7 -12.027 -4.791 1.630 1.00 0.00 N ATOM 0 H ASN A 7 -8.018 -6.384 1.794 1.00 0.00 H new ATOM 0 HA ASN A 7 -10.664 -6.300 0.506 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -8.756 -4.275 1.595 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -9.747 -3.807 0.227 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -12.857 -4.644 2.204 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -12.091 -5.339 0.772 1.00 0.00 H new ATOM 95 N GLU A 8 -9.886 -6.500 -1.772 1.00 0.00 N ATOM 96 CA GLU A 8 -9.476 -6.721 -3.146 1.00 0.00 C ATOM 97 C GLU A 8 -10.245 -5.793 -4.077 1.00 0.00 C ATOM 98 O GLU A 8 -11.439 -5.556 -3.881 1.00 0.00 O ATOM 99 CB GLU A 8 -9.737 -8.180 -3.521 1.00 0.00 C ATOM 100 CG GLU A 8 -9.133 -9.165 -2.532 1.00 0.00 C ATOM 101 CD GLU A 8 -9.694 -10.563 -2.671 1.00 0.00 C ATOM 102 OE1 GLU A 8 -10.767 -10.834 -2.093 1.00 0.00 O ATOM 103 OE2 GLU A 8 -9.059 -11.401 -3.341 1.00 0.00 O ATOM 0 H GLU A 8 -10.850 -6.772 -1.577 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.412 -6.507 -3.246 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -10.812 -8.347 -3.581 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -9.329 -8.373 -4.513 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.053 -9.197 -2.674 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.311 -8.808 -1.518 1.00 0.00 H new ATOM 110 N ILE A 9 -9.561 -5.259 -5.075 1.00 0.00 N ATOM 111 CA ILE A 9 -10.187 -4.349 -6.019 1.00 0.00 C ATOM 112 C ILE A 9 -9.629 -4.564 -7.428 1.00 0.00 C ATOM 113 O ILE A 9 -8.432 -4.792 -7.605 1.00 0.00 O ATOM 114 CB ILE A 9 -10.001 -2.877 -5.573 1.00 0.00 C ATOM 115 CG1 ILE A 9 -10.727 -1.921 -6.524 1.00 0.00 C ATOM 116 CG2 ILE A 9 -8.524 -2.524 -5.478 1.00 0.00 C ATOM 117 CD1 ILE A 9 -10.731 -0.482 -6.052 1.00 0.00 C ATOM 0 H ILE A 9 -8.573 -5.440 -5.252 1.00 0.00 H new ATOM 0 HA ILE A 9 -11.256 -4.563 -6.039 1.00 0.00 H new ATOM 0 HB ILE A 9 -10.442 -2.767 -4.582 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -10.256 -1.971 -7.506 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -11.757 -2.257 -6.647 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.418 -1.486 -5.163 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.040 -3.175 -4.750 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.055 -2.658 -6.453 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -11.262 0.137 -6.775 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -11.229 -0.418 -5.084 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.705 -0.128 -5.956 1.00 0.00 H new ATOM 129 N THR A 10 -10.504 -4.509 -8.421 1.00 0.00 N ATOM 130 CA THR A 10 -10.123 -4.781 -9.799 1.00 0.00 C ATOM 131 C THR A 10 -9.605 -3.518 -10.495 1.00 0.00 C ATOM 132 O THR A 10 -10.211 -2.449 -10.395 1.00 0.00 O ATOM 133 CB THR A 10 -11.327 -5.342 -10.580 1.00 0.00 C ATOM 134 OG1 THR A 10 -12.007 -6.323 -9.781 1.00 0.00 O ATOM 135 CG2 THR A 10 -10.882 -5.978 -11.887 1.00 0.00 C ATOM 0 H THR A 10 -11.489 -4.277 -8.297 1.00 0.00 H new ATOM 0 HA THR A 10 -9.320 -5.518 -9.783 1.00 0.00 H new ATOM 0 HB THR A 10 -12.000 -4.516 -10.808 1.00 0.00 H new ATOM 0 HG1 THR A 10 -12.773 -6.677 -10.279 1.00 0.00 H new ATOM 0 HG21 THR A 10 -11.752 -6.366 -12.418 1.00 0.00 H new ATOM 0 HG22 THR A 10 -10.384 -5.230 -12.504 1.00 0.00 H new ATOM 0 HG23 THR A 10 -10.191 -6.795 -11.678 1.00 0.00 H new ATOM 143 N ILE A 11 -8.470 -3.640 -11.176 1.00 0.00 N ATOM 144 CA ILE A 11 -7.904 -2.532 -11.939 1.00 0.00 C ATOM 145 C ILE A 11 -7.701 -2.965 -13.388 1.00 0.00 C ATOM 146 O ILE A 11 -7.302 -4.096 -13.644 1.00 0.00 O ATOM 147 CB ILE A 11 -6.545 -2.076 -11.359 1.00 0.00 C ATOM 148 CG1 ILE A 11 -6.624 -1.937 -9.836 1.00 0.00 C ATOM 149 CG2 ILE A 11 -6.120 -0.757 -11.987 1.00 0.00 C ATOM 150 CD1 ILE A 11 -5.305 -1.571 -9.189 1.00 0.00 C ATOM 0 H ILE A 11 -7.922 -4.499 -11.215 1.00 0.00 H new ATOM 0 HA ILE A 11 -8.601 -1.696 -11.881 1.00 0.00 H new ATOM 0 HB ILE A 11 -5.799 -2.835 -11.596 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.364 -1.176 -9.587 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.978 -2.877 -9.412 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -5.162 -0.447 -11.570 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -6.023 -0.882 -13.065 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.871 0.005 -11.776 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.439 -1.490 -8.110 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.567 -2.343 -9.406 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.959 -0.616 -9.584 1.00 0.00 H new ATOM 162 N ALA A 12 -7.968 -2.074 -14.335 1.00 0.00 N ATOM 163 CA ALA A 12 -7.811 -2.404 -15.749 1.00 0.00 C ATOM 164 C ALA A 12 -6.422 -2.021 -16.256 1.00 0.00 C ATOM 165 O ALA A 12 -6.209 -1.861 -17.458 1.00 0.00 O ATOM 166 CB ALA A 12 -8.887 -1.717 -16.575 1.00 0.00 C ATOM 0 H ALA A 12 -8.292 -1.124 -14.153 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.920 -3.483 -15.857 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -8.757 -1.972 -17.627 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -9.870 -2.048 -16.240 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -8.807 -0.637 -16.451 1.00 0.00 H new ATOM 172 N ALA A 13 -5.476 -1.898 -15.335 1.00 0.00 N ATOM 173 CA ALA A 13 -4.111 -1.537 -15.686 1.00 0.00 C ATOM 174 C ALA A 13 -3.247 -2.787 -15.842 1.00 0.00 C ATOM 175 O ALA A 13 -3.392 -3.748 -15.085 1.00 0.00 O ATOM 176 CB ALA A 13 -3.521 -0.608 -14.633 1.00 0.00 C ATOM 0 H ALA A 13 -5.630 -2.043 -14.337 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.128 -1.012 -16.641 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -2.500 -0.347 -14.910 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.123 0.299 -14.569 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.518 -1.110 -13.666 1.00 0.00 H new ATOM 182 N PRO A 14 -2.344 -2.796 -16.836 1.00 0.00 N ATOM 183 CA PRO A 14 -1.452 -3.931 -17.093 1.00 0.00 C ATOM 184 C PRO A 14 -0.481 -4.172 -15.942 1.00 0.00 C ATOM 185 O PRO A 14 -0.056 -3.227 -15.270 1.00 0.00 O ATOM 186 CB PRO A 14 -0.685 -3.523 -18.358 1.00 0.00 C ATOM 187 CG PRO A 14 -1.462 -2.394 -18.946 1.00 0.00 C ATOM 188 CD PRO A 14 -2.122 -1.702 -17.791 1.00 0.00 C ATOM 0 HA PRO A 14 -2.009 -4.861 -17.204 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.333 -3.216 -18.118 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -0.611 -4.355 -19.058 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -0.808 -1.711 -19.488 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -2.203 -2.759 -19.658 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -1.487 -0.922 -17.371 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -3.058 -1.227 -18.086 1.00 0.00 H new ATOM 196 N MET A 15 -0.125 -5.441 -15.740 1.00 0.00 N ATOM 197 CA MET A 15 0.759 -5.855 -14.645 1.00 0.00 C ATOM 198 C MET A 15 2.021 -5.003 -14.575 1.00 0.00 C ATOM 199 O MET A 15 2.453 -4.617 -13.489 1.00 0.00 O ATOM 200 CB MET A 15 1.161 -7.323 -14.810 1.00 0.00 C ATOM 201 CG MET A 15 0.030 -8.313 -14.590 1.00 0.00 C ATOM 202 SD MET A 15 -0.591 -8.308 -12.895 1.00 0.00 S ATOM 203 CE MET A 15 0.918 -8.563 -11.963 1.00 0.00 C ATOM 0 H MET A 15 -0.440 -6.212 -16.329 1.00 0.00 H new ATOM 0 HA MET A 15 0.200 -5.720 -13.719 1.00 0.00 H new ATOM 0 HB2 MET A 15 1.563 -7.466 -15.813 1.00 0.00 H new ATOM 0 HB3 MET A 15 1.965 -7.548 -14.109 1.00 0.00 H new ATOM 0 HG2 MET A 15 -0.788 -8.079 -15.272 1.00 0.00 H new ATOM 0 HG3 MET A 15 0.378 -9.315 -14.841 1.00 0.00 H new ATOM 0 HE1 MET A 15 0.675 -8.966 -10.980 1.00 0.00 H new ATOM 0 HE2 MET A 15 1.559 -9.266 -12.494 1.00 0.00 H new ATOM 0 HE3 MET A 15 1.439 -7.613 -11.847 1.00 0.00 H new ATOM 213 N GLU A 16 2.595 -4.711 -15.738 1.00 0.00 N ATOM 214 CA GLU A 16 3.843 -3.957 -15.824 1.00 0.00 C ATOM 215 C GLU A 16 3.748 -2.636 -15.075 1.00 0.00 C ATOM 216 O GLU A 16 4.571 -2.344 -14.204 1.00 0.00 O ATOM 217 CB GLU A 16 4.199 -3.675 -17.282 1.00 0.00 C ATOM 218 CG GLU A 16 4.203 -4.907 -18.164 1.00 0.00 C ATOM 219 CD GLU A 16 4.802 -4.627 -19.522 1.00 0.00 C ATOM 220 OE1 GLU A 16 4.217 -3.826 -20.277 1.00 0.00 O ATOM 221 OE2 GLU A 16 5.878 -5.187 -19.824 1.00 0.00 O ATOM 0 H GLU A 16 2.212 -4.988 -16.642 1.00 0.00 H new ATOM 0 HA GLU A 16 4.621 -4.567 -15.365 1.00 0.00 H new ATOM 0 HB2 GLU A 16 3.489 -2.954 -17.686 1.00 0.00 H new ATOM 0 HB3 GLU A 16 5.184 -3.209 -17.321 1.00 0.00 H new ATOM 0 HG2 GLU A 16 4.767 -5.701 -17.675 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.182 -5.270 -18.285 1.00 0.00 H new ATOM 228 N LEU A 17 2.735 -1.844 -15.405 1.00 0.00 N ATOM 229 CA LEU A 17 2.607 -0.517 -14.837 1.00 0.00 C ATOM 230 C LEU A 17 2.172 -0.602 -13.381 1.00 0.00 C ATOM 231 O LEU A 17 2.629 0.175 -12.548 1.00 0.00 O ATOM 232 CB LEU A 17 1.625 0.326 -15.651 1.00 0.00 C ATOM 233 CG LEU A 17 2.028 1.793 -15.815 1.00 0.00 C ATOM 234 CD1 LEU A 17 3.353 1.898 -16.557 1.00 0.00 C ATOM 235 CD2 LEU A 17 0.948 2.564 -16.552 1.00 0.00 C ATOM 0 H LEU A 17 1.996 -2.100 -16.060 1.00 0.00 H new ATOM 0 HA LEU A 17 3.581 -0.030 -14.874 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.516 -0.120 -16.640 1.00 0.00 H new ATOM 0 HB3 LEU A 17 0.646 0.283 -15.173 1.00 0.00 H new ATOM 0 HG LEU A 17 2.148 2.230 -14.824 1.00 0.00 H new ATOM 0 HD11 LEU A 17 3.627 2.947 -16.666 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.128 1.378 -15.994 1.00 0.00 H new ATOM 0 HD13 LEU A 17 3.255 1.444 -17.543 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.253 3.605 -16.659 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.798 2.127 -17.539 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.017 2.515 -15.988 1.00 0.00 H new ATOM 247 N VAL A 18 1.302 -1.560 -13.077 1.00 0.00 N ATOM 248 CA VAL A 18 0.886 -1.807 -11.699 1.00 0.00 C ATOM 249 C VAL A 18 2.097 -2.099 -10.813 1.00 0.00 C ATOM 250 O VAL A 18 2.255 -1.512 -9.738 1.00 0.00 O ATOM 251 CB VAL A 18 -0.111 -2.987 -11.612 1.00 0.00 C ATOM 252 CG1 VAL A 18 -0.464 -3.297 -10.164 1.00 0.00 C ATOM 253 CG2 VAL A 18 -1.371 -2.685 -12.407 1.00 0.00 C ATOM 0 H VAL A 18 0.871 -2.178 -13.765 1.00 0.00 H new ATOM 0 HA VAL A 18 0.388 -0.904 -11.345 1.00 0.00 H new ATOM 0 HB VAL A 18 0.371 -3.864 -12.043 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.166 -4.130 -10.131 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.441 -3.563 -9.618 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.920 -2.420 -9.705 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -2.059 -3.527 -12.333 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.848 -1.791 -12.007 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.111 -2.520 -13.453 1.00 0.00 H new ATOM 263 N TRP A 19 2.963 -2.988 -11.283 1.00 0.00 N ATOM 264 CA TRP A 19 4.143 -3.381 -10.529 1.00 0.00 C ATOM 265 C TRP A 19 5.111 -2.206 -10.393 1.00 0.00 C ATOM 266 O TRP A 19 5.499 -1.840 -9.284 1.00 0.00 O ATOM 267 CB TRP A 19 4.842 -4.567 -11.208 1.00 0.00 C ATOM 268 CG TRP A 19 5.843 -5.263 -10.327 1.00 0.00 C ATOM 269 CD1 TRP A 19 7.181 -5.004 -10.234 1.00 0.00 C ATOM 270 CD2 TRP A 19 5.581 -6.339 -9.419 1.00 0.00 C ATOM 271 NE1 TRP A 19 7.762 -5.844 -9.316 1.00 0.00 N ATOM 272 CE2 TRP A 19 6.802 -6.675 -8.804 1.00 0.00 C ATOM 273 CE3 TRP A 19 4.433 -7.047 -9.064 1.00 0.00 C ATOM 274 CZ2 TRP A 19 6.904 -7.690 -7.855 1.00 0.00 C ATOM 275 CZ3 TRP A 19 4.535 -8.053 -8.124 1.00 0.00 C ATOM 276 CH2 TRP A 19 5.762 -8.366 -7.527 1.00 0.00 C ATOM 0 H TRP A 19 2.868 -3.451 -12.187 1.00 0.00 H new ATOM 0 HA TRP A 19 3.826 -3.686 -9.532 1.00 0.00 H new ATOM 0 HB2 TRP A 19 4.089 -5.287 -11.527 1.00 0.00 H new ATOM 0 HB3 TRP A 19 5.346 -4.214 -12.108 1.00 0.00 H new ATOM 0 HD1 TRP A 19 7.706 -4.249 -10.800 1.00 0.00 H new ATOM 0 HE1 TRP A 19 8.749 -5.848 -9.058 1.00 0.00 H new ATOM 0 HE3 TRP A 19 3.481 -6.812 -9.517 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 7.850 -7.934 -7.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 3.652 -8.609 -7.844 1.00 0.00 H new ATOM 0 HH2 TRP A 19 5.807 -9.157 -6.793 1.00 0.00 H new ATOM 287 N THR A 20 5.477 -1.597 -11.515 1.00 0.00 N ATOM 288 CA THR A 20 6.485 -0.543 -11.506 1.00 0.00 C ATOM 289 C THR A 20 6.004 0.694 -10.739 1.00 0.00 C ATOM 290 O THR A 20 6.797 1.354 -10.070 1.00 0.00 O ATOM 291 CB THR A 20 6.928 -0.148 -12.942 1.00 0.00 C ATOM 292 OG1 THR A 20 8.100 0.682 -12.900 1.00 0.00 O ATOM 293 CG2 THR A 20 5.824 0.585 -13.690 1.00 0.00 C ATOM 0 H THR A 20 5.095 -1.812 -12.436 1.00 0.00 H new ATOM 0 HA THR A 20 7.353 -0.951 -10.988 1.00 0.00 H new ATOM 0 HB THR A 20 7.152 -1.073 -13.473 1.00 0.00 H new ATOM 0 HG1 THR A 20 8.365 0.920 -13.813 1.00 0.00 H new ATOM 0 HG21 THR A 20 6.172 0.844 -14.690 1.00 0.00 H new ATOM 0 HG22 THR A 20 4.947 -0.058 -13.766 1.00 0.00 H new ATOM 0 HG23 THR A 20 5.561 1.495 -13.150 1.00 0.00 H new ATOM 301 N MET A 21 4.708 0.991 -10.807 1.00 0.00 N ATOM 302 CA MET A 21 4.170 2.177 -10.145 1.00 0.00 C ATOM 303 C MET A 21 4.211 2.014 -8.632 1.00 0.00 C ATOM 304 O MET A 21 4.602 2.927 -7.911 1.00 0.00 O ATOM 305 CB MET A 21 2.733 2.445 -10.593 1.00 0.00 C ATOM 306 CG MET A 21 2.186 3.788 -10.137 1.00 0.00 C ATOM 307 SD MET A 21 3.005 5.181 -10.942 1.00 0.00 S ATOM 308 CE MET A 21 2.553 4.895 -12.653 1.00 0.00 C ATOM 0 H MET A 21 4.017 0.433 -11.309 1.00 0.00 H new ATOM 0 HA MET A 21 4.792 3.026 -10.428 1.00 0.00 H new ATOM 0 HB2 MET A 21 2.687 2.395 -11.681 1.00 0.00 H new ATOM 0 HB3 MET A 21 2.090 1.653 -10.210 1.00 0.00 H new ATOM 0 HG2 MET A 21 1.117 3.830 -10.345 1.00 0.00 H new ATOM 0 HG3 MET A 21 2.304 3.877 -9.057 1.00 0.00 H new ATOM 0 HE1 MET A 21 2.614 5.832 -13.207 1.00 0.00 H new ATOM 0 HE2 MET A 21 3.236 4.168 -13.093 1.00 0.00 H new ATOM 0 HE3 MET A 21 1.534 4.511 -12.701 1.00 0.00 H new ATOM 318 N THR A 22 3.822 0.840 -8.156 1.00 0.00 N ATOM 319 CA THR A 22 3.786 0.582 -6.725 1.00 0.00 C ATOM 320 C THR A 22 5.191 0.390 -6.156 1.00 0.00 C ATOM 321 O THR A 22 5.402 0.513 -4.951 1.00 0.00 O ATOM 322 CB THR A 22 2.912 -0.644 -6.396 1.00 0.00 C ATOM 323 OG1 THR A 22 3.302 -1.768 -7.202 1.00 0.00 O ATOM 324 CG2 THR A 22 1.438 -0.332 -6.623 1.00 0.00 C ATOM 0 H THR A 22 3.528 0.055 -8.737 1.00 0.00 H new ATOM 0 HA THR A 22 3.341 1.459 -6.256 1.00 0.00 H new ATOM 0 HB THR A 22 3.059 -0.892 -5.345 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.825 -1.738 -8.057 1.00 0.00 H new ATOM 0 HG21 THR A 22 0.839 -1.211 -6.385 1.00 0.00 H new ATOM 0 HG22 THR A 22 1.138 0.496 -5.981 1.00 0.00 H new ATOM 0 HG23 THR A 22 1.281 -0.058 -7.666 1.00 0.00 H new ATOM 332 N ASN A 23 6.149 0.087 -7.029 1.00 0.00 N ATOM 333 CA ASN A 23 7.546 -0.036 -6.618 1.00 0.00 C ATOM 334 C ASN A 23 8.203 1.332 -6.540 1.00 0.00 C ATOM 335 O ASN A 23 9.190 1.518 -5.828 1.00 0.00 O ATOM 336 CB ASN A 23 8.336 -0.933 -7.577 1.00 0.00 C ATOM 337 CG ASN A 23 8.246 -2.405 -7.214 1.00 0.00 C ATOM 338 OD1 ASN A 23 9.057 -2.918 -6.445 1.00 0.00 O ATOM 339 ND2 ASN A 23 7.255 -3.096 -7.748 1.00 0.00 N ATOM 0 H ASN A 23 5.985 -0.077 -8.022 1.00 0.00 H new ATOM 0 HA ASN A 23 7.555 -0.497 -5.630 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.963 -0.790 -8.591 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.382 -0.626 -7.576 1.00 0.00 H new ATOM 0 HD21 ASN A 23 7.145 -4.085 -7.526 1.00 0.00 H new ATOM 0 HD22 ASN A 23 6.599 -2.640 -8.382 1.00 0.00 H new ATOM 346 N ASP A 24 7.649 2.290 -7.270 1.00 0.00 N ATOM 347 CA ASP A 24 8.173 3.646 -7.262 1.00 0.00 C ATOM 348 C ASP A 24 7.569 4.413 -6.100 1.00 0.00 C ATOM 349 O ASP A 24 6.595 5.150 -6.256 1.00 0.00 O ATOM 350 CB ASP A 24 7.866 4.362 -8.575 1.00 0.00 C ATOM 351 CG ASP A 24 8.800 5.525 -8.837 1.00 0.00 C ATOM 352 OD1 ASP A 24 9.051 6.335 -7.920 1.00 0.00 O ATOM 353 OD2 ASP A 24 9.279 5.643 -9.983 1.00 0.00 O ATOM 0 H ASP A 24 6.838 2.153 -7.874 1.00 0.00 H new ATOM 0 HA ASP A 24 9.256 3.599 -7.149 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.938 3.651 -9.398 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.838 4.724 -8.555 1.00 0.00 H new ATOM 358 N ILE A 25 8.146 4.211 -4.929 1.00 0.00 N ATOM 359 CA ILE A 25 7.617 4.771 -3.696 1.00 0.00 C ATOM 360 C ILE A 25 7.761 6.290 -3.653 1.00 0.00 C ATOM 361 O ILE A 25 7.118 6.962 -2.849 1.00 0.00 O ATOM 362 CB ILE A 25 8.312 4.146 -2.470 1.00 0.00 C ATOM 363 CG1 ILE A 25 9.810 4.451 -2.481 1.00 0.00 C ATOM 364 CG2 ILE A 25 8.083 2.640 -2.445 1.00 0.00 C ATOM 365 CD1 ILE A 25 10.544 3.862 -1.300 1.00 0.00 C ATOM 0 H ILE A 25 8.993 3.656 -4.805 1.00 0.00 H new ATOM 0 HA ILE A 25 6.554 4.532 -3.667 1.00 0.00 H new ATOM 0 HB ILE A 25 7.879 4.585 -1.571 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.247 4.064 -3.402 1.00 0.00 H new ATOM 0 HG13 ILE A 25 9.955 5.531 -2.489 1.00 0.00 H new ATOM 0 HG21 ILE A 25 8.579 2.211 -1.574 1.00 0.00 H new ATOM 0 HG22 ILE A 25 7.014 2.435 -2.391 1.00 0.00 H new ATOM 0 HG23 ILE A 25 8.492 2.195 -3.352 1.00 0.00 H new ATOM 0 HD11 ILE A 25 11.602 4.114 -1.367 1.00 0.00 H new ATOM 0 HD12 ILE A 25 10.132 4.268 -0.376 1.00 0.00 H new ATOM 0 HD13 ILE A 25 10.428 2.778 -1.303 1.00 0.00 H new ATOM 377 N GLU A 26 8.576 6.832 -4.544 1.00 0.00 N ATOM 378 CA GLU A 26 8.845 8.260 -4.551 1.00 0.00 C ATOM 379 C GLU A 26 7.654 9.044 -5.090 1.00 0.00 C ATOM 380 O GLU A 26 7.558 10.255 -4.894 1.00 0.00 O ATOM 381 CB GLU A 26 10.090 8.562 -5.380 1.00 0.00 C ATOM 382 CG GLU A 26 11.346 7.886 -4.862 1.00 0.00 C ATOM 383 CD GLU A 26 12.581 8.332 -5.608 1.00 0.00 C ATOM 384 OE1 GLU A 26 12.905 7.723 -6.649 1.00 0.00 O ATOM 385 OE2 GLU A 26 13.224 9.308 -5.167 1.00 0.00 O ATOM 0 H GLU A 26 9.062 6.305 -5.270 1.00 0.00 H new ATOM 0 HA GLU A 26 9.019 8.572 -3.521 1.00 0.00 H new ATOM 0 HB2 GLU A 26 9.916 8.247 -6.409 1.00 0.00 H new ATOM 0 HB3 GLU A 26 10.250 9.640 -5.400 1.00 0.00 H new ATOM 0 HG2 GLU A 26 11.465 8.107 -3.801 1.00 0.00 H new ATOM 0 HG3 GLU A 26 11.239 6.805 -4.953 1.00 0.00 H new ATOM 392 N LYS A 27 6.740 8.352 -5.756 1.00 0.00 N ATOM 393 CA LYS A 27 5.564 9.001 -6.322 1.00 0.00 C ATOM 394 C LYS A 27 4.327 8.742 -5.472 1.00 0.00 C ATOM 395 O LYS A 27 3.233 9.196 -5.803 1.00 0.00 O ATOM 396 CB LYS A 27 5.322 8.545 -7.764 1.00 0.00 C ATOM 397 CG LYS A 27 6.057 9.387 -8.799 1.00 0.00 C ATOM 398 CD LYS A 27 5.724 8.945 -10.215 1.00 0.00 C ATOM 399 CE LYS A 27 6.404 7.634 -10.566 1.00 0.00 C ATOM 400 NZ LYS A 27 7.875 7.802 -10.705 1.00 0.00 N ATOM 0 H LYS A 27 6.789 7.346 -5.918 1.00 0.00 H new ATOM 0 HA LYS A 27 5.756 10.074 -6.328 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.634 7.505 -7.865 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.253 8.579 -7.973 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.790 10.436 -8.672 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.132 9.309 -8.636 1.00 0.00 H new ATOM 0 HD2 LYS A 27 4.645 8.834 -10.318 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.034 9.716 -10.920 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.193 6.895 -9.793 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.991 7.247 -11.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 8.321 6.870 -10.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 8.080 8.395 -11.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 8.255 8.258 -9.851 1.00 0.00 H new ATOM 414 N TRP A 28 4.512 8.036 -4.363 1.00 0.00 N ATOM 415 CA TRP A 28 3.410 7.733 -3.451 1.00 0.00 C ATOM 416 C TRP A 28 2.693 8.996 -2.945 1.00 0.00 C ATOM 417 O TRP A 28 1.468 9.008 -2.900 1.00 0.00 O ATOM 418 CB TRP A 28 3.891 6.891 -2.267 1.00 0.00 C ATOM 419 CG TRP A 28 4.120 5.452 -2.609 1.00 0.00 C ATOM 420 CD1 TRP A 28 4.095 4.886 -3.853 1.00 0.00 C ATOM 421 CD2 TRP A 28 4.404 4.390 -1.691 1.00 0.00 C ATOM 422 NE1 TRP A 28 4.353 3.542 -3.765 1.00 0.00 N ATOM 423 CE2 TRP A 28 4.543 3.212 -2.448 1.00 0.00 C ATOM 424 CE3 TRP A 28 4.555 4.321 -0.304 1.00 0.00 C ATOM 425 CZ2 TRP A 28 4.828 1.983 -1.866 1.00 0.00 C ATOM 426 CZ3 TRP A 28 4.839 3.099 0.273 1.00 0.00 C ATOM 427 CH2 TRP A 28 4.973 1.944 -0.507 1.00 0.00 C ATOM 0 H TRP A 28 5.415 7.661 -4.071 1.00 0.00 H new ATOM 0 HA TRP A 28 2.686 7.157 -4.027 1.00 0.00 H new ATOM 0 HB2 TRP A 28 4.818 7.316 -1.882 1.00 0.00 H new ATOM 0 HB3 TRP A 28 3.155 6.953 -1.465 1.00 0.00 H new ATOM 0 HD1 TRP A 28 3.900 5.420 -4.772 1.00 0.00 H new ATOM 0 HE1 TRP A 28 4.396 2.894 -4.551 1.00 0.00 H new ATOM 0 HE3 TRP A 28 4.452 5.207 0.305 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 4.931 1.091 -2.465 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.960 3.033 1.344 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.195 1.003 -0.025 1.00 0.00 H new ATOM 438 N PRO A 29 3.417 10.078 -2.555 1.00 0.00 N ATOM 439 CA PRO A 29 2.778 11.338 -2.122 1.00 0.00 C ATOM 440 C PRO A 29 1.852 11.945 -3.185 1.00 0.00 C ATOM 441 O PRO A 29 1.031 12.809 -2.881 1.00 0.00 O ATOM 442 CB PRO A 29 3.964 12.272 -1.858 1.00 0.00 C ATOM 443 CG PRO A 29 5.109 11.364 -1.583 1.00 0.00 C ATOM 444 CD PRO A 29 4.890 10.162 -2.453 1.00 0.00 C ATOM 0 HA PRO A 29 2.136 11.176 -1.256 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.164 12.911 -2.718 1.00 0.00 H new ATOM 0 HB3 PRO A 29 3.769 12.930 -1.011 1.00 0.00 H new ATOM 0 HG2 PRO A 29 6.058 11.848 -1.815 1.00 0.00 H new ATOM 0 HG3 PRO A 29 5.143 11.084 -0.530 1.00 0.00 H new ATOM 0 HD2 PRO A 29 5.354 10.284 -3.432 1.00 0.00 H new ATOM 0 HD3 PRO A 29 5.314 9.262 -2.009 1.00 0.00 H new ATOM 452 N GLY A 30 1.985 11.489 -4.427 1.00 0.00 N ATOM 453 CA GLY A 30 1.136 11.984 -5.497 1.00 0.00 C ATOM 454 C GLY A 30 -0.151 11.190 -5.618 1.00 0.00 C ATOM 455 O GLY A 30 -1.047 11.541 -6.391 1.00 0.00 O ATOM 0 H GLY A 30 2.666 10.785 -4.712 1.00 0.00 H new ATOM 0 HA2 GLY A 30 0.899 13.032 -5.316 1.00 0.00 H new ATOM 0 HA3 GLY A 30 1.679 11.939 -6.441 1.00 0.00 H new ATOM 459 N LEU A 31 -0.231 10.102 -4.862 1.00 0.00 N ATOM 460 CA LEU A 31 -1.424 9.263 -4.836 1.00 0.00 C ATOM 461 C LEU A 31 -2.013 9.227 -3.428 1.00 0.00 C ATOM 462 O LEU A 31 -3.228 9.261 -3.246 1.00 0.00 O ATOM 463 CB LEU A 31 -1.110 7.828 -5.297 1.00 0.00 C ATOM 464 CG LEU A 31 -0.835 7.637 -6.797 1.00 0.00 C ATOM 465 CD1 LEU A 31 0.538 8.165 -7.182 1.00 0.00 C ATOM 466 CD2 LEU A 31 -0.964 6.169 -7.173 1.00 0.00 C ATOM 0 H LEU A 31 0.522 9.778 -4.255 1.00 0.00 H new ATOM 0 HA LEU A 31 -2.149 9.696 -5.525 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.241 7.473 -4.743 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.948 7.189 -5.019 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.578 8.211 -7.350 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.700 8.014 -8.249 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.596 9.229 -6.953 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.304 7.631 -6.620 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.767 6.048 -8.238 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.245 5.582 -6.602 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.973 5.823 -6.949 1.00 0.00 H new ATOM 478 N PHE A 32 -1.140 9.162 -2.435 1.00 0.00 N ATOM 479 CA PHE A 32 -1.559 9.075 -1.048 1.00 0.00 C ATOM 480 C PHE A 32 -1.437 10.421 -0.349 1.00 0.00 C ATOM 481 O PHE A 32 -0.335 10.916 -0.119 1.00 0.00 O ATOM 482 CB PHE A 32 -0.727 8.032 -0.304 1.00 0.00 C ATOM 483 CG PHE A 32 -1.525 6.840 0.124 1.00 0.00 C ATOM 484 CD1 PHE A 32 -2.576 6.989 1.008 1.00 0.00 C ATOM 485 CD2 PHE A 32 -1.228 5.575 -0.357 1.00 0.00 C ATOM 486 CE1 PHE A 32 -3.319 5.902 1.408 1.00 0.00 C ATOM 487 CE2 PHE A 32 -1.970 4.479 0.041 1.00 0.00 C ATOM 488 CZ PHE A 32 -3.017 4.643 0.925 1.00 0.00 C ATOM 0 H PHE A 32 -0.129 9.168 -2.568 1.00 0.00 H new ATOM 0 HA PHE A 32 -2.607 8.775 -1.038 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.090 7.703 -0.946 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -0.277 8.494 0.574 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -2.817 7.970 1.390 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -0.409 5.444 -1.049 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.138 6.033 2.099 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -1.731 3.497 -0.339 1.00 0.00 H new ATOM 0 HZ PHE A 32 -3.599 3.789 1.239 1.00 0.00 H new ATOM 498 N SER A 33 -2.579 10.993 0.003 1.00 0.00 N ATOM 499 CA SER A 33 -2.622 12.269 0.706 1.00 0.00 C ATOM 500 C SER A 33 -2.389 12.074 2.203 1.00 0.00 C ATOM 501 O SER A 33 -2.271 13.038 2.958 1.00 0.00 O ATOM 502 CB SER A 33 -3.980 12.930 0.476 1.00 0.00 C ATOM 503 OG SER A 33 -4.231 13.112 -0.907 1.00 0.00 O ATOM 0 H SER A 33 -3.496 10.590 -0.188 1.00 0.00 H new ATOM 0 HA SER A 33 -1.830 12.908 0.317 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.766 12.315 0.914 1.00 0.00 H new ATOM 0 HB3 SER A 33 -4.010 13.894 0.984 1.00 0.00 H new ATOM 0 HG SER A 33 -5.107 13.535 -1.028 1.00 0.00 H new ATOM 509 N GLU A 34 -2.317 10.815 2.615 1.00 0.00 N ATOM 510 CA GLU A 34 -2.191 10.465 4.023 1.00 0.00 C ATOM 511 C GLU A 34 -0.771 10.731 4.526 1.00 0.00 C ATOM 512 O GLU A 34 -0.544 10.909 5.723 1.00 0.00 O ATOM 513 CB GLU A 34 -2.558 8.990 4.210 1.00 0.00 C ATOM 514 CG GLU A 34 -2.716 8.562 5.658 1.00 0.00 C ATOM 515 CD GLU A 34 -3.116 7.107 5.787 1.00 0.00 C ATOM 516 OE1 GLU A 34 -4.295 6.787 5.512 1.00 0.00 O ATOM 517 OE2 GLU A 34 -2.259 6.280 6.170 1.00 0.00 O ATOM 0 H GLU A 34 -2.344 10.012 1.986 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.872 11.085 4.606 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.490 8.790 3.681 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.788 8.375 3.744 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.778 8.727 6.188 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.468 9.187 6.139 1.00 0.00 H new ATOM 524 N TYR A 35 0.177 10.776 3.601 1.00 0.00 N ATOM 525 CA TYR A 35 1.577 10.952 3.953 1.00 0.00 C ATOM 526 C TYR A 35 2.091 12.270 3.399 1.00 0.00 C ATOM 527 O TYR A 35 1.379 12.961 2.671 1.00 0.00 O ATOM 528 CB TYR A 35 2.407 9.780 3.416 1.00 0.00 C ATOM 529 CG TYR A 35 1.779 8.435 3.711 1.00 0.00 C ATOM 530 CD1 TYR A 35 1.634 7.986 5.017 1.00 0.00 C ATOM 531 CD2 TYR A 35 1.305 7.628 2.685 1.00 0.00 C ATOM 532 CE1 TYR A 35 1.032 6.774 5.293 1.00 0.00 C ATOM 533 CE2 TYR A 35 0.706 6.411 2.953 1.00 0.00 C ATOM 534 CZ TYR A 35 0.569 5.990 4.258 1.00 0.00 C ATOM 535 OH TYR A 35 -0.038 4.784 4.529 1.00 0.00 O ATOM 0 H TYR A 35 0.001 10.693 2.600 1.00 0.00 H new ATOM 0 HA TYR A 35 1.671 10.972 5.039 1.00 0.00 H new ATOM 0 HB2 TYR A 35 2.529 9.891 2.339 1.00 0.00 H new ATOM 0 HB3 TYR A 35 3.404 9.815 3.855 1.00 0.00 H new ATOM 0 HD1 TYR A 35 1.998 8.595 5.831 1.00 0.00 H new ATOM 0 HD2 TYR A 35 1.406 7.956 1.661 1.00 0.00 H new ATOM 0 HE1 TYR A 35 0.924 6.442 6.315 1.00 0.00 H new ATOM 0 HE2 TYR A 35 0.347 5.793 2.143 1.00 0.00 H new ATOM 0 HH TYR A 35 -0.836 4.935 5.077 1.00 0.00 H new ATOM 545 N ALA A 36 3.312 12.629 3.759 1.00 0.00 N ATOM 546 CA ALA A 36 3.899 13.876 3.295 1.00 0.00 C ATOM 547 C ALA A 36 5.202 13.626 2.550 1.00 0.00 C ATOM 548 O ALA A 36 5.545 14.351 1.618 1.00 0.00 O ATOM 549 CB ALA A 36 4.129 14.826 4.461 1.00 0.00 C ATOM 0 H ALA A 36 3.915 12.077 4.369 1.00 0.00 H new ATOM 0 HA ALA A 36 3.196 14.338 2.602 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.569 15.753 4.094 1.00 0.00 H new ATOM 0 HB2 ALA A 36 3.178 15.043 4.947 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.806 14.363 5.179 1.00 0.00 H new ATOM 555 N SER A 37 5.942 12.607 2.967 1.00 0.00 N ATOM 556 CA SER A 37 7.201 12.269 2.322 1.00 0.00 C ATOM 557 C SER A 37 7.471 10.771 2.398 1.00 0.00 C ATOM 558 O SER A 37 7.181 10.127 3.406 1.00 0.00 O ATOM 559 CB SER A 37 8.352 13.045 2.969 1.00 0.00 C ATOM 560 OG SER A 37 8.132 14.442 2.875 1.00 0.00 O ATOM 0 H SER A 37 5.691 12.001 3.749 1.00 0.00 H new ATOM 0 HA SER A 37 7.129 12.549 1.271 1.00 0.00 H new ATOM 0 HB2 SER A 37 8.448 12.757 4.016 1.00 0.00 H new ATOM 0 HB3 SER A 37 9.291 12.786 2.480 1.00 0.00 H new ATOM 0 HG SER A 37 8.877 14.920 3.295 1.00 0.00 H new ATOM 566 N VAL A 38 8.004 10.226 1.315 1.00 0.00 N ATOM 567 CA VAL A 38 8.410 8.832 1.268 1.00 0.00 C ATOM 568 C VAL A 38 9.895 8.761 0.944 1.00 0.00 C ATOM 569 O VAL A 38 10.301 8.956 -0.202 1.00 0.00 O ATOM 570 CB VAL A 38 7.604 8.036 0.219 1.00 0.00 C ATOM 571 CG1 VAL A 38 8.046 6.581 0.181 1.00 0.00 C ATOM 572 CG2 VAL A 38 6.112 8.132 0.504 1.00 0.00 C ATOM 0 H VAL A 38 8.166 10.737 0.447 1.00 0.00 H new ATOM 0 HA VAL A 38 8.213 8.382 2.241 1.00 0.00 H new ATOM 0 HB VAL A 38 7.799 8.475 -0.759 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.462 6.043 -0.566 1.00 0.00 H new ATOM 0 HG12 VAL A 38 9.104 6.529 -0.078 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.889 6.127 1.160 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.561 7.565 -0.246 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.904 7.724 1.493 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.801 9.176 0.469 1.00 0.00 H new ATOM 582 N GLU A 39 10.698 8.516 1.965 1.00 0.00 N ATOM 583 CA GLU A 39 12.146 8.591 1.836 1.00 0.00 C ATOM 584 C GLU A 39 12.761 7.204 1.701 1.00 0.00 C ATOM 585 O GLU A 39 12.531 6.331 2.537 1.00 0.00 O ATOM 586 CB GLU A 39 12.724 9.315 3.050 1.00 0.00 C ATOM 587 CG GLU A 39 12.132 10.701 3.244 1.00 0.00 C ATOM 588 CD GLU A 39 12.631 11.387 4.495 1.00 0.00 C ATOM 589 OE1 GLU A 39 13.822 11.760 4.534 1.00 0.00 O ATOM 590 OE2 GLU A 39 11.832 11.582 5.432 1.00 0.00 O ATOM 0 H GLU A 39 10.371 8.262 2.897 1.00 0.00 H new ATOM 0 HA GLU A 39 12.388 9.147 0.930 1.00 0.00 H new ATOM 0 HB2 GLU A 39 12.542 8.719 3.944 1.00 0.00 H new ATOM 0 HB3 GLU A 39 13.805 9.399 2.937 1.00 0.00 H new ATOM 0 HG2 GLU A 39 12.373 11.317 2.378 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.046 10.623 3.288 1.00 0.00 H new ATOM 597 N VAL A 40 13.549 7.010 0.653 1.00 0.00 N ATOM 598 CA VAL A 40 14.173 5.719 0.395 1.00 0.00 C ATOM 599 C VAL A 40 15.467 5.602 1.191 1.00 0.00 C ATOM 600 O VAL A 40 16.484 6.190 0.825 1.00 0.00 O ATOM 601 CB VAL A 40 14.489 5.517 -1.107 1.00 0.00 C ATOM 602 CG1 VAL A 40 14.750 4.045 -1.418 1.00 0.00 C ATOM 603 CG2 VAL A 40 13.370 6.070 -1.980 1.00 0.00 C ATOM 0 H VAL A 40 13.772 7.731 -0.033 1.00 0.00 H new ATOM 0 HA VAL A 40 13.465 4.950 0.702 1.00 0.00 H new ATOM 0 HB VAL A 40 15.398 6.074 -1.336 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.969 3.931 -2.480 1.00 0.00 H new ATOM 0 HG12 VAL A 40 15.600 3.694 -0.832 1.00 0.00 H new ATOM 0 HG13 VAL A 40 13.867 3.458 -1.165 1.00 0.00 H new ATOM 0 HG21 VAL A 40 13.618 5.915 -3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 40 12.438 5.555 -1.747 1.00 0.00 H new ATOM 0 HG23 VAL A 40 13.252 7.137 -1.788 1.00 0.00 H new ATOM 613 N LEU A 41 15.418 4.868 2.293 1.00 0.00 N ATOM 614 CA LEU A 41 16.591 4.687 3.138 1.00 0.00 C ATOM 615 C LEU A 41 17.609 3.807 2.430 1.00 0.00 C ATOM 616 O LEU A 41 18.807 4.093 2.423 1.00 0.00 O ATOM 617 CB LEU A 41 16.197 4.059 4.477 1.00 0.00 C ATOM 618 CG LEU A 41 15.207 4.871 5.312 1.00 0.00 C ATOM 619 CD1 LEU A 41 14.867 4.129 6.593 1.00 0.00 C ATOM 620 CD2 LEU A 41 15.777 6.246 5.630 1.00 0.00 C ATOM 0 H LEU A 41 14.580 4.389 2.623 1.00 0.00 H new ATOM 0 HA LEU A 41 17.035 5.664 3.331 1.00 0.00 H new ATOM 0 HB2 LEU A 41 15.766 3.076 4.286 1.00 0.00 H new ATOM 0 HB3 LEU A 41 17.101 3.902 5.066 1.00 0.00 H new ATOM 0 HG LEU A 41 14.293 5.004 4.733 1.00 0.00 H new ATOM 0 HD11 LEU A 41 14.161 4.718 7.178 1.00 0.00 H new ATOM 0 HD12 LEU A 41 14.420 3.166 6.348 1.00 0.00 H new ATOM 0 HD13 LEU A 41 15.776 3.970 7.173 1.00 0.00 H new ATOM 0 HD21 LEU A 41 15.058 6.809 6.225 1.00 0.00 H new ATOM 0 HD22 LEU A 41 16.704 6.134 6.192 1.00 0.00 H new ATOM 0 HD23 LEU A 41 15.977 6.780 4.701 1.00 0.00 H new ATOM 632 N GLY A 42 17.116 2.739 1.829 1.00 0.00 N ATOM 633 CA GLY A 42 17.964 1.861 1.063 1.00 0.00 C ATOM 634 C GLY A 42 17.158 0.837 0.303 1.00 0.00 C ATOM 635 O GLY A 42 16.025 0.528 0.679 1.00 0.00 O ATOM 0 H GLY A 42 16.134 2.464 1.860 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.560 2.448 0.364 1.00 0.00 H new ATOM 0 HA3 GLY A 42 18.662 1.354 1.730 1.00 0.00 H new ATOM 639 N ARG A 43 17.727 0.318 -0.767 1.00 0.00 N ATOM 640 CA ARG A 43 17.061 -0.709 -1.540 1.00 0.00 C ATOM 641 C ARG A 43 17.914 -1.965 -1.601 1.00 0.00 C ATOM 642 O ARG A 43 18.952 -2.000 -2.262 1.00 0.00 O ATOM 643 CB ARG A 43 16.742 -0.214 -2.950 1.00 0.00 C ATOM 644 CG ARG A 43 15.949 -1.221 -3.766 1.00 0.00 C ATOM 645 CD ARG A 43 15.631 -0.702 -5.155 1.00 0.00 C ATOM 646 NE ARG A 43 14.851 -1.669 -5.923 1.00 0.00 N ATOM 647 CZ ARG A 43 14.716 -1.634 -7.250 1.00 0.00 C ATOM 648 NH1 ARG A 43 15.301 -0.678 -7.960 1.00 0.00 N ATOM 649 NH2 ARG A 43 14.002 -2.565 -7.870 1.00 0.00 N ATOM 0 H ARG A 43 18.645 0.590 -1.119 1.00 0.00 H new ATOM 0 HA ARG A 43 16.121 -0.948 -1.044 1.00 0.00 H new ATOM 0 HB2 ARG A 43 16.178 0.717 -2.884 1.00 0.00 H new ATOM 0 HB3 ARG A 43 17.673 0.014 -3.469 1.00 0.00 H new ATOM 0 HG2 ARG A 43 16.515 -2.149 -3.847 1.00 0.00 H new ATOM 0 HG3 ARG A 43 15.021 -1.458 -3.246 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.077 0.234 -5.077 1.00 0.00 H new ATOM 0 HD3 ARG A 43 16.559 -0.480 -5.683 1.00 0.00 H new ATOM 0 HE ARG A 43 14.381 -2.417 -5.414 1.00 0.00 H new ATOM 0 HH11 ARG A 43 15.858 0.036 -7.492 1.00 0.00 H new ATOM 0 HH12 ARG A 43 15.193 -0.658 -8.974 1.00 0.00 H new ATOM 0 HH21 ARG A 43 13.556 -3.308 -7.332 1.00 0.00 H new ATOM 0 HH22 ARG A 43 13.899 -2.538 -8.884 1.00 0.00 H new ATOM 663 N ASP A 44 17.467 -2.990 -0.900 1.00 0.00 N ATOM 664 CA ASP A 44 18.150 -4.269 -0.886 1.00 0.00 C ATOM 665 C ASP A 44 17.555 -5.171 -1.962 1.00 0.00 C ATOM 666 O ASP A 44 17.021 -6.244 -1.674 1.00 0.00 O ATOM 667 CB ASP A 44 18.034 -4.909 0.501 1.00 0.00 C ATOM 668 CG ASP A 44 18.825 -6.195 0.626 1.00 0.00 C ATOM 669 OD1 ASP A 44 20.049 -6.172 0.379 1.00 0.00 O ATOM 670 OD2 ASP A 44 18.232 -7.229 0.998 1.00 0.00 O ATOM 0 H ASP A 44 16.624 -2.960 -0.327 1.00 0.00 H new ATOM 0 HA ASP A 44 19.209 -4.125 -1.101 1.00 0.00 H new ATOM 0 HB2 ASP A 44 18.382 -4.200 1.253 1.00 0.00 H new ATOM 0 HB3 ASP A 44 16.985 -5.112 0.715 1.00 0.00 H new ATOM 675 N ASP A 45 17.630 -4.686 -3.204 1.00 0.00 N ATOM 676 CA ASP A 45 17.093 -5.378 -4.381 1.00 0.00 C ATOM 677 C ASP A 45 15.592 -5.612 -4.261 1.00 0.00 C ATOM 678 O ASP A 45 14.792 -4.818 -4.762 1.00 0.00 O ATOM 679 CB ASP A 45 17.825 -6.702 -4.630 1.00 0.00 C ATOM 680 CG ASP A 45 19.272 -6.492 -5.025 1.00 0.00 C ATOM 681 OD1 ASP A 45 19.527 -6.054 -6.169 1.00 0.00 O ATOM 682 OD2 ASP A 45 20.165 -6.750 -4.188 1.00 0.00 O ATOM 0 H ASP A 45 18.070 -3.792 -3.424 1.00 0.00 H new ATOM 0 HA ASP A 45 17.262 -4.727 -5.239 1.00 0.00 H new ATOM 0 HB2 ASP A 45 17.782 -7.314 -3.729 1.00 0.00 H new ATOM 0 HB3 ASP A 45 17.312 -7.256 -5.417 1.00 0.00 H new ATOM 687 N ASP A 46 15.218 -6.687 -3.583 1.00 0.00 N ATOM 688 CA ASP A 46 13.813 -7.035 -3.401 1.00 0.00 C ATOM 689 C ASP A 46 13.189 -6.180 -2.311 1.00 0.00 C ATOM 690 O ASP A 46 12.021 -5.799 -2.394 1.00 0.00 O ATOM 691 CB ASP A 46 13.654 -8.513 -3.037 1.00 0.00 C ATOM 692 CG ASP A 46 14.147 -9.444 -4.122 1.00 0.00 C ATOM 693 OD1 ASP A 46 13.366 -9.756 -5.044 1.00 0.00 O ATOM 694 OD2 ASP A 46 15.317 -9.881 -4.055 1.00 0.00 O ATOM 0 H ASP A 46 15.871 -7.338 -3.147 1.00 0.00 H new ATOM 0 HA ASP A 46 13.303 -6.848 -4.346 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.200 -8.716 -2.116 1.00 0.00 H new ATOM 0 HB3 ASP A 46 12.603 -8.721 -2.837 1.00 0.00 H new ATOM 699 N LYS A 47 13.973 -5.887 -1.286 1.00 0.00 N ATOM 700 CA LYS A 47 13.501 -5.082 -0.171 1.00 0.00 C ATOM 701 C LYS A 47 13.739 -3.604 -0.414 1.00 0.00 C ATOM 702 O LYS A 47 14.877 -3.145 -0.415 1.00 0.00 O ATOM 703 CB LYS A 47 14.206 -5.471 1.126 1.00 0.00 C ATOM 704 CG LYS A 47 13.631 -6.685 1.821 1.00 0.00 C ATOM 705 CD LYS A 47 14.201 -6.801 3.222 1.00 0.00 C ATOM 706 CE LYS A 47 13.501 -7.867 4.039 1.00 0.00 C ATOM 707 NZ LYS A 47 13.935 -7.829 5.458 1.00 0.00 N ATOM 0 H LYS A 47 14.942 -6.196 -1.203 1.00 0.00 H new ATOM 0 HA LYS A 47 12.431 -5.270 -0.083 1.00 0.00 H new ATOM 0 HB2 LYS A 47 15.258 -5.658 0.909 1.00 0.00 H new ATOM 0 HB3 LYS A 47 14.167 -4.625 1.812 1.00 0.00 H new ATOM 0 HG2 LYS A 47 12.545 -6.607 1.867 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.862 -7.584 1.250 1.00 0.00 H new ATOM 0 HD2 LYS A 47 15.264 -7.032 3.162 1.00 0.00 H new ATOM 0 HD3 LYS A 47 14.112 -5.840 3.729 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.422 -7.722 3.982 1.00 0.00 H new ATOM 0 HE3 LYS A 47 13.713 -8.850 3.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 13.164 -8.170 6.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 14.769 -8.438 5.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.177 -6.852 5.721 1.00 0.00 H new ATOM 721 N VAL A 48 12.676 -2.854 -0.607 1.00 0.00 N ATOM 722 CA VAL A 48 12.798 -1.413 -0.645 1.00 0.00 C ATOM 723 C VAL A 48 12.409 -0.845 0.718 1.00 0.00 C ATOM 724 O VAL A 48 11.241 -0.849 1.111 1.00 0.00 O ATOM 725 CB VAL A 48 11.982 -0.768 -1.797 1.00 0.00 C ATOM 726 CG1 VAL A 48 10.507 -1.128 -1.725 1.00 0.00 C ATOM 727 CG2 VAL A 48 12.169 0.742 -1.802 1.00 0.00 C ATOM 0 H VAL A 48 11.730 -3.211 -0.738 1.00 0.00 H new ATOM 0 HA VAL A 48 13.837 -1.162 -0.857 1.00 0.00 H new ATOM 0 HB VAL A 48 12.365 -1.173 -2.734 1.00 0.00 H new ATOM 0 HG11 VAL A 48 9.976 -0.654 -2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 48 10.393 -2.210 -1.793 1.00 0.00 H new ATOM 0 HG13 VAL A 48 10.093 -0.778 -0.779 1.00 0.00 H new ATOM 0 HG21 VAL A 48 11.590 1.178 -2.616 1.00 0.00 H new ATOM 0 HG22 VAL A 48 11.827 1.154 -0.853 1.00 0.00 H new ATOM 0 HG23 VAL A 48 13.224 0.977 -1.941 1.00 0.00 H new ATOM 737 N THR A 49 13.414 -0.416 1.462 1.00 0.00 N ATOM 738 CA THR A 49 13.215 0.061 2.818 1.00 0.00 C ATOM 739 C THR A 49 13.064 1.575 2.825 1.00 0.00 C ATOM 740 O THR A 49 13.975 2.305 2.423 1.00 0.00 O ATOM 741 CB THR A 49 14.390 -0.361 3.721 1.00 0.00 C ATOM 742 OG1 THR A 49 14.628 -1.768 3.563 1.00 0.00 O ATOM 743 CG2 THR A 49 14.094 -0.055 5.181 1.00 0.00 C ATOM 0 H THR A 49 14.383 -0.389 1.146 1.00 0.00 H new ATOM 0 HA THR A 49 12.302 -0.387 3.210 1.00 0.00 H new ATOM 0 HB THR A 49 15.275 0.203 3.426 1.00 0.00 H new ATOM 0 HG1 THR A 49 15.376 -2.039 4.135 1.00 0.00 H new ATOM 0 HG21 THR A 49 14.940 -0.363 5.796 1.00 0.00 H new ATOM 0 HG22 THR A 49 13.928 1.015 5.302 1.00 0.00 H new ATOM 0 HG23 THR A 49 13.202 -0.598 5.493 1.00 0.00 H new ATOM 751 N PHE A 50 11.910 2.044 3.267 1.00 0.00 N ATOM 752 CA PHE A 50 11.609 3.463 3.218 1.00 0.00 C ATOM 753 C PHE A 50 11.141 3.990 4.565 1.00 0.00 C ATOM 754 O PHE A 50 10.783 3.227 5.465 1.00 0.00 O ATOM 755 CB PHE A 50 10.551 3.749 2.148 1.00 0.00 C ATOM 756 CG PHE A 50 9.323 2.887 2.250 1.00 0.00 C ATOM 757 CD1 PHE A 50 8.347 3.147 3.200 1.00 0.00 C ATOM 758 CD2 PHE A 50 9.146 1.818 1.391 1.00 0.00 C ATOM 759 CE1 PHE A 50 7.222 2.354 3.289 1.00 0.00 C ATOM 760 CE2 PHE A 50 8.022 1.023 1.475 1.00 0.00 C ATOM 761 CZ PHE A 50 7.059 1.290 2.425 1.00 0.00 C ATOM 0 H PHE A 50 11.169 1.465 3.662 1.00 0.00 H new ATOM 0 HA PHE A 50 12.532 3.982 2.960 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.254 4.795 2.218 1.00 0.00 H new ATOM 0 HB3 PHE A 50 10.999 3.610 1.164 1.00 0.00 H new ATOM 0 HD1 PHE A 50 8.469 3.979 3.877 1.00 0.00 H new ATOM 0 HD2 PHE A 50 9.897 1.603 0.645 1.00 0.00 H new ATOM 0 HE1 PHE A 50 6.469 2.565 4.034 1.00 0.00 H new ATOM 0 HE2 PHE A 50 7.896 0.192 0.797 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.179 0.668 2.493 1.00 0.00 H new ATOM 771 N ARG A 51 11.158 5.306 4.681 1.00 0.00 N ATOM 772 CA ARG A 51 10.663 5.992 5.858 1.00 0.00 C ATOM 773 C ARG A 51 9.406 6.772 5.494 1.00 0.00 C ATOM 774 O ARG A 51 9.454 7.695 4.678 1.00 0.00 O ATOM 775 CB ARG A 51 11.744 6.930 6.406 1.00 0.00 C ATOM 776 CG ARG A 51 11.330 7.704 7.646 1.00 0.00 C ATOM 777 CD ARG A 51 12.459 8.598 8.132 1.00 0.00 C ATOM 778 NE ARG A 51 12.071 9.395 9.294 1.00 0.00 N ATOM 779 CZ ARG A 51 12.863 10.280 9.893 1.00 0.00 C ATOM 780 NH1 ARG A 51 14.107 10.467 9.473 1.00 0.00 N ATOM 781 NH2 ARG A 51 12.410 10.980 10.920 1.00 0.00 N ATOM 0 H ARG A 51 11.517 5.930 3.958 1.00 0.00 H new ATOM 0 HA ARG A 51 10.415 5.266 6.632 1.00 0.00 H new ATOM 0 HB2 ARG A 51 12.633 6.344 6.638 1.00 0.00 H new ATOM 0 HB3 ARG A 51 12.023 7.638 5.626 1.00 0.00 H new ATOM 0 HG2 ARG A 51 10.451 8.310 7.424 1.00 0.00 H new ATOM 0 HG3 ARG A 51 11.047 7.008 8.436 1.00 0.00 H new ATOM 0 HD2 ARG A 51 13.323 7.984 8.387 1.00 0.00 H new ATOM 0 HD3 ARG A 51 12.767 9.262 7.325 1.00 0.00 H new ATOM 0 HE ARG A 51 11.132 9.264 9.670 1.00 0.00 H new ATOM 0 HH11 ARG A 51 14.465 9.930 8.683 1.00 0.00 H new ATOM 0 HH12 ARG A 51 14.706 11.148 9.940 1.00 0.00 H new ATOM 0 HH21 ARG A 51 11.455 10.840 11.251 1.00 0.00 H new ATOM 0 HH22 ARG A 51 13.015 11.659 11.381 1.00 0.00 H new ATOM 795 N LEU A 52 8.279 6.372 6.065 1.00 0.00 N ATOM 796 CA LEU A 52 7.017 7.048 5.809 1.00 0.00 C ATOM 797 C LEU A 52 6.866 8.245 6.729 1.00 0.00 C ATOM 798 O LEU A 52 6.596 8.098 7.921 1.00 0.00 O ATOM 799 CB LEU A 52 5.833 6.094 5.985 1.00 0.00 C ATOM 800 CG LEU A 52 5.665 5.056 4.875 1.00 0.00 C ATOM 801 CD1 LEU A 52 4.507 4.121 5.188 1.00 0.00 C ATOM 802 CD2 LEU A 52 5.441 5.745 3.537 1.00 0.00 C ATOM 0 H LEU A 52 8.213 5.583 6.708 1.00 0.00 H new ATOM 0 HA LEU A 52 7.023 7.393 4.775 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.945 5.572 6.935 1.00 0.00 H new ATOM 0 HB3 LEU A 52 4.918 6.683 6.051 1.00 0.00 H new ATOM 0 HG LEU A 52 6.579 4.465 4.815 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.403 3.389 4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.700 3.604 6.128 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.586 4.698 5.274 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.323 4.994 2.756 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.541 6.358 3.590 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.298 6.377 3.305 1.00 0.00 H new ATOM 814 N THR A 53 7.061 9.424 6.170 1.00 0.00 N ATOM 815 CA THR A 53 6.983 10.654 6.930 1.00 0.00 C ATOM 816 C THR A 53 5.657 11.369 6.661 1.00 0.00 C ATOM 817 O THR A 53 5.282 11.601 5.507 1.00 0.00 O ATOM 818 CB THR A 53 8.172 11.575 6.579 1.00 0.00 C ATOM 819 OG1 THR A 53 9.407 10.861 6.761 1.00 0.00 O ATOM 820 CG2 THR A 53 8.174 12.830 7.443 1.00 0.00 C ATOM 0 H THR A 53 7.277 9.555 5.182 1.00 0.00 H new ATOM 0 HA THR A 53 7.032 10.409 7.991 1.00 0.00 H new ATOM 0 HB THR A 53 8.070 11.879 5.537 1.00 0.00 H new ATOM 0 HG1 THR A 53 10.107 11.273 6.213 1.00 0.00 H new ATOM 0 HG21 THR A 53 9.023 13.457 7.171 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.248 13.383 7.283 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.252 12.549 8.493 1.00 0.00 H new ATOM 828 N MET A 54 4.938 11.688 7.728 1.00 0.00 N ATOM 829 CA MET A 54 3.665 12.390 7.624 1.00 0.00 C ATOM 830 C MET A 54 3.837 13.863 7.948 1.00 0.00 C ATOM 831 O MET A 54 4.922 14.305 8.325 1.00 0.00 O ATOM 832 CB MET A 54 2.626 11.796 8.583 1.00 0.00 C ATOM 833 CG MET A 54 2.133 10.416 8.198 1.00 0.00 C ATOM 834 SD MET A 54 0.760 9.866 9.232 1.00 0.00 S ATOM 835 CE MET A 54 0.132 8.500 8.260 1.00 0.00 C ATOM 0 H MET A 54 5.217 11.470 8.684 1.00 0.00 H new ATOM 0 HA MET A 54 3.316 12.276 6.598 1.00 0.00 H new ATOM 0 HB2 MET A 54 3.058 11.748 9.583 1.00 0.00 H new ATOM 0 HB3 MET A 54 1.772 12.471 8.637 1.00 0.00 H new ATOM 0 HG2 MET A 54 1.819 10.423 7.154 1.00 0.00 H new ATOM 0 HG3 MET A 54 2.954 9.704 8.279 1.00 0.00 H new ATOM 0 HE1 MET A 54 -0.013 7.632 8.903 1.00 0.00 H new ATOM 0 HE2 MET A 54 -0.820 8.781 7.809 1.00 0.00 H new ATOM 0 HE3 MET A 54 0.846 8.254 7.475 1.00 0.00 H new ATOM 845 N HIS A 55 2.759 14.616 7.789 1.00 0.00 N ATOM 846 CA HIS A 55 2.732 16.009 8.205 1.00 0.00 C ATOM 847 C HIS A 55 2.703 16.080 9.732 1.00 0.00 C ATOM 848 O HIS A 55 2.242 15.142 10.386 1.00 0.00 O ATOM 849 CB HIS A 55 1.522 16.738 7.589 1.00 0.00 C ATOM 850 CG HIS A 55 0.191 16.107 7.889 1.00 0.00 C ATOM 851 ND1 HIS A 55 -0.506 15.349 6.970 1.00 0.00 N ATOM 852 CD2 HIS A 55 -0.573 16.129 9.008 1.00 0.00 C ATOM 853 CE1 HIS A 55 -1.636 14.933 7.512 1.00 0.00 C ATOM 854 NE2 HIS A 55 -1.699 15.392 8.745 1.00 0.00 N ATOM 0 H HIS A 55 1.889 14.284 7.373 1.00 0.00 H new ATOM 0 HA HIS A 55 3.631 16.511 7.847 1.00 0.00 H new ATOM 0 HB2 HIS A 55 1.511 17.766 7.951 1.00 0.00 H new ATOM 0 HB3 HIS A 55 1.653 16.782 6.508 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.339 16.633 9.934 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.382 14.321 7.027 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -2.463 15.226 9.400 1.00 0.00 H new ATOM 863 N PRO A 56 3.205 17.176 10.318 1.00 0.00 N ATOM 864 CA PRO A 56 3.287 17.331 11.775 1.00 0.00 C ATOM 865 C PRO A 56 1.917 17.305 12.450 1.00 0.00 C ATOM 866 O PRO A 56 0.895 17.611 11.826 1.00 0.00 O ATOM 867 CB PRO A 56 3.946 18.702 11.962 1.00 0.00 C ATOM 868 CG PRO A 56 4.592 19.009 10.656 1.00 0.00 C ATOM 869 CD PRO A 56 3.739 18.352 9.613 1.00 0.00 C ATOM 0 HA PRO A 56 3.842 16.511 12.231 1.00 0.00 H new ATOM 0 HB2 PRO A 56 3.208 19.461 12.224 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.680 18.679 12.768 1.00 0.00 H new ATOM 0 HG2 PRO A 56 4.650 20.085 10.492 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.612 18.626 10.625 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.943 19.012 9.268 1.00 0.00 H new ATOM 0 HD3 PRO A 56 4.320 18.068 8.736 1.00 0.00 H new ATOM 877 N ASP A 57 1.902 16.924 13.721 1.00 0.00 N ATOM 878 CA ASP A 57 0.669 16.881 14.498 1.00 0.00 C ATOM 879 C ASP A 57 0.312 18.268 15.030 1.00 0.00 C ATOM 880 O ASP A 57 0.884 19.274 14.602 1.00 0.00 O ATOM 881 CB ASP A 57 0.775 15.868 15.654 1.00 0.00 C ATOM 882 CG ASP A 57 1.930 16.131 16.609 1.00 0.00 C ATOM 883 OD1 ASP A 57 2.262 17.309 16.856 1.00 0.00 O ATOM 884 OD2 ASP A 57 2.512 15.150 17.123 1.00 0.00 O ATOM 0 H ASP A 57 2.734 16.639 14.238 1.00 0.00 H new ATOM 0 HA ASP A 57 -0.130 16.552 13.834 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.158 15.878 16.218 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.884 14.867 15.236 1.00 0.00 H new ATOM 889 N ALA A 58 -0.631 18.314 15.965 1.00 0.00 N ATOM 890 CA ALA A 58 -1.127 19.576 16.505 1.00 0.00 C ATOM 891 C ALA A 58 -0.053 20.327 17.290 1.00 0.00 C ATOM 892 O ALA A 58 -0.141 21.543 17.465 1.00 0.00 O ATOM 893 CB ALA A 58 -2.342 19.330 17.386 1.00 0.00 C ATOM 0 H ALA A 58 -1.070 17.486 16.367 1.00 0.00 H new ATOM 0 HA ALA A 58 -1.412 20.202 15.659 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -2.702 20.279 17.782 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -3.130 18.861 16.797 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -2.066 18.673 18.211 1.00 0.00 H new ATOM 899 N ASP A 59 0.966 19.613 17.748 1.00 0.00 N ATOM 900 CA ASP A 59 2.024 20.231 18.540 1.00 0.00 C ATOM 901 C ASP A 59 3.206 20.588 17.652 1.00 0.00 C ATOM 902 O ASP A 59 4.188 21.175 18.103 1.00 0.00 O ATOM 903 CB ASP A 59 2.478 19.291 19.654 1.00 0.00 C ATOM 904 CG ASP A 59 2.561 19.981 21.001 1.00 0.00 C ATOM 905 OD1 ASP A 59 3.568 20.665 21.276 1.00 0.00 O ATOM 906 OD2 ASP A 59 1.614 19.834 21.800 1.00 0.00 O ATOM 0 H ASP A 59 1.084 18.613 17.587 1.00 0.00 H new ATOM 0 HA ASP A 59 1.628 21.142 18.989 1.00 0.00 H new ATOM 0 HB2 ASP A 59 1.785 18.452 19.722 1.00 0.00 H new ATOM 0 HB3 ASP A 59 3.454 18.878 19.401 1.00 0.00 H new ATOM 911 N GLY A 60 3.107 20.221 16.383 1.00 0.00 N ATOM 912 CA GLY A 60 4.158 20.530 15.438 1.00 0.00 C ATOM 913 C GLY A 60 5.196 19.432 15.361 1.00 0.00 C ATOM 914 O GLY A 60 6.306 19.648 14.870 1.00 0.00 O ATOM 0 H GLY A 60 2.314 19.713 15.991 1.00 0.00 H new ATOM 0 HA2 GLY A 60 3.723 20.686 14.451 1.00 0.00 H new ATOM 0 HA3 GLY A 60 4.640 21.464 15.726 1.00 0.00 H new ATOM 918 N LYS A 61 4.834 18.252 15.842 1.00 0.00 N ATOM 919 CA LYS A 61 5.733 17.109 15.831 1.00 0.00 C ATOM 920 C LYS A 61 5.497 16.262 14.585 1.00 0.00 C ATOM 921 O LYS A 61 4.367 15.878 14.293 1.00 0.00 O ATOM 922 CB LYS A 61 5.525 16.274 17.097 1.00 0.00 C ATOM 923 CG LYS A 61 6.382 15.023 17.166 1.00 0.00 C ATOM 924 CD LYS A 61 6.150 14.275 18.467 1.00 0.00 C ATOM 925 CE LYS A 61 6.965 12.996 18.529 1.00 0.00 C ATOM 926 NZ LYS A 61 6.809 12.303 19.834 1.00 0.00 N ATOM 0 H LYS A 61 3.918 18.061 16.247 1.00 0.00 H new ATOM 0 HA LYS A 61 6.763 17.466 15.811 1.00 0.00 H new ATOM 0 HB2 LYS A 61 5.738 16.895 17.967 1.00 0.00 H new ATOM 0 HB3 LYS A 61 4.476 15.986 17.160 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.151 14.373 16.322 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.434 15.294 17.081 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.414 14.916 19.308 1.00 0.00 H new ATOM 0 HD3 LYS A 61 5.091 14.037 18.567 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.656 12.329 17.724 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.017 13.228 18.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 7.381 11.434 19.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.128 12.930 20.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 5.809 12.059 19.980 1.00 0.00 H new ATOM 940 N VAL A 62 6.564 15.993 13.849 1.00 0.00 N ATOM 941 CA VAL A 62 6.472 15.227 12.610 1.00 0.00 C ATOM 942 C VAL A 62 6.526 13.729 12.904 1.00 0.00 C ATOM 943 O VAL A 62 7.354 13.280 13.696 1.00 0.00 O ATOM 944 CB VAL A 62 7.617 15.599 11.643 1.00 0.00 C ATOM 945 CG1 VAL A 62 7.465 14.880 10.312 1.00 0.00 C ATOM 946 CG2 VAL A 62 7.677 17.105 11.433 1.00 0.00 C ATOM 0 H VAL A 62 7.509 16.294 14.087 1.00 0.00 H new ATOM 0 HA VAL A 62 5.520 15.471 12.139 1.00 0.00 H new ATOM 0 HB VAL A 62 8.555 15.277 12.096 1.00 0.00 H new ATOM 0 HG11 VAL A 62 8.285 15.161 9.651 1.00 0.00 H new ATOM 0 HG12 VAL A 62 7.484 13.803 10.476 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.517 15.160 9.853 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.491 17.345 10.748 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.734 17.451 11.011 1.00 0.00 H new ATOM 0 HG23 VAL A 62 7.850 17.599 12.389 1.00 0.00 H new ATOM 956 N TRP A 63 5.643 12.959 12.273 1.00 0.00 N ATOM 957 CA TRP A 63 5.598 11.521 12.499 1.00 0.00 C ATOM 958 C TRP A 63 6.191 10.778 11.321 1.00 0.00 C ATOM 959 O TRP A 63 5.925 11.107 10.166 1.00 0.00 O ATOM 960 CB TRP A 63 4.166 11.045 12.747 1.00 0.00 C ATOM 961 CG TRP A 63 3.614 11.489 14.063 1.00 0.00 C ATOM 962 CD1 TRP A 63 3.780 12.707 14.641 1.00 0.00 C ATOM 963 CD2 TRP A 63 2.809 10.721 14.965 1.00 0.00 C ATOM 964 NE1 TRP A 63 3.119 12.758 15.842 1.00 0.00 N ATOM 965 CE2 TRP A 63 2.517 11.547 16.066 1.00 0.00 C ATOM 966 CE3 TRP A 63 2.303 9.417 14.946 1.00 0.00 C ATOM 967 CZ2 TRP A 63 1.743 11.113 17.137 1.00 0.00 C ATOM 968 CZ3 TRP A 63 1.536 8.987 16.012 1.00 0.00 C ATOM 969 CH2 TRP A 63 1.262 9.833 17.094 1.00 0.00 C ATOM 0 H TRP A 63 4.954 13.306 11.606 1.00 0.00 H new ATOM 0 HA TRP A 63 6.191 11.307 13.389 1.00 0.00 H new ATOM 0 HB2 TRP A 63 3.524 11.416 11.948 1.00 0.00 H new ATOM 0 HB3 TRP A 63 4.139 9.956 12.698 1.00 0.00 H new ATOM 0 HD1 TRP A 63 4.351 13.519 14.216 1.00 0.00 H new ATOM 0 HE1 TRP A 63 3.082 13.564 16.466 1.00 0.00 H new ATOM 0 HE3 TRP A 63 2.508 8.759 14.114 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 1.529 11.763 17.973 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 1.141 7.982 16.011 1.00 0.00 H new ATOM 0 HH2 TRP A 63 0.658 9.467 17.911 1.00 0.00 H new ATOM 980 N SER A 64 6.995 9.780 11.623 1.00 0.00 N ATOM 981 CA SER A 64 7.641 8.979 10.595 1.00 0.00 C ATOM 982 C SER A 64 8.013 7.606 11.138 1.00 0.00 C ATOM 983 O SER A 64 8.328 7.470 12.324 1.00 0.00 O ATOM 984 CB SER A 64 8.890 9.698 10.087 1.00 0.00 C ATOM 985 OG SER A 64 9.799 9.952 11.151 1.00 0.00 O ATOM 0 H SER A 64 7.220 9.500 12.578 1.00 0.00 H new ATOM 0 HA SER A 64 6.943 8.844 9.769 1.00 0.00 H new ATOM 0 HB2 SER A 64 9.378 9.092 9.324 1.00 0.00 H new ATOM 0 HB3 SER A 64 8.606 10.638 9.614 1.00 0.00 H new ATOM 0 HG SER A 64 9.507 10.744 11.648 1.00 0.00 H new ATOM 991 N TRP A 65 7.970 6.595 10.278 1.00 0.00 N ATOM 992 CA TRP A 65 8.349 5.243 10.669 1.00 0.00 C ATOM 993 C TRP A 65 8.959 4.485 9.490 1.00 0.00 C ATOM 994 O TRP A 65 8.622 4.740 8.330 1.00 0.00 O ATOM 995 CB TRP A 65 7.138 4.480 11.224 1.00 0.00 C ATOM 996 CG TRP A 65 6.032 4.283 10.230 1.00 0.00 C ATOM 997 CD1 TRP A 65 5.866 3.220 9.392 1.00 0.00 C ATOM 998 CD2 TRP A 65 4.938 5.169 9.973 1.00 0.00 C ATOM 999 NE1 TRP A 65 4.742 3.394 8.624 1.00 0.00 N ATOM 1000 CE2 TRP A 65 4.154 4.582 8.964 1.00 0.00 C ATOM 1001 CE3 TRP A 65 4.547 6.404 10.498 1.00 0.00 C ATOM 1002 CZ2 TRP A 65 3.003 5.186 8.470 1.00 0.00 C ATOM 1003 CZ3 TRP A 65 3.405 7.002 10.007 1.00 0.00 C ATOM 1004 CH2 TRP A 65 2.644 6.393 9.002 1.00 0.00 C ATOM 0 H TRP A 65 7.676 6.686 9.305 1.00 0.00 H new ATOM 0 HA TRP A 65 9.101 5.319 11.454 1.00 0.00 H new ATOM 0 HB2 TRP A 65 7.469 3.505 11.582 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.746 5.019 12.086 1.00 0.00 H new ATOM 0 HD1 TRP A 65 6.524 2.365 9.340 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.401 2.744 7.916 1.00 0.00 H new ATOM 0 HE3 TRP A 65 5.128 6.881 11.273 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 2.414 4.719 7.694 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 3.093 7.956 10.405 1.00 0.00 H new ATOM 0 HH2 TRP A 65 1.755 6.887 8.639 1.00 0.00 H new ATOM 1015 N VAL A 66 9.865 3.568 9.796 1.00 0.00 N ATOM 1016 CA VAL A 66 10.512 2.746 8.781 1.00 0.00 C ATOM 1017 C VAL A 66 9.696 1.482 8.495 1.00 0.00 C ATOM 1018 O VAL A 66 9.196 0.826 9.416 1.00 0.00 O ATOM 1019 CB VAL A 66 11.939 2.346 9.222 1.00 0.00 C ATOM 1020 CG1 VAL A 66 12.624 1.489 8.167 1.00 0.00 C ATOM 1021 CG2 VAL A 66 12.769 3.584 9.527 1.00 0.00 C ATOM 0 H VAL A 66 10.172 3.372 10.749 1.00 0.00 H new ATOM 0 HA VAL A 66 10.574 3.342 7.870 1.00 0.00 H new ATOM 0 HB VAL A 66 11.854 1.751 10.131 1.00 0.00 H new ATOM 0 HG11 VAL A 66 13.625 1.224 8.507 1.00 0.00 H new ATOM 0 HG12 VAL A 66 12.044 0.580 8.004 1.00 0.00 H new ATOM 0 HG13 VAL A 66 12.694 2.048 7.234 1.00 0.00 H new ATOM 0 HG21 VAL A 66 13.770 3.284 9.836 1.00 0.00 H new ATOM 0 HG22 VAL A 66 12.836 4.206 8.635 1.00 0.00 H new ATOM 0 HG23 VAL A 66 12.296 4.150 10.330 1.00 0.00 H new ATOM 1031 N SER A 67 9.552 1.154 7.217 1.00 0.00 N ATOM 1032 CA SER A 67 8.848 -0.052 6.803 1.00 0.00 C ATOM 1033 C SER A 67 9.576 -0.724 5.640 1.00 0.00 C ATOM 1034 O SER A 67 10.181 -0.051 4.801 1.00 0.00 O ATOM 1035 CB SER A 67 7.408 0.284 6.408 1.00 0.00 C ATOM 1036 OG SER A 67 6.715 0.893 7.486 1.00 0.00 O ATOM 0 H SER A 67 9.917 1.711 6.445 1.00 0.00 H new ATOM 0 HA SER A 67 8.826 -0.746 7.643 1.00 0.00 H new ATOM 0 HB2 SER A 67 7.410 0.953 5.548 1.00 0.00 H new ATOM 0 HB3 SER A 67 6.889 -0.625 6.104 1.00 0.00 H new ATOM 0 HG SER A 67 6.832 1.865 7.443 1.00 0.00 H new ATOM 1042 N GLU A 68 9.523 -2.049 5.600 1.00 0.00 N ATOM 1043 CA GLU A 68 10.185 -2.809 4.550 1.00 0.00 C ATOM 1044 C GLU A 68 9.167 -3.326 3.548 1.00 0.00 C ATOM 1045 O GLU A 68 8.263 -4.078 3.906 1.00 0.00 O ATOM 1046 CB GLU A 68 10.953 -3.995 5.134 1.00 0.00 C ATOM 1047 CG GLU A 68 11.994 -3.613 6.167 1.00 0.00 C ATOM 1048 CD GLU A 68 12.682 -4.826 6.751 1.00 0.00 C ATOM 1049 OE1 GLU A 68 12.177 -5.376 7.748 1.00 0.00 O ATOM 1050 OE2 GLU A 68 13.726 -5.245 6.207 1.00 0.00 O ATOM 0 H GLU A 68 9.027 -2.620 6.285 1.00 0.00 H new ATOM 0 HA GLU A 68 10.886 -2.140 4.050 1.00 0.00 H new ATOM 0 HB2 GLU A 68 10.242 -4.685 5.589 1.00 0.00 H new ATOM 0 HB3 GLU A 68 11.443 -4.532 4.322 1.00 0.00 H new ATOM 0 HG2 GLU A 68 12.737 -2.960 5.709 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.520 -3.045 6.967 1.00 0.00 H new ATOM 1057 N ARG A 69 9.310 -2.917 2.301 1.00 0.00 N ATOM 1058 CA ARG A 69 8.440 -3.399 1.243 1.00 0.00 C ATOM 1059 C ARG A 69 9.194 -4.383 0.354 1.00 0.00 C ATOM 1060 O ARG A 69 10.073 -3.995 -0.415 1.00 0.00 O ATOM 1061 CB ARG A 69 7.915 -2.227 0.418 1.00 0.00 C ATOM 1062 CG ARG A 69 7.020 -2.640 -0.732 1.00 0.00 C ATOM 1063 CD ARG A 69 6.707 -1.464 -1.640 1.00 0.00 C ATOM 1064 NE ARG A 69 5.958 -1.873 -2.826 1.00 0.00 N ATOM 1065 CZ ARG A 69 6.527 -2.337 -3.940 1.00 0.00 C ATOM 1066 NH1 ARG A 69 7.850 -2.468 -4.007 1.00 0.00 N ATOM 1067 NH2 ARG A 69 5.773 -2.680 -4.981 1.00 0.00 N ATOM 0 H ARG A 69 10.020 -2.252 1.995 1.00 0.00 H new ATOM 0 HA ARG A 69 7.590 -3.915 1.690 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.362 -1.553 1.072 1.00 0.00 H new ATOM 0 HB3 ARG A 69 8.761 -1.665 0.023 1.00 0.00 H new ATOM 0 HG2 ARG A 69 7.506 -3.428 -1.308 1.00 0.00 H new ATOM 0 HG3 ARG A 69 6.092 -3.057 -0.341 1.00 0.00 H new ATOM 0 HD2 ARG A 69 6.132 -0.721 -1.086 1.00 0.00 H new ATOM 0 HD3 ARG A 69 7.637 -0.984 -1.946 1.00 0.00 H new ATOM 0 HE ARG A 69 4.941 -1.800 -2.801 1.00 0.00 H new ATOM 0 HH11 ARG A 69 8.429 -2.214 -3.207 1.00 0.00 H new ATOM 0 HH12 ARG A 69 8.285 -2.823 -4.859 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.759 -2.588 -4.928 1.00 0.00 H new ATOM 0 HH22 ARG A 69 6.209 -3.035 -5.832 1.00 0.00 H new ATOM 1081 N VAL A 70 8.859 -5.654 0.482 1.00 0.00 N ATOM 1082 CA VAL A 70 9.518 -6.704 -0.280 1.00 0.00 C ATOM 1083 C VAL A 70 8.743 -7.013 -1.554 1.00 0.00 C ATOM 1084 O VAL A 70 7.532 -7.242 -1.512 1.00 0.00 O ATOM 1085 CB VAL A 70 9.651 -8.001 0.548 1.00 0.00 C ATOM 1086 CG1 VAL A 70 10.491 -9.035 -0.190 1.00 0.00 C ATOM 1087 CG2 VAL A 70 10.236 -7.705 1.920 1.00 0.00 C ATOM 0 H VAL A 70 8.129 -5.988 1.111 1.00 0.00 H new ATOM 0 HA VAL A 70 10.513 -6.339 -0.534 1.00 0.00 H new ATOM 0 HB VAL A 70 8.654 -8.418 0.687 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.569 -9.939 0.414 1.00 0.00 H new ATOM 0 HG12 VAL A 70 10.018 -9.275 -1.142 1.00 0.00 H new ATOM 0 HG13 VAL A 70 11.488 -8.632 -0.371 1.00 0.00 H new ATOM 0 HG21 VAL A 70 10.321 -8.632 2.487 1.00 0.00 H new ATOM 0 HG22 VAL A 70 11.223 -7.257 1.806 1.00 0.00 H new ATOM 0 HG23 VAL A 70 9.583 -7.013 2.452 1.00 0.00 H new ATOM 1097 N ALA A 71 9.437 -7.006 -2.681 1.00 0.00 N ATOM 1098 CA ALA A 71 8.830 -7.376 -3.950 1.00 0.00 C ATOM 1099 C ALA A 71 9.048 -8.858 -4.234 1.00 0.00 C ATOM 1100 O ALA A 71 10.173 -9.294 -4.468 1.00 0.00 O ATOM 1101 CB ALA A 71 9.390 -6.525 -5.083 1.00 0.00 C ATOM 0 H ALA A 71 10.422 -6.748 -2.743 1.00 0.00 H new ATOM 0 HA ALA A 71 7.758 -7.192 -3.884 1.00 0.00 H new ATOM 0 HB1 ALA A 71 8.923 -6.818 -6.023 1.00 0.00 H new ATOM 0 HB2 ALA A 71 9.181 -5.474 -4.886 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.468 -6.674 -5.152 1.00 0.00 H new ATOM 1107 N ASP A 72 7.968 -9.626 -4.184 1.00 0.00 N ATOM 1108 CA ASP A 72 8.016 -11.058 -4.465 1.00 0.00 C ATOM 1109 C ASP A 72 7.410 -11.317 -5.845 1.00 0.00 C ATOM 1110 O ASP A 72 6.196 -11.480 -5.986 1.00 0.00 O ATOM 1111 CB ASP A 72 7.252 -11.835 -3.381 1.00 0.00 C ATOM 1112 CG ASP A 72 7.469 -13.336 -3.438 1.00 0.00 C ATOM 1113 OD1 ASP A 72 8.016 -13.835 -4.445 1.00 0.00 O ATOM 1114 OD2 ASP A 72 7.089 -14.025 -2.465 1.00 0.00 O ATOM 0 H ASP A 72 7.038 -9.278 -3.949 1.00 0.00 H new ATOM 0 HA ASP A 72 9.051 -11.400 -4.460 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.558 -11.470 -2.401 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.187 -11.627 -3.480 1.00 0.00 H new ATOM 1119 N PRO A 73 8.255 -11.334 -6.887 1.00 0.00 N ATOM 1120 CA PRO A 73 7.806 -11.367 -8.283 1.00 0.00 C ATOM 1121 C PRO A 73 7.171 -12.693 -8.684 1.00 0.00 C ATOM 1122 O PRO A 73 6.322 -12.736 -9.575 1.00 0.00 O ATOM 1123 CB PRO A 73 9.095 -11.139 -9.091 1.00 0.00 C ATOM 1124 CG PRO A 73 10.123 -10.708 -8.097 1.00 0.00 C ATOM 1125 CD PRO A 73 9.720 -11.325 -6.792 1.00 0.00 C ATOM 0 HA PRO A 73 7.030 -10.621 -8.457 1.00 0.00 H new ATOM 0 HB2 PRO A 73 9.403 -12.051 -9.603 1.00 0.00 H new ATOM 0 HB3 PRO A 73 8.948 -10.378 -9.857 1.00 0.00 H new ATOM 0 HG2 PRO A 73 11.117 -11.040 -8.395 1.00 0.00 H new ATOM 0 HG3 PRO A 73 10.160 -9.621 -8.020 1.00 0.00 H new ATOM 0 HD2 PRO A 73 10.126 -12.330 -6.675 1.00 0.00 H new ATOM 0 HD3 PRO A 73 10.068 -10.740 -5.941 1.00 0.00 H new ATOM 1133 N VAL A 74 7.568 -13.766 -8.013 1.00 0.00 N ATOM 1134 CA VAL A 74 7.142 -15.109 -8.394 1.00 0.00 C ATOM 1135 C VAL A 74 5.642 -15.299 -8.180 1.00 0.00 C ATOM 1136 O VAL A 74 4.939 -15.804 -9.055 1.00 0.00 O ATOM 1137 CB VAL A 74 7.923 -16.188 -7.614 1.00 0.00 C ATOM 1138 CG1 VAL A 74 7.516 -17.586 -8.057 1.00 0.00 C ATOM 1139 CG2 VAL A 74 9.421 -15.989 -7.788 1.00 0.00 C ATOM 0 H VAL A 74 8.185 -13.734 -7.201 1.00 0.00 H new ATOM 0 HA VAL A 74 7.358 -15.222 -9.456 1.00 0.00 H new ATOM 0 HB VAL A 74 7.678 -16.085 -6.557 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.082 -18.326 -7.491 1.00 0.00 H new ATOM 0 HG12 VAL A 74 6.450 -17.729 -7.877 1.00 0.00 H new ATOM 0 HG13 VAL A 74 7.724 -17.706 -9.120 1.00 0.00 H new ATOM 0 HG21 VAL A 74 9.957 -16.758 -7.232 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.677 -16.061 -8.845 1.00 0.00 H new ATOM 0 HG23 VAL A 74 9.704 -15.006 -7.412 1.00 0.00 H new ATOM 1149 N THR A 75 5.149 -14.879 -7.026 1.00 0.00 N ATOM 1150 CA THR A 75 3.730 -14.989 -6.730 1.00 0.00 C ATOM 1151 C THR A 75 3.007 -13.668 -6.974 1.00 0.00 C ATOM 1152 O THR A 75 1.840 -13.515 -6.605 1.00 0.00 O ATOM 1153 CB THR A 75 3.499 -15.443 -5.277 1.00 0.00 C ATOM 1154 OG1 THR A 75 4.388 -14.740 -4.398 1.00 0.00 O ATOM 1155 CG2 THR A 75 3.708 -16.943 -5.134 1.00 0.00 C ATOM 0 H THR A 75 5.708 -14.461 -6.282 1.00 0.00 H new ATOM 0 HA THR A 75 3.321 -15.741 -7.405 1.00 0.00 H new ATOM 0 HB THR A 75 2.468 -15.214 -5.008 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.235 -15.032 -3.475 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.539 -17.237 -4.098 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.007 -17.471 -5.780 1.00 0.00 H new ATOM 0 HG23 THR A 75 4.728 -17.197 -5.421 1.00 0.00 H new ATOM 1163 N ARG A 76 3.705 -12.724 -7.612 1.00 0.00 N ATOM 1164 CA ARG A 76 3.158 -11.390 -7.877 1.00 0.00 C ATOM 1165 C ARG A 76 2.695 -10.750 -6.570 1.00 0.00 C ATOM 1166 O ARG A 76 1.623 -10.148 -6.498 1.00 0.00 O ATOM 1167 CB ARG A 76 1.992 -11.465 -8.874 1.00 0.00 C ATOM 1168 CG ARG A 76 2.344 -12.146 -10.190 1.00 0.00 C ATOM 1169 CD ARG A 76 1.175 -12.112 -11.164 1.00 0.00 C ATOM 1170 NE ARG A 76 1.444 -12.884 -12.381 1.00 0.00 N ATOM 1171 CZ ARG A 76 0.991 -12.561 -13.596 1.00 0.00 C ATOM 1172 NH1 ARG A 76 0.294 -11.451 -13.782 1.00 0.00 N ATOM 1173 NH2 ARG A 76 1.241 -13.354 -14.629 1.00 0.00 N ATOM 0 H ARG A 76 4.655 -12.860 -7.956 1.00 0.00 H new ATOM 0 HA ARG A 76 3.943 -10.775 -8.318 1.00 0.00 H new ATOM 0 HB2 ARG A 76 1.164 -12.001 -8.410 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.640 -10.455 -9.082 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.207 -11.652 -10.637 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.632 -13.180 -10.001 1.00 0.00 H new ATOM 0 HD2 ARG A 76 0.285 -12.508 -10.674 1.00 0.00 H new ATOM 0 HD3 ARG A 76 0.958 -11.078 -11.432 1.00 0.00 H new ATOM 0 HE ARG A 76 2.016 -13.724 -12.294 1.00 0.00 H new ATOM 0 HH11 ARG A 76 0.098 -10.834 -12.994 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -0.047 -11.213 -14.713 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.779 -14.210 -14.496 1.00 0.00 H new ATOM 0 HH22 ARG A 76 0.895 -13.108 -15.556 1.00 0.00 H new ATOM 1187 N THR A 77 3.524 -10.875 -5.546 1.00 0.00 N ATOM 1188 CA THR A 77 3.154 -10.467 -4.204 1.00 0.00 C ATOM 1189 C THR A 77 4.085 -9.377 -3.675 1.00 0.00 C ATOM 1190 O THR A 77 5.290 -9.416 -3.897 1.00 0.00 O ATOM 1191 CB THR A 77 3.209 -11.678 -3.251 1.00 0.00 C ATOM 1192 OG1 THR A 77 2.466 -12.772 -3.805 1.00 0.00 O ATOM 1193 CG2 THR A 77 2.651 -11.326 -1.880 1.00 0.00 C ATOM 0 H THR A 77 4.466 -11.260 -5.622 1.00 0.00 H new ATOM 0 HA THR A 77 2.140 -10.069 -4.248 1.00 0.00 H new ATOM 0 HB THR A 77 4.254 -11.966 -3.134 1.00 0.00 H new ATOM 0 HG1 THR A 77 3.054 -13.550 -3.905 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.703 -12.200 -1.231 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.237 -10.516 -1.446 1.00 0.00 H new ATOM 0 HG23 THR A 77 1.613 -11.010 -1.980 1.00 0.00 H new ATOM 1201 N VAL A 78 3.521 -8.396 -2.995 1.00 0.00 N ATOM 1202 CA VAL A 78 4.315 -7.389 -2.313 1.00 0.00 C ATOM 1203 C VAL A 78 4.106 -7.500 -0.808 1.00 0.00 C ATOM 1204 O VAL A 78 2.975 -7.500 -0.334 1.00 0.00 O ATOM 1205 CB VAL A 78 3.959 -5.964 -2.780 1.00 0.00 C ATOM 1206 CG1 VAL A 78 4.782 -4.932 -2.030 1.00 0.00 C ATOM 1207 CG2 VAL A 78 4.165 -5.825 -4.281 1.00 0.00 C ATOM 0 H VAL A 78 2.513 -8.274 -2.900 1.00 0.00 H new ATOM 0 HA VAL A 78 5.361 -7.570 -2.559 1.00 0.00 H new ATOM 0 HB VAL A 78 2.906 -5.786 -2.560 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.515 -3.933 -2.375 1.00 0.00 H new ATOM 0 HG12 VAL A 78 4.581 -5.013 -0.962 1.00 0.00 H new ATOM 0 HG13 VAL A 78 5.842 -5.108 -2.214 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.908 -4.812 -4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.208 -6.026 -4.525 1.00 0.00 H new ATOM 0 HG23 VAL A 78 3.526 -6.537 -4.803 1.00 0.00 H new ATOM 1217 N ARG A 79 5.194 -7.613 -0.065 1.00 0.00 N ATOM 1218 CA ARG A 79 5.117 -7.783 1.379 1.00 0.00 C ATOM 1219 C ARG A 79 5.647 -6.542 2.088 1.00 0.00 C ATOM 1220 O ARG A 79 6.857 -6.331 2.155 1.00 0.00 O ATOM 1221 CB ARG A 79 5.924 -9.012 1.807 1.00 0.00 C ATOM 1222 CG ARG A 79 5.645 -10.247 0.966 1.00 0.00 C ATOM 1223 CD ARG A 79 6.478 -11.433 1.419 1.00 0.00 C ATOM 1224 NE ARG A 79 6.397 -12.551 0.479 1.00 0.00 N ATOM 1225 CZ ARG A 79 5.996 -13.779 0.809 1.00 0.00 C ATOM 1226 NH1 ARG A 79 5.571 -14.039 2.041 1.00 0.00 N ATOM 1227 NH2 ARG A 79 6.008 -14.742 -0.103 1.00 0.00 N ATOM 0 H ARG A 79 6.143 -7.590 -0.437 1.00 0.00 H new ATOM 0 HA ARG A 79 4.073 -7.927 1.657 1.00 0.00 H new ATOM 0 HB2 ARG A 79 6.987 -8.776 1.750 1.00 0.00 H new ATOM 0 HB3 ARG A 79 5.703 -9.236 2.851 1.00 0.00 H new ATOM 0 HG2 ARG A 79 4.587 -10.500 1.030 1.00 0.00 H new ATOM 0 HG3 ARG A 79 5.858 -10.031 -0.081 1.00 0.00 H new ATOM 0 HD2 ARG A 79 7.518 -11.125 1.527 1.00 0.00 H new ATOM 0 HD3 ARG A 79 6.138 -11.760 2.402 1.00 0.00 H new ATOM 0 HE ARG A 79 6.664 -12.380 -0.490 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.550 -13.297 2.741 1.00 0.00 H new ATOM 0 HH12 ARG A 79 5.266 -14.981 2.287 1.00 0.00 H new ATOM 0 HH21 ARG A 79 6.323 -14.542 -1.052 1.00 0.00 H new ATOM 0 HH22 ARG A 79 5.702 -15.683 0.145 1.00 0.00 H new ATOM 1241 N ALA A 80 4.748 -5.712 2.592 1.00 0.00 N ATOM 1242 CA ALA A 80 5.143 -4.495 3.283 1.00 0.00 C ATOM 1243 C ALA A 80 4.944 -4.639 4.786 1.00 0.00 C ATOM 1244 O ALA A 80 3.831 -4.502 5.293 1.00 0.00 O ATOM 1245 CB ALA A 80 4.362 -3.301 2.751 1.00 0.00 C ATOM 0 H ALA A 80 3.740 -5.859 2.536 1.00 0.00 H new ATOM 0 HA ALA A 80 6.203 -4.324 3.095 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.671 -2.399 3.280 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.560 -3.182 1.686 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.296 -3.465 2.906 1.00 0.00 H new ATOM 1251 N GLN A 81 6.024 -4.926 5.492 1.00 0.00 N ATOM 1252 CA GLN A 81 5.966 -5.097 6.934 1.00 0.00 C ATOM 1253 C GLN A 81 6.489 -3.846 7.629 1.00 0.00 C ATOM 1254 O GLN A 81 7.482 -3.253 7.196 1.00 0.00 O ATOM 1255 CB GLN A 81 6.775 -6.329 7.360 1.00 0.00 C ATOM 1256 CG GLN A 81 8.259 -6.240 7.033 1.00 0.00 C ATOM 1257 CD GLN A 81 9.021 -7.494 7.419 1.00 0.00 C ATOM 1258 OE1 GLN A 81 8.482 -8.599 7.387 1.00 0.00 O ATOM 1259 NE2 GLN A 81 10.281 -7.335 7.791 1.00 0.00 N ATOM 0 H GLN A 81 6.954 -5.046 5.089 1.00 0.00 H new ATOM 0 HA GLN A 81 4.928 -5.252 7.229 1.00 0.00 H new ATOM 0 HB2 GLN A 81 6.658 -6.474 8.434 1.00 0.00 H new ATOM 0 HB3 GLN A 81 6.358 -7.211 6.873 1.00 0.00 H new ATOM 0 HG2 GLN A 81 8.381 -6.060 5.965 1.00 0.00 H new ATOM 0 HG3 GLN A 81 8.690 -5.384 7.552 1.00 0.00 H new ATOM 0 HE21 GLN A 81 10.695 -6.403 7.805 1.00 0.00 H new ATOM 0 HE22 GLN A 81 10.838 -8.145 8.063 1.00 0.00 H new ATOM 1268 N ARG A 82 5.818 -3.427 8.692 1.00 0.00 N ATOM 1269 CA ARG A 82 6.250 -2.240 9.420 1.00 0.00 C ATOM 1270 C ARG A 82 7.237 -2.609 10.514 1.00 0.00 C ATOM 1271 O ARG A 82 6.931 -3.414 11.391 1.00 0.00 O ATOM 1272 CB ARG A 82 5.070 -1.484 10.037 1.00 0.00 C ATOM 1273 CG ARG A 82 4.065 -0.964 9.025 1.00 0.00 C ATOM 1274 CD ARG A 82 3.347 0.274 9.538 1.00 0.00 C ATOM 1275 NE ARG A 82 2.831 0.097 10.895 1.00 0.00 N ATOM 1276 CZ ARG A 82 2.025 0.964 11.504 1.00 0.00 C ATOM 1277 NH1 ARG A 82 1.616 2.058 10.864 1.00 0.00 N ATOM 1278 NH2 ARG A 82 1.630 0.738 12.754 1.00 0.00 N ATOM 0 H ARG A 82 4.985 -3.882 9.066 1.00 0.00 H new ATOM 0 HA ARG A 82 6.735 -1.586 8.695 1.00 0.00 H new ATOM 0 HB2 ARG A 82 4.556 -2.144 10.736 1.00 0.00 H new ATOM 0 HB3 ARG A 82 5.454 -0.644 10.615 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.576 -0.729 8.091 1.00 0.00 H new ATOM 0 HG3 ARG A 82 3.336 -1.743 8.802 1.00 0.00 H new ATOM 0 HD2 ARG A 82 4.032 1.122 9.520 1.00 0.00 H new ATOM 0 HD3 ARG A 82 2.523 0.517 8.867 1.00 0.00 H new ATOM 0 HE ARG A 82 3.105 -0.742 11.406 1.00 0.00 H new ATOM 0 HH11 ARG A 82 1.920 2.232 9.906 1.00 0.00 H new ATOM 0 HH12 ARG A 82 0.998 2.722 11.332 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.945 -0.099 13.245 1.00 0.00 H new ATOM 0 HH22 ARG A 82 1.012 1.402 13.222 1.00 0.00 H new ATOM 1292 N VAL A 83 8.419 -2.014 10.453 1.00 0.00 N ATOM 1293 CA VAL A 83 9.430 -2.224 11.477 1.00 0.00 C ATOM 1294 C VAL A 83 9.031 -1.484 12.747 1.00 0.00 C ATOM 1295 O VAL A 83 9.016 -2.050 13.842 1.00 0.00 O ATOM 1296 CB VAL A 83 10.819 -1.737 11.012 1.00 0.00 C ATOM 1297 CG1 VAL A 83 11.869 -2.006 12.080 1.00 0.00 C ATOM 1298 CG2 VAL A 83 11.206 -2.401 9.697 1.00 0.00 C ATOM 0 H VAL A 83 8.701 -1.381 9.704 1.00 0.00 H new ATOM 0 HA VAL A 83 9.495 -3.295 11.671 1.00 0.00 H new ATOM 0 HB VAL A 83 10.768 -0.660 10.850 1.00 0.00 H new ATOM 0 HG11 VAL A 83 12.840 -1.655 11.732 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.600 -1.479 12.996 1.00 0.00 H new ATOM 0 HG13 VAL A 83 11.920 -3.077 12.279 1.00 0.00 H new ATOM 0 HG21 VAL A 83 12.188 -2.045 9.385 1.00 0.00 H new ATOM 0 HG22 VAL A 83 11.237 -3.482 9.831 1.00 0.00 H new ATOM 0 HG23 VAL A 83 10.470 -2.151 8.933 1.00 0.00 H new ATOM 1308 N GLU A 84 8.686 -0.218 12.586 1.00 0.00 N ATOM 1309 CA GLU A 84 8.263 0.602 13.705 1.00 0.00 C ATOM 1310 C GLU A 84 6.743 0.636 13.791 1.00 0.00 C ATOM 1311 O GLU A 84 6.063 1.034 12.843 1.00 0.00 O ATOM 1312 CB GLU A 84 8.819 2.017 13.564 1.00 0.00 C ATOM 1313 CG GLU A 84 10.335 2.065 13.493 1.00 0.00 C ATOM 1314 CD GLU A 84 10.862 3.477 13.380 1.00 0.00 C ATOM 1315 OE1 GLU A 84 11.018 3.965 12.246 1.00 0.00 O ATOM 1316 OE2 GLU A 84 11.122 4.105 14.428 1.00 0.00 O ATOM 0 H GLU A 84 8.691 0.264 11.687 1.00 0.00 H new ATOM 0 HA GLU A 84 8.653 0.165 14.624 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.406 2.474 12.665 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.483 2.617 14.409 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.753 1.594 14.383 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.674 1.484 12.636 1.00 0.00 H new ATOM 1323 N THR A 85 6.218 0.194 14.921 1.00 0.00 N ATOM 1324 CA THR A 85 4.786 0.182 15.156 1.00 0.00 C ATOM 1325 C THR A 85 4.506 0.122 16.656 1.00 0.00 C ATOM 1326 O THR A 85 5.270 -0.484 17.412 1.00 0.00 O ATOM 1327 CB THR A 85 4.104 -1.005 14.433 1.00 0.00 C ATOM 1328 OG1 THR A 85 2.705 -1.042 14.738 1.00 0.00 O ATOM 1329 CG2 THR A 85 4.754 -2.332 14.806 1.00 0.00 C ATOM 0 H THR A 85 6.771 -0.165 15.699 1.00 0.00 H new ATOM 0 HA THR A 85 4.367 1.102 14.748 1.00 0.00 H new ATOM 0 HB THR A 85 4.231 -0.854 13.361 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.547 -1.669 15.474 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.251 -3.144 14.281 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.806 -2.314 14.523 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.670 -2.489 15.881 1.00 0.00 H new ATOM 1337 N GLY A 86 3.431 0.772 17.083 1.00 0.00 N ATOM 1338 CA GLY A 86 3.097 0.815 18.494 1.00 0.00 C ATOM 1339 C GLY A 86 1.843 0.026 18.819 1.00 0.00 C ATOM 1340 O GLY A 86 1.928 -1.127 19.232 1.00 0.00 O ATOM 0 H GLY A 86 2.782 1.272 16.475 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.931 0.420 19.074 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.959 1.852 18.800 1.00 0.00 H new ATOM 1344 N PRO A 87 0.653 0.627 18.629 1.00 0.00 N ATOM 1345 CA PRO A 87 -0.633 -0.029 18.925 1.00 0.00 C ATOM 1346 C PRO A 87 -0.841 -1.313 18.124 1.00 0.00 C ATOM 1347 O PRO A 87 -1.596 -2.198 18.532 1.00 0.00 O ATOM 1348 CB PRO A 87 -1.677 1.019 18.524 1.00 0.00 C ATOM 1349 CG PRO A 87 -0.947 2.316 18.543 1.00 0.00 C ATOM 1350 CD PRO A 87 0.462 2.000 18.134 1.00 0.00 C ATOM 0 HA PRO A 87 -0.692 -0.334 19.970 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -2.086 0.811 17.535 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -2.515 1.028 19.220 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -1.402 3.031 17.857 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -0.974 2.765 19.536 1.00 0.00 H new ATOM 0 HD2 PRO A 87 0.591 2.061 17.053 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.176 2.692 18.580 1.00 0.00 H new ATOM 1358 N PHE A 88 -0.172 -1.411 16.982 1.00 0.00 N ATOM 1359 CA PHE A 88 -0.262 -2.599 16.157 1.00 0.00 C ATOM 1360 C PHE A 88 0.904 -3.518 16.482 1.00 0.00 C ATOM 1361 O PHE A 88 2.027 -3.282 16.041 1.00 0.00 O ATOM 1362 CB PHE A 88 -0.255 -2.230 14.670 1.00 0.00 C ATOM 1363 CG PHE A 88 -1.367 -1.301 14.265 1.00 0.00 C ATOM 1364 CD1 PHE A 88 -1.200 0.073 14.331 1.00 0.00 C ATOM 1365 CD2 PHE A 88 -2.578 -1.803 13.817 1.00 0.00 C ATOM 1366 CE1 PHE A 88 -2.218 0.929 13.954 1.00 0.00 C ATOM 1367 CE2 PHE A 88 -3.600 -0.952 13.437 1.00 0.00 C ATOM 1368 CZ PHE A 88 -3.421 0.415 13.507 1.00 0.00 C ATOM 0 H PHE A 88 0.436 -0.681 16.611 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.200 -3.112 16.368 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.700 -1.765 14.426 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.325 -3.143 14.079 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.263 0.480 14.681 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -2.726 -2.872 13.764 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -2.074 1.998 14.009 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.538 -1.357 13.086 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.219 1.081 13.213 1.00 0.00 H new ATOM 1378 N GLN A 89 0.628 -4.543 17.275 1.00 0.00 N ATOM 1379 CA GLN A 89 1.648 -5.483 17.726 1.00 0.00 C ATOM 1380 C GLN A 89 2.282 -6.177 16.525 1.00 0.00 C ATOM 1381 O GLN A 89 3.495 -6.393 16.475 1.00 0.00 O ATOM 1382 CB GLN A 89 1.011 -6.510 18.666 1.00 0.00 C ATOM 1383 CG GLN A 89 2.004 -7.400 19.395 1.00 0.00 C ATOM 1384 CD GLN A 89 1.317 -8.382 20.325 1.00 0.00 C ATOM 1385 OE1 GLN A 89 0.233 -8.109 20.847 1.00 0.00 O ATOM 1386 NE2 GLN A 89 1.942 -9.524 20.550 1.00 0.00 N ATOM 0 H GLN A 89 -0.308 -4.748 17.625 1.00 0.00 H new ATOM 0 HA GLN A 89 2.429 -4.946 18.265 1.00 0.00 H new ATOM 0 HB2 GLN A 89 0.406 -5.982 19.403 1.00 0.00 H new ATOM 0 HB3 GLN A 89 0.333 -7.140 18.090 1.00 0.00 H new ATOM 0 HG2 GLN A 89 2.601 -7.949 18.666 1.00 0.00 H new ATOM 0 HG3 GLN A 89 2.693 -6.780 19.969 1.00 0.00 H new ATOM 0 HE21 GLN A 89 2.837 -9.713 20.099 1.00 0.00 H new ATOM 0 HE22 GLN A 89 1.529 -10.217 21.174 1.00 0.00 H new ATOM 1395 N TYR A 90 1.447 -6.507 15.553 1.00 0.00 N ATOM 1396 CA TYR A 90 1.909 -7.104 14.310 1.00 0.00 C ATOM 1397 C TYR A 90 1.215 -6.426 13.134 1.00 0.00 C ATOM 1398 O TYR A 90 0.043 -6.062 13.235 1.00 0.00 O ATOM 1399 CB TYR A 90 1.624 -8.612 14.311 1.00 0.00 C ATOM 1400 CG TYR A 90 2.049 -9.335 13.048 1.00 0.00 C ATOM 1401 CD1 TYR A 90 3.383 -9.652 12.815 1.00 0.00 C ATOM 1402 CD2 TYR A 90 1.111 -9.706 12.093 1.00 0.00 C ATOM 1403 CE1 TYR A 90 3.767 -10.319 11.665 1.00 0.00 C ATOM 1404 CE2 TYR A 90 1.487 -10.372 10.942 1.00 0.00 C ATOM 1405 CZ TYR A 90 2.815 -10.676 10.732 1.00 0.00 C ATOM 1406 OH TYR A 90 3.191 -11.339 9.585 1.00 0.00 O ATOM 0 H TYR A 90 0.437 -6.370 15.602 1.00 0.00 H new ATOM 0 HA TYR A 90 2.985 -6.961 14.216 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.134 -9.064 15.162 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.555 -8.766 14.460 1.00 0.00 H new ATOM 0 HD1 TYR A 90 4.131 -9.373 13.543 1.00 0.00 H new ATOM 0 HD2 TYR A 90 0.069 -9.470 12.253 1.00 0.00 H new ATOM 0 HE1 TYR A 90 4.807 -10.559 11.498 1.00 0.00 H new ATOM 0 HE2 TYR A 90 0.744 -10.653 10.210 1.00 0.00 H new ATOM 0 HH TYR A 90 2.399 -11.517 9.036 1.00 0.00 H new ATOM 1416 N MET A 91 1.946 -6.221 12.044 1.00 0.00 N ATOM 1417 CA MET A 91 1.367 -5.650 10.834 1.00 0.00 C ATOM 1418 C MET A 91 2.211 -5.976 9.609 1.00 0.00 C ATOM 1419 O MET A 91 3.319 -5.453 9.435 1.00 0.00 O ATOM 1420 CB MET A 91 1.186 -4.133 10.956 1.00 0.00 C ATOM 1421 CG MET A 91 0.783 -3.471 9.644 1.00 0.00 C ATOM 1422 SD MET A 91 0.292 -1.748 9.839 1.00 0.00 S ATOM 1423 CE MET A 91 -1.305 -1.943 10.621 1.00 0.00 C ATOM 0 H MET A 91 2.939 -6.441 11.974 1.00 0.00 H new ATOM 0 HA MET A 91 0.384 -6.103 10.710 1.00 0.00 H new ATOM 0 HB2 MET A 91 0.427 -3.923 11.710 1.00 0.00 H new ATOM 0 HB3 MET A 91 2.117 -3.689 11.309 1.00 0.00 H new ATOM 0 HG2 MET A 91 1.617 -3.527 8.945 1.00 0.00 H new ATOM 0 HG3 MET A 91 -0.042 -4.029 9.201 1.00 0.00 H new ATOM 0 HE1 MET A 91 -1.653 -0.976 10.984 1.00 0.00 H new ATOM 0 HE2 MET A 91 -2.019 -2.337 9.898 1.00 0.00 H new ATOM 0 HE3 MET A 91 -1.218 -2.635 11.459 1.00 0.00 H new ATOM 1433 N ASN A 92 1.676 -6.852 8.778 1.00 0.00 N ATOM 1434 CA ASN A 92 2.281 -7.190 7.499 1.00 0.00 C ATOM 1435 C ASN A 92 1.264 -6.962 6.391 1.00 0.00 C ATOM 1436 O ASN A 92 0.214 -7.607 6.359 1.00 0.00 O ATOM 1437 CB ASN A 92 2.748 -8.648 7.494 1.00 0.00 C ATOM 1438 CG ASN A 92 3.373 -9.057 6.171 1.00 0.00 C ATOM 1439 OD1 ASN A 92 3.983 -8.244 5.480 1.00 0.00 O ATOM 1440 ND2 ASN A 92 3.224 -10.323 5.812 1.00 0.00 N ATOM 0 H ASN A 92 0.808 -7.351 8.970 1.00 0.00 H new ATOM 0 HA ASN A 92 3.151 -6.554 7.334 1.00 0.00 H new ATOM 0 HB2 ASN A 92 3.472 -8.796 8.295 1.00 0.00 H new ATOM 0 HB3 ASN A 92 1.899 -9.298 7.707 1.00 0.00 H new ATOM 0 HD21 ASN A 92 3.623 -10.654 4.934 1.00 0.00 H new ATOM 0 HD22 ASN A 92 2.710 -10.967 6.414 1.00 0.00 H new ATOM 1447 N ILE A 93 1.556 -6.026 5.507 1.00 0.00 N ATOM 1448 CA ILE A 93 0.629 -5.665 4.451 1.00 0.00 C ATOM 1449 C ILE A 93 1.015 -6.356 3.148 1.00 0.00 C ATOM 1450 O ILE A 93 2.000 -5.993 2.506 1.00 0.00 O ATOM 1451 CB ILE A 93 0.589 -4.140 4.239 1.00 0.00 C ATOM 1452 CG1 ILE A 93 0.461 -3.416 5.584 1.00 0.00 C ATOM 1453 CG2 ILE A 93 -0.575 -3.772 3.335 1.00 0.00 C ATOM 1454 CD1 ILE A 93 0.586 -1.911 5.480 1.00 0.00 C ATOM 0 H ILE A 93 2.430 -5.501 5.500 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.364 -5.995 4.754 1.00 0.00 H new ATOM 0 HB ILE A 93 1.520 -3.829 3.765 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.504 -3.662 6.028 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.229 -3.789 6.262 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -0.596 -2.692 3.190 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.456 -4.265 2.370 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -1.509 -4.095 3.795 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.485 -1.468 6.471 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.561 -1.655 5.066 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.198 -1.525 4.828 1.00 0.00 H new ATOM 1466 N VAL A 94 0.240 -7.358 2.778 1.00 0.00 N ATOM 1467 CA VAL A 94 0.512 -8.142 1.587 1.00 0.00 C ATOM 1468 C VAL A 94 -0.336 -7.665 0.411 1.00 0.00 C ATOM 1469 O VAL A 94 -1.560 -7.794 0.425 1.00 0.00 O ATOM 1470 CB VAL A 94 0.239 -9.641 1.842 1.00 0.00 C ATOM 1471 CG1 VAL A 94 0.483 -10.459 0.586 1.00 0.00 C ATOM 1472 CG2 VAL A 94 1.096 -10.152 2.990 1.00 0.00 C ATOM 0 H VAL A 94 -0.592 -7.651 3.291 1.00 0.00 H new ATOM 0 HA VAL A 94 1.565 -8.007 1.341 1.00 0.00 H new ATOM 0 HB VAL A 94 -0.810 -9.752 2.118 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.284 -11.511 0.792 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -0.179 -10.113 -0.208 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.520 -10.341 0.271 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.890 -11.210 3.155 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.150 -10.022 2.743 1.00 0.00 H new ATOM 0 HG23 VAL A 94 0.863 -9.591 3.895 1.00 0.00 H new ATOM 1482 N TRP A 95 0.315 -7.098 -0.595 1.00 0.00 N ATOM 1483 CA TRP A 95 -0.369 -6.706 -1.818 1.00 0.00 C ATOM 1484 C TRP A 95 -0.170 -7.781 -2.873 1.00 0.00 C ATOM 1485 O TRP A 95 0.902 -7.880 -3.467 1.00 0.00 O ATOM 1486 CB TRP A 95 0.158 -5.377 -2.374 1.00 0.00 C ATOM 1487 CG TRP A 95 0.175 -4.243 -1.398 1.00 0.00 C ATOM 1488 CD1 TRP A 95 -0.623 -4.077 -0.305 1.00 0.00 C ATOM 1489 CD2 TRP A 95 1.032 -3.097 -1.447 1.00 0.00 C ATOM 1490 NE1 TRP A 95 -0.309 -2.902 0.331 1.00 0.00 N ATOM 1491 CE2 TRP A 95 0.703 -2.283 -0.350 1.00 0.00 C ATOM 1492 CE3 TRP A 95 2.048 -2.681 -2.313 1.00 0.00 C ATOM 1493 CZ2 TRP A 95 1.353 -1.080 -0.092 1.00 0.00 C ATOM 1494 CZ3 TRP A 95 2.693 -1.486 -2.056 1.00 0.00 C ATOM 1495 CH2 TRP A 95 2.343 -0.698 -0.954 1.00 0.00 C ATOM 0 H TRP A 95 1.315 -6.899 -0.588 1.00 0.00 H new ATOM 0 HA TRP A 95 -1.425 -6.582 -1.576 1.00 0.00 H new ATOM 0 HB2 TRP A 95 1.171 -5.532 -2.745 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -0.454 -5.091 -3.229 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.389 -4.768 0.013 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -0.758 -2.547 1.175 1.00 0.00 H new ATOM 0 HE3 TRP A 95 2.324 -3.282 -3.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 1.085 -0.470 0.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 3.480 -1.155 -2.717 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.866 0.231 -0.781 1.00 0.00 H new ATOM 1506 N GLU A 96 -1.178 -8.602 -3.085 1.00 0.00 N ATOM 1507 CA GLU A 96 -1.094 -9.627 -4.110 1.00 0.00 C ATOM 1508 C GLU A 96 -1.795 -9.150 -5.372 1.00 0.00 C ATOM 1509 O GLU A 96 -2.926 -8.664 -5.318 1.00 0.00 O ATOM 1510 CB GLU A 96 -1.704 -10.947 -3.632 1.00 0.00 C ATOM 1511 CG GLU A 96 -1.371 -12.121 -4.544 1.00 0.00 C ATOM 1512 CD GLU A 96 -2.027 -13.416 -4.113 1.00 0.00 C ATOM 1513 OE1 GLU A 96 -2.153 -13.654 -2.895 1.00 0.00 O ATOM 1514 OE2 GLU A 96 -2.427 -14.206 -4.996 1.00 0.00 O ATOM 0 H GLU A 96 -2.057 -8.582 -2.568 1.00 0.00 H new ATOM 0 HA GLU A 96 -0.041 -9.808 -4.326 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -1.346 -11.163 -2.625 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -2.787 -10.839 -3.569 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.684 -11.883 -5.561 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -0.290 -12.259 -4.568 1.00 0.00 H new ATOM 1521 N TYR A 97 -1.113 -9.263 -6.499 1.00 0.00 N ATOM 1522 CA TYR A 97 -1.684 -8.857 -7.769 1.00 0.00 C ATOM 1523 C TYR A 97 -2.166 -10.078 -8.539 1.00 0.00 C ATOM 1524 O TYR A 97 -1.372 -10.933 -8.932 1.00 0.00 O ATOM 1525 CB TYR A 97 -0.661 -8.074 -8.593 1.00 0.00 C ATOM 1526 CG TYR A 97 -0.095 -6.873 -7.866 1.00 0.00 C ATOM 1527 CD1 TYR A 97 -0.918 -5.837 -7.444 1.00 0.00 C ATOM 1528 CD2 TYR A 97 1.265 -6.774 -7.608 1.00 0.00 C ATOM 1529 CE1 TYR A 97 -0.401 -4.739 -6.781 1.00 0.00 C ATOM 1530 CE2 TYR A 97 1.789 -5.681 -6.946 1.00 0.00 C ATOM 1531 CZ TYR A 97 0.954 -4.666 -6.536 1.00 0.00 C ATOM 1532 OH TYR A 97 1.475 -3.574 -5.878 1.00 0.00 O ATOM 0 H TYR A 97 -0.164 -9.632 -6.559 1.00 0.00 H new ATOM 0 HA TYR A 97 -2.536 -8.206 -7.576 1.00 0.00 H new ATOM 0 HB2 TYR A 97 0.156 -8.739 -8.871 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -1.130 -7.741 -9.519 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -1.979 -5.890 -7.637 1.00 0.00 H new ATOM 0 HD2 TYR A 97 1.925 -7.566 -7.931 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -1.055 -3.943 -6.457 1.00 0.00 H new ATOM 0 HE2 TYR A 97 2.850 -5.623 -6.751 1.00 0.00 H new ATOM 0 HH TYR A 97 2.083 -3.091 -6.476 1.00 0.00 H new ATOM 1542 N ALA A 98 -3.466 -10.153 -8.744 1.00 0.00 N ATOM 1543 CA ALA A 98 -4.074 -11.301 -9.387 1.00 0.00 C ATOM 1544 C ALA A 98 -4.493 -10.972 -10.810 1.00 0.00 C ATOM 1545 O ALA A 98 -5.458 -10.235 -11.034 1.00 0.00 O ATOM 1546 CB ALA A 98 -5.264 -11.786 -8.576 1.00 0.00 C ATOM 0 H ALA A 98 -4.127 -9.425 -8.472 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.333 -12.099 -9.434 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.713 -12.649 -9.069 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -4.932 -12.070 -7.577 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.002 -10.987 -8.499 1.00 0.00 H new ATOM 1552 N GLU A 99 -3.751 -11.509 -11.763 1.00 0.00 N ATOM 1553 CA GLU A 99 -4.031 -11.293 -13.172 1.00 0.00 C ATOM 1554 C GLU A 99 -5.334 -11.984 -13.554 1.00 0.00 C ATOM 1555 O GLU A 99 -5.396 -13.211 -13.646 1.00 0.00 O ATOM 1556 CB GLU A 99 -2.875 -11.828 -14.012 1.00 0.00 C ATOM 1557 CG GLU A 99 -2.985 -11.529 -15.496 1.00 0.00 C ATOM 1558 CD GLU A 99 -1.805 -12.072 -16.271 1.00 0.00 C ATOM 1559 OE1 GLU A 99 -0.735 -11.433 -16.255 1.00 0.00 O ATOM 1560 OE2 GLU A 99 -1.933 -13.158 -16.876 1.00 0.00 O ATOM 0 H GLU A 99 -2.942 -12.104 -11.584 1.00 0.00 H new ATOM 0 HA GLU A 99 -4.138 -10.225 -13.361 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -1.943 -11.404 -13.637 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.812 -12.908 -13.875 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -3.906 -11.963 -15.886 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.052 -10.451 -15.645 1.00 0.00 H new ATOM 1567 N THR A 100 -6.372 -11.195 -13.757 1.00 0.00 N ATOM 1568 CA THR A 100 -7.692 -11.725 -14.030 1.00 0.00 C ATOM 1569 C THR A 100 -8.193 -11.220 -15.385 1.00 0.00 C ATOM 1570 O THR A 100 -7.652 -10.255 -15.924 1.00 0.00 O ATOM 1571 CB THR A 100 -8.661 -11.314 -12.903 1.00 0.00 C ATOM 1572 OG1 THR A 100 -8.047 -11.579 -11.632 1.00 0.00 O ATOM 1573 CG2 THR A 100 -9.979 -12.069 -12.989 1.00 0.00 C ATOM 0 H THR A 100 -6.324 -10.176 -13.737 1.00 0.00 H new ATOM 0 HA THR A 100 -7.642 -12.813 -14.068 1.00 0.00 H new ATOM 0 HB THR A 100 -8.874 -10.251 -13.013 1.00 0.00 H new ATOM 0 HG1 THR A 100 -7.296 -10.964 -11.497 1.00 0.00 H new ATOM 0 HG21 THR A 100 -10.634 -11.751 -12.178 1.00 0.00 H new ATOM 0 HG22 THR A 100 -10.457 -11.858 -13.945 1.00 0.00 H new ATOM 0 HG23 THR A 100 -9.791 -13.139 -12.905 1.00 0.00 H new ATOM 1581 N ALA A 101 -9.215 -11.875 -15.928 1.00 0.00 N ATOM 1582 CA ALA A 101 -9.756 -11.525 -17.238 1.00 0.00 C ATOM 1583 C ALA A 101 -10.248 -10.078 -17.290 1.00 0.00 C ATOM 1584 O ALA A 101 -10.230 -9.449 -18.346 1.00 0.00 O ATOM 1585 CB ALA A 101 -10.884 -12.475 -17.606 1.00 0.00 C ATOM 0 H ALA A 101 -9.689 -12.658 -15.477 1.00 0.00 H new ATOM 0 HA ALA A 101 -8.947 -11.620 -17.963 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.281 -12.206 -18.585 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -10.504 -13.496 -17.637 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.676 -12.405 -16.861 1.00 0.00 H new ATOM 1591 N GLU A 102 -10.693 -9.557 -16.150 1.00 0.00 N ATOM 1592 CA GLU A 102 -11.162 -8.179 -16.075 1.00 0.00 C ATOM 1593 C GLU A 102 -9.987 -7.212 -15.987 1.00 0.00 C ATOM 1594 O GLU A 102 -10.093 -6.049 -16.375 1.00 0.00 O ATOM 1595 CB GLU A 102 -12.067 -7.975 -14.859 1.00 0.00 C ATOM 1596 CG GLU A 102 -13.279 -8.886 -14.822 1.00 0.00 C ATOM 1597 CD GLU A 102 -14.239 -8.517 -13.708 1.00 0.00 C ATOM 1598 OE1 GLU A 102 -14.014 -8.940 -12.556 1.00 0.00 O ATOM 1599 OE2 GLU A 102 -15.228 -7.808 -13.982 1.00 0.00 O ATOM 0 H GLU A 102 -10.738 -10.068 -15.268 1.00 0.00 H new ATOM 0 HA GLU A 102 -11.730 -7.978 -16.983 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -11.481 -8.133 -13.954 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -12.405 -6.939 -14.843 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.799 -8.835 -15.779 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -12.952 -9.918 -14.691 1.00 0.00 H new ATOM 1606 N GLY A 103 -8.862 -7.709 -15.497 1.00 0.00 N ATOM 1607 CA GLY A 103 -7.727 -6.856 -15.237 1.00 0.00 C ATOM 1608 C GLY A 103 -6.935 -7.329 -14.038 1.00 0.00 C ATOM 1609 O GLY A 103 -7.157 -8.433 -13.533 1.00 0.00 O ATOM 0 H GLY A 103 -8.717 -8.694 -15.274 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -7.080 -6.833 -16.114 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -8.070 -5.835 -15.067 1.00 0.00 H new ATOM 1613 N THR A 104 -6.010 -6.504 -13.587 1.00 0.00 N ATOM 1614 CA THR A 104 -5.188 -6.824 -12.438 1.00 0.00 C ATOM 1615 C THR A 104 -5.954 -6.560 -11.146 1.00 0.00 C ATOM 1616 O THR A 104 -6.228 -5.410 -10.797 1.00 0.00 O ATOM 1617 CB THR A 104 -3.895 -5.988 -12.444 1.00 0.00 C ATOM 1618 OG1 THR A 104 -3.226 -6.131 -13.708 1.00 0.00 O ATOM 1619 CG2 THR A 104 -2.966 -6.415 -11.320 1.00 0.00 C ATOM 0 H THR A 104 -5.808 -5.596 -14.006 1.00 0.00 H new ATOM 0 HA THR A 104 -4.929 -7.881 -12.495 1.00 0.00 H new ATOM 0 HB THR A 104 -4.163 -4.943 -12.290 1.00 0.00 H new ATOM 0 HG1 THR A 104 -3.170 -5.258 -14.149 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.060 -5.809 -11.347 1.00 0.00 H new ATOM 0 HG22 THR A 104 -3.467 -6.277 -10.362 1.00 0.00 H new ATOM 0 HG23 THR A 104 -2.703 -7.466 -11.444 1.00 0.00 H new ATOM 1627 N VAL A 105 -6.332 -7.626 -10.459 1.00 0.00 N ATOM 1628 CA VAL A 105 -7.003 -7.503 -9.178 1.00 0.00 C ATOM 1629 C VAL A 105 -5.977 -7.293 -8.073 1.00 0.00 C ATOM 1630 O VAL A 105 -5.118 -8.143 -7.841 1.00 0.00 O ATOM 1631 CB VAL A 105 -7.861 -8.747 -8.859 1.00 0.00 C ATOM 1632 CG1 VAL A 105 -8.489 -8.638 -7.477 1.00 0.00 C ATOM 1633 CG2 VAL A 105 -8.936 -8.933 -9.918 1.00 0.00 C ATOM 0 H VAL A 105 -6.185 -8.587 -10.769 1.00 0.00 H new ATOM 0 HA VAL A 105 -7.668 -6.641 -9.235 1.00 0.00 H new ATOM 0 HB VAL A 105 -7.208 -9.620 -8.865 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -9.088 -9.527 -7.278 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -7.703 -8.554 -6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -9.126 -7.755 -7.436 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -9.533 -9.814 -9.680 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -9.580 -8.054 -9.941 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -8.467 -9.065 -10.893 1.00 0.00 H new ATOM 1643 N MET A 106 -6.059 -6.154 -7.410 1.00 0.00 N ATOM 1644 CA MET A 106 -5.125 -5.823 -6.351 1.00 0.00 C ATOM 1645 C MET A 106 -5.707 -6.215 -5.000 1.00 0.00 C ATOM 1646 O MET A 106 -6.759 -5.718 -4.594 1.00 0.00 O ATOM 1647 CB MET A 106 -4.796 -4.330 -6.372 1.00 0.00 C ATOM 1648 CG MET A 106 -3.741 -3.921 -5.356 1.00 0.00 C ATOM 1649 SD MET A 106 -3.435 -2.144 -5.357 1.00 0.00 S ATOM 1650 CE MET A 106 -5.075 -1.538 -4.978 1.00 0.00 C ATOM 0 H MET A 106 -6.766 -5.440 -7.588 1.00 0.00 H new ATOM 0 HA MET A 106 -4.203 -6.381 -6.514 1.00 0.00 H new ATOM 0 HB2 MET A 106 -4.452 -4.057 -7.370 1.00 0.00 H new ATOM 0 HB3 MET A 106 -5.708 -3.764 -6.183 1.00 0.00 H new ATOM 0 HG2 MET A 106 -4.060 -4.231 -4.361 1.00 0.00 H new ATOM 0 HG3 MET A 106 -2.811 -4.447 -5.571 1.00 0.00 H new ATOM 0 HE1 MET A 106 -5.002 -0.547 -4.529 1.00 0.00 H new ATOM 0 HE2 MET A 106 -5.662 -1.479 -5.895 1.00 0.00 H new ATOM 0 HE3 MET A 106 -5.562 -2.218 -4.279 1.00 0.00 H new ATOM 1660 N ARG A 107 -5.025 -7.120 -4.323 1.00 0.00 N ATOM 1661 CA ARG A 107 -5.477 -7.631 -3.037 1.00 0.00 C ATOM 1662 C ARG A 107 -4.642 -7.051 -1.904 1.00 0.00 C ATOM 1663 O ARG A 107 -3.443 -7.304 -1.817 1.00 0.00 O ATOM 1664 CB ARG A 107 -5.385 -9.161 -3.029 1.00 0.00 C ATOM 1665 CG ARG A 107 -5.705 -9.798 -1.685 1.00 0.00 C ATOM 1666 CD ARG A 107 -5.559 -11.311 -1.742 1.00 0.00 C ATOM 1667 NE ARG A 107 -6.514 -11.918 -2.668 1.00 0.00 N ATOM 1668 CZ ARG A 107 -6.276 -13.013 -3.382 1.00 0.00 C ATOM 1669 NH1 ARG A 107 -5.097 -13.620 -3.315 1.00 0.00 N ATOM 1670 NH2 ARG A 107 -7.224 -13.492 -4.176 1.00 0.00 N ATOM 0 H ARG A 107 -4.145 -7.522 -4.645 1.00 0.00 H new ATOM 0 HA ARG A 107 -6.514 -7.331 -2.886 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -6.069 -9.559 -3.779 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -4.379 -9.455 -3.327 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -5.040 -9.395 -0.921 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -6.722 -9.539 -1.390 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -4.545 -11.566 -2.048 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.705 -11.727 -0.745 1.00 0.00 H new ATOM 0 HE ARG A 107 -7.425 -11.471 -2.773 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -4.365 -13.246 -2.712 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -4.924 -14.460 -3.867 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -8.127 -13.020 -4.235 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -7.051 -14.332 -4.728 1.00 0.00 H new ATOM 1684 N TRP A 108 -5.277 -6.261 -1.054 1.00 0.00 N ATOM 1685 CA TRP A 108 -4.618 -5.725 0.125 1.00 0.00 C ATOM 1686 C TRP A 108 -4.920 -6.586 1.339 1.00 0.00 C ATOM 1687 O TRP A 108 -5.932 -6.399 2.018 1.00 0.00 O ATOM 1688 CB TRP A 108 -5.037 -4.276 0.380 1.00 0.00 C ATOM 1689 CG TRP A 108 -4.289 -3.288 -0.460 1.00 0.00 C ATOM 1690 CD1 TRP A 108 -4.075 -3.352 -1.805 1.00 0.00 C ATOM 1691 CD2 TRP A 108 -3.649 -2.088 -0.008 1.00 0.00 C ATOM 1692 NE1 TRP A 108 -3.341 -2.268 -2.219 1.00 0.00 N ATOM 1693 CE2 TRP A 108 -3.069 -1.476 -1.136 1.00 0.00 C ATOM 1694 CE3 TRP A 108 -3.512 -1.470 1.240 1.00 0.00 C ATOM 1695 CZ2 TRP A 108 -2.361 -0.279 -1.052 1.00 0.00 C ATOM 1696 CZ3 TRP A 108 -2.809 -0.282 1.321 1.00 0.00 C ATOM 1697 CH2 TRP A 108 -2.242 0.303 0.181 1.00 0.00 C ATOM 0 H TRP A 108 -6.251 -5.976 -1.159 1.00 0.00 H new ATOM 0 HA TRP A 108 -3.543 -5.738 -0.055 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -6.105 -4.174 0.185 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -4.881 -4.040 1.433 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -4.431 -4.141 -2.451 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -3.046 -2.083 -3.178 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -3.947 -1.913 2.124 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -1.922 0.174 -1.929 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -2.695 0.203 2.279 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -1.700 1.232 0.277 1.00 0.00 H new ATOM 1708 N THR A 109 -4.056 -7.554 1.571 1.00 0.00 N ATOM 1709 CA THR A 109 -4.161 -8.416 2.730 1.00 0.00 C ATOM 1710 C THR A 109 -3.387 -7.811 3.895 1.00 0.00 C ATOM 1711 O THR A 109 -2.162 -7.917 3.968 1.00 0.00 O ATOM 1712 CB THR A 109 -3.625 -9.830 2.420 1.00 0.00 C ATOM 1713 OG1 THR A 109 -4.373 -10.409 1.342 1.00 0.00 O ATOM 1714 CG2 THR A 109 -3.713 -10.731 3.643 1.00 0.00 C ATOM 0 H THR A 109 -3.264 -7.764 0.963 1.00 0.00 H new ATOM 0 HA THR A 109 -5.214 -8.502 2.999 1.00 0.00 H new ATOM 0 HB THR A 109 -2.577 -9.740 2.134 1.00 0.00 H new ATOM 0 HG1 THR A 109 -5.134 -10.910 1.704 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.329 -11.720 3.395 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.121 -10.304 4.453 1.00 0.00 H new ATOM 0 HG23 THR A 109 -4.753 -10.815 3.959 1.00 0.00 H new ATOM 1722 N GLN A 110 -4.100 -7.141 4.785 1.00 0.00 N ATOM 1723 CA GLN A 110 -3.475 -6.535 5.944 1.00 0.00 C ATOM 1724 C GLN A 110 -3.571 -7.464 7.144 1.00 0.00 C ATOM 1725 O GLN A 110 -4.635 -7.605 7.752 1.00 0.00 O ATOM 1726 CB GLN A 110 -4.119 -5.186 6.271 1.00 0.00 C ATOM 1727 CG GLN A 110 -4.031 -4.178 5.138 1.00 0.00 C ATOM 1728 CD GLN A 110 -4.540 -2.808 5.541 1.00 0.00 C ATOM 1729 OE1 GLN A 110 -5.409 -2.687 6.400 1.00 0.00 O ATOM 1730 NE2 GLN A 110 -4.005 -1.767 4.922 1.00 0.00 N ATOM 0 H GLN A 110 -5.109 -7.004 4.726 1.00 0.00 H new ATOM 0 HA GLN A 110 -2.424 -6.366 5.711 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -5.167 -5.345 6.523 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -3.638 -4.768 7.156 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -2.995 -4.095 4.809 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -4.608 -4.541 4.287 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -3.285 -1.910 4.214 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -4.313 -0.823 5.153 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.465 -8.121 7.455 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.384 -8.968 8.635 1.00 0.00 C ATOM 1741 C ASP A 111 -1.931 -8.115 9.805 1.00 0.00 C ATOM 1742 O ASP A 111 -0.742 -7.818 9.941 1.00 0.00 O ATOM 1743 CB ASP A 111 -1.395 -10.121 8.408 1.00 0.00 C ATOM 1744 CG ASP A 111 -1.530 -11.240 9.425 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -1.889 -10.965 10.585 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -1.283 -12.413 9.055 1.00 0.00 O ATOM 0 H ASP A 111 -1.607 -8.084 6.904 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.362 -9.402 8.842 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.546 -10.528 7.408 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -0.378 -9.730 8.442 1.00 0.00 H new ATOM 1751 N PHE A 112 -2.877 -7.675 10.616 1.00 0.00 N ATOM 1752 CA PHE A 112 -2.557 -6.816 11.738 1.00 0.00 C ATOM 1753 C PHE A 112 -3.084 -7.412 13.031 1.00 0.00 C ATOM 1754 O PHE A 112 -4.124 -8.067 13.050 1.00 0.00 O ATOM 1755 CB PHE A 112 -3.114 -5.397 11.533 1.00 0.00 C ATOM 1756 CG PHE A 112 -4.616 -5.298 11.559 1.00 0.00 C ATOM 1757 CD1 PHE A 112 -5.358 -5.482 10.406 1.00 0.00 C ATOM 1758 CD2 PHE A 112 -5.285 -5.011 12.742 1.00 0.00 C ATOM 1759 CE1 PHE A 112 -6.735 -5.386 10.430 1.00 0.00 C ATOM 1760 CE2 PHE A 112 -6.662 -4.913 12.770 1.00 0.00 C ATOM 1761 CZ PHE A 112 -7.388 -5.101 11.613 1.00 0.00 C ATOM 0 H PHE A 112 -3.868 -7.898 10.518 1.00 0.00 H new ATOM 0 HA PHE A 112 -1.471 -6.743 11.803 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -2.708 -4.747 12.308 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -2.755 -5.016 10.577 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -4.854 -5.703 9.477 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -4.721 -4.863 13.651 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -7.302 -5.534 9.523 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -7.170 -4.689 13.697 1.00 0.00 H new ATOM 0 HZ PHE A 112 -8.465 -5.026 11.632 1.00 0.00 H new ATOM 1771 N ALA A 113 -2.349 -7.190 14.099 1.00 0.00 N ATOM 1772 CA ALA A 113 -2.734 -7.667 15.411 1.00 0.00 C ATOM 1773 C ALA A 113 -2.649 -6.534 16.416 1.00 0.00 C ATOM 1774 O ALA A 113 -1.553 -6.082 16.755 1.00 0.00 O ATOM 1775 CB ALA A 113 -1.838 -8.825 15.829 1.00 0.00 C ATOM 0 H ALA A 113 -1.469 -6.675 14.083 1.00 0.00 H new ATOM 0 HA ALA A 113 -3.763 -8.024 15.376 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -2.135 -9.177 16.817 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -1.935 -9.638 15.110 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -0.801 -8.490 15.860 1.00 0.00 H new ATOM 1781 N MET A 114 -3.797 -6.046 16.864 1.00 0.00 N ATOM 1782 CA MET A 114 -3.826 -4.967 17.838 1.00 0.00 C ATOM 1783 C MET A 114 -4.048 -5.510 19.238 1.00 0.00 C ATOM 1784 O MET A 114 -4.824 -6.443 19.444 1.00 0.00 O ATOM 1785 CB MET A 114 -4.911 -3.945 17.505 1.00 0.00 C ATOM 1786 CG MET A 114 -4.703 -3.247 16.174 1.00 0.00 C ATOM 1787 SD MET A 114 -5.718 -1.769 16.007 1.00 0.00 S ATOM 1788 CE MET A 114 -5.042 -0.749 17.314 1.00 0.00 C ATOM 0 H MET A 114 -4.715 -6.379 16.570 1.00 0.00 H new ATOM 0 HA MET A 114 -2.858 -4.468 17.798 1.00 0.00 H new ATOM 0 HB2 MET A 114 -5.879 -4.446 17.495 1.00 0.00 H new ATOM 0 HB3 MET A 114 -4.948 -3.196 18.296 1.00 0.00 H new ATOM 0 HG2 MET A 114 -3.652 -2.976 16.069 1.00 0.00 H new ATOM 0 HG3 MET A 114 -4.937 -3.938 15.364 1.00 0.00 H new ATOM 0 HE1 MET A 114 -5.186 0.303 17.066 1.00 0.00 H new ATOM 0 HE2 MET A 114 -5.551 -0.974 18.251 1.00 0.00 H new ATOM 0 HE3 MET A 114 -3.977 -0.954 17.421 1.00 0.00 H new ATOM 1798 N LYS A 115 -3.365 -4.916 20.200 1.00 0.00 N ATOM 1799 CA LYS A 115 -3.474 -5.340 21.586 1.00 0.00 C ATOM 1800 C LYS A 115 -2.899 -4.271 22.521 1.00 0.00 C ATOM 1801 O LYS A 115 -3.615 -3.785 23.396 1.00 0.00 O ATOM 1802 CB LYS A 115 -2.778 -6.695 21.795 1.00 0.00 C ATOM 1803 CG LYS A 115 -3.268 -7.462 23.016 1.00 0.00 C ATOM 1804 CD LYS A 115 -2.639 -8.848 23.103 1.00 0.00 C ATOM 1805 CE LYS A 115 -1.371 -8.862 23.950 1.00 0.00 C ATOM 1806 NZ LYS A 115 -0.350 -7.890 23.477 1.00 0.00 N ATOM 0 H LYS A 115 -2.726 -4.136 20.047 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.529 -5.466 21.828 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.929 -7.310 20.908 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.705 -6.530 21.889 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.032 -6.898 23.918 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.353 -7.557 22.974 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.362 -9.546 23.526 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -2.405 -9.201 22.099 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.629 -8.636 24.985 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.944 -9.865 23.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.572 -8.121 23.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -0.278 -7.939 22.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.629 -6.929 23.760 1.00 0.00 H new ATOM 1820 N PRO A 116 -1.610 -3.869 22.351 1.00 0.00 N ATOM 1821 CA PRO A 116 -0.995 -2.830 23.190 1.00 0.00 C ATOM 1822 C PRO A 116 -1.779 -1.520 23.177 1.00 0.00 C ATOM 1823 O PRO A 116 -1.706 -0.746 22.218 1.00 0.00 O ATOM 1824 CB PRO A 116 0.400 -2.624 22.582 1.00 0.00 C ATOM 1825 CG PRO A 116 0.351 -3.278 21.244 1.00 0.00 C ATOM 1826 CD PRO A 116 -0.643 -4.390 21.366 1.00 0.00 C ATOM 0 HA PRO A 116 -0.970 -3.136 24.236 1.00 0.00 H new ATOM 0 HB2 PRO A 116 0.636 -1.564 22.492 1.00 0.00 H new ATOM 0 HB3 PRO A 116 1.171 -3.071 23.209 1.00 0.00 H new ATOM 0 HG2 PRO A 116 0.050 -2.568 20.473 1.00 0.00 H new ATOM 0 HG3 PRO A 116 1.332 -3.660 20.960 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -1.120 -4.611 20.411 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -0.175 -5.313 21.710 1.00 0.00 H new ATOM 1834 N ASP A 117 -2.542 -1.308 24.246 1.00 0.00 N ATOM 1835 CA ASP A 117 -3.368 -0.114 24.423 1.00 0.00 C ATOM 1836 C ASP A 117 -4.341 0.059 23.258 1.00 0.00 C ATOM 1837 O ASP A 117 -4.645 1.175 22.836 1.00 0.00 O ATOM 1838 CB ASP A 117 -2.491 1.132 24.591 1.00 0.00 C ATOM 1839 CG ASP A 117 -3.251 2.284 25.220 1.00 0.00 C ATOM 1840 OD1 ASP A 117 -3.970 2.051 26.217 1.00 0.00 O ATOM 1841 OD2 ASP A 117 -3.136 3.426 24.726 1.00 0.00 O ATOM 0 H ASP A 117 -2.606 -1.966 25.023 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.955 -0.243 25.332 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -1.628 0.887 25.210 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -2.108 1.439 23.618 1.00 0.00 H new ATOM 1846 N ALA A 118 -4.845 -1.059 22.753 1.00 0.00 N ATOM 1847 CA ALA A 118 -5.796 -1.040 21.654 1.00 0.00 C ATOM 1848 C ALA A 118 -7.223 -0.902 22.174 1.00 0.00 C ATOM 1849 O ALA A 118 -7.746 -1.806 22.824 1.00 0.00 O ATOM 1850 CB ALA A 118 -5.659 -2.300 20.814 1.00 0.00 C ATOM 0 H ALA A 118 -4.609 -1.993 23.089 1.00 0.00 H new ATOM 0 HA ALA A 118 -5.576 -0.176 21.027 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -6.378 -2.271 19.995 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -4.649 -2.359 20.409 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.852 -3.174 21.435 1.00 0.00 H new ATOM 1856 N PRO A 119 -7.871 0.240 21.896 1.00 0.00 N ATOM 1857 CA PRO A 119 -9.251 0.491 22.316 1.00 0.00 C ATOM 1858 C PRO A 119 -10.263 -0.165 21.379 1.00 0.00 C ATOM 1859 O PRO A 119 -11.472 -0.092 21.595 1.00 0.00 O ATOM 1860 CB PRO A 119 -9.352 2.012 22.242 1.00 0.00 C ATOM 1861 CG PRO A 119 -8.427 2.392 21.137 1.00 0.00 C ATOM 1862 CD PRO A 119 -7.305 1.388 21.159 1.00 0.00 C ATOM 0 HA PRO A 119 -9.473 0.080 23.301 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -10.373 2.333 22.034 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -9.058 2.476 23.183 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -8.942 2.378 20.177 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -8.046 3.403 21.279 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -7.002 1.105 20.151 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -6.422 1.787 21.658 1.00 0.00 H new ATOM 1870 N VAL A 120 -9.754 -0.803 20.336 1.00 0.00 N ATOM 1871 CA VAL A 120 -10.594 -1.464 19.354 1.00 0.00 C ATOM 1872 C VAL A 120 -10.353 -2.965 19.362 1.00 0.00 C ATOM 1873 O VAL A 120 -9.290 -3.429 19.767 1.00 0.00 O ATOM 1874 CB VAL A 120 -10.352 -0.913 17.936 1.00 0.00 C ATOM 1875 CG1 VAL A 120 -10.948 0.478 17.796 1.00 0.00 C ATOM 1876 CG2 VAL A 120 -8.865 -0.891 17.618 1.00 0.00 C ATOM 0 H VAL A 120 -8.754 -0.876 20.149 1.00 0.00 H new ATOM 0 HA VAL A 120 -11.629 -1.262 19.630 1.00 0.00 H new ATOM 0 HB VAL A 120 -10.846 -1.572 17.222 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -10.767 0.851 16.788 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -12.021 0.434 17.980 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -10.483 1.148 18.520 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -8.714 -0.499 16.612 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -8.349 -0.255 18.337 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -8.465 -1.903 17.676 1.00 0.00 H new ATOM 1886 N ASP A 121 -11.340 -3.711 18.895 1.00 0.00 N ATOM 1887 CA ASP A 121 -11.302 -5.169 18.946 1.00 0.00 C ATOM 1888 C ASP A 121 -10.827 -5.734 17.610 1.00 0.00 C ATOM 1889 O ASP A 121 -11.195 -6.844 17.218 1.00 0.00 O ATOM 1890 CB ASP A 121 -12.700 -5.689 19.296 1.00 0.00 C ATOM 1891 CG ASP A 121 -12.747 -7.185 19.533 1.00 0.00 C ATOM 1892 OD1 ASP A 121 -12.053 -7.671 20.447 1.00 0.00 O ATOM 1893 OD2 ASP A 121 -13.498 -7.877 18.813 1.00 0.00 O ATOM 0 H ASP A 121 -12.186 -3.330 18.472 1.00 0.00 H new ATOM 0 HA ASP A 121 -10.598 -5.494 19.712 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -13.056 -5.176 20.189 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -13.386 -5.435 18.488 1.00 0.00 H new ATOM 1898 N ASP A 122 -9.995 -4.948 16.923 1.00 0.00 N ATOM 1899 CA ASP A 122 -9.456 -5.292 15.597 1.00 0.00 C ATOM 1900 C ASP A 122 -10.547 -5.255 14.533 1.00 0.00 C ATOM 1901 O ASP A 122 -10.370 -4.647 13.481 1.00 0.00 O ATOM 1902 CB ASP A 122 -8.767 -6.662 15.598 1.00 0.00 C ATOM 1903 CG ASP A 122 -7.588 -6.726 16.549 1.00 0.00 C ATOM 1904 OD1 ASP A 122 -7.817 -6.898 17.765 1.00 0.00 O ATOM 1905 OD2 ASP A 122 -6.433 -6.616 16.089 1.00 0.00 O ATOM 0 H ASP A 122 -9.671 -4.046 17.271 1.00 0.00 H new ATOM 0 HA ASP A 122 -8.706 -4.539 15.356 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -9.492 -7.428 15.873 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -8.427 -6.893 14.589 1.00 0.00 H new ATOM 1910 N ALA A 123 -11.677 -5.894 14.818 1.00 0.00 N ATOM 1911 CA ALA A 123 -12.826 -5.875 13.924 1.00 0.00 C ATOM 1912 C ALA A 123 -13.282 -4.446 13.665 1.00 0.00 C ATOM 1913 O ALA A 123 -13.718 -4.112 12.566 1.00 0.00 O ATOM 1914 CB ALA A 123 -13.961 -6.695 14.512 1.00 0.00 C ATOM 0 H ALA A 123 -11.820 -6.436 15.670 1.00 0.00 H new ATOM 0 HA ALA A 123 -12.531 -6.317 12.972 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -14.815 -6.673 13.834 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -13.633 -7.725 14.649 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -14.252 -6.276 15.475 1.00 0.00 H new ATOM 1920 N TRP A 124 -13.171 -3.602 14.689 1.00 0.00 N ATOM 1921 CA TRP A 124 -13.485 -2.186 14.545 1.00 0.00 C ATOM 1922 C TRP A 124 -12.591 -1.548 13.492 1.00 0.00 C ATOM 1923 O TRP A 124 -13.045 -0.747 12.675 1.00 0.00 O ATOM 1924 CB TRP A 124 -13.319 -1.452 15.872 1.00 0.00 C ATOM 1925 CG TRP A 124 -14.394 -1.762 16.860 1.00 0.00 C ATOM 1926 CD1 TRP A 124 -14.317 -2.624 17.912 1.00 0.00 C ATOM 1927 CD2 TRP A 124 -15.714 -1.212 16.884 1.00 0.00 C ATOM 1928 NE1 TRP A 124 -15.506 -2.640 18.593 1.00 0.00 N ATOM 1929 CE2 TRP A 124 -16.382 -1.782 17.981 1.00 0.00 C ATOM 1930 CE3 TRP A 124 -16.397 -0.289 16.085 1.00 0.00 C ATOM 1931 CZ2 TRP A 124 -17.698 -1.462 18.300 1.00 0.00 C ATOM 1932 CZ3 TRP A 124 -17.702 0.028 16.402 1.00 0.00 C ATOM 1933 CH2 TRP A 124 -18.342 -0.557 17.502 1.00 0.00 C ATOM 0 H TRP A 124 -12.867 -3.875 15.624 1.00 0.00 H new ATOM 0 HA TRP A 124 -14.525 -2.105 14.229 1.00 0.00 H new ATOM 0 HB2 TRP A 124 -12.353 -1.712 16.304 1.00 0.00 H new ATOM 0 HB3 TRP A 124 -13.306 -0.378 15.685 1.00 0.00 H new ATOM 0 HD1 TRP A 124 -13.447 -3.209 18.171 1.00 0.00 H new ATOM 0 HE1 TRP A 124 -15.707 -3.200 19.422 1.00 0.00 H new ATOM 0 HE3 TRP A 124 -15.912 0.167 15.235 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 -18.193 -1.912 19.148 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 -18.239 0.739 15.792 1.00 0.00 H new ATOM 0 HH2 TRP A 124 -19.364 -0.288 17.724 1.00 0.00 H new ATOM 1944 N MET A 125 -11.318 -1.921 13.513 1.00 0.00 N ATOM 1945 CA MET A 125 -10.373 -1.432 12.527 1.00 0.00 C ATOM 1946 C MET A 125 -10.725 -1.981 11.160 1.00 0.00 C ATOM 1947 O MET A 125 -10.847 -1.224 10.209 1.00 0.00 O ATOM 1948 CB MET A 125 -8.939 -1.819 12.892 1.00 0.00 C ATOM 1949 CG MET A 125 -8.422 -1.130 14.141 1.00 0.00 C ATOM 1950 SD MET A 125 -8.402 0.668 13.993 1.00 0.00 S ATOM 1951 CE MET A 125 -7.257 0.888 12.631 1.00 0.00 C ATOM 0 H MET A 125 -10.920 -2.559 14.202 1.00 0.00 H new ATOM 0 HA MET A 125 -10.434 -0.344 12.509 1.00 0.00 H new ATOM 0 HB2 MET A 125 -8.888 -2.898 13.035 1.00 0.00 H new ATOM 0 HB3 MET A 125 -8.283 -1.577 12.056 1.00 0.00 H new ATOM 0 HG2 MET A 125 -9.044 -1.413 14.990 1.00 0.00 H new ATOM 0 HG3 MET A 125 -7.413 -1.483 14.354 1.00 0.00 H new ATOM 0 HE1 MET A 125 -6.894 1.916 12.623 1.00 0.00 H new ATOM 0 HE2 MET A 125 -6.415 0.206 12.750 1.00 0.00 H new ATOM 0 HE3 MET A 125 -7.765 0.676 11.690 1.00 0.00 H new ATOM 1961 N THR A 126 -10.913 -3.296 11.082 1.00 0.00 N ATOM 1962 CA THR A 126 -11.262 -3.957 9.829 1.00 0.00 C ATOM 1963 C THR A 126 -12.469 -3.297 9.162 1.00 0.00 C ATOM 1964 O THR A 126 -12.434 -3.009 7.969 1.00 0.00 O ATOM 1965 CB THR A 126 -11.548 -5.456 10.055 1.00 0.00 C ATOM 1966 OG1 THR A 126 -10.376 -6.093 10.576 1.00 0.00 O ATOM 1967 CG2 THR A 126 -11.966 -6.144 8.762 1.00 0.00 C ATOM 0 H THR A 126 -10.829 -3.928 11.878 1.00 0.00 H new ATOM 0 HA THR A 126 -10.404 -3.856 9.165 1.00 0.00 H new ATOM 0 HB THR A 126 -12.369 -5.541 10.766 1.00 0.00 H new ATOM 0 HG1 THR A 126 -9.695 -6.151 9.873 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.160 -7.199 8.957 1.00 0.00 H new ATOM 0 HG22 THR A 126 -12.871 -5.674 8.376 1.00 0.00 H new ATOM 0 HG23 THR A 126 -11.167 -6.052 8.026 1.00 0.00 H new ATOM 1975 N ASP A 127 -13.516 -3.031 9.938 1.00 0.00 N ATOM 1976 CA ASP A 127 -14.720 -2.397 9.405 1.00 0.00 C ATOM 1977 C ASP A 127 -14.379 -1.054 8.770 1.00 0.00 C ATOM 1978 O ASP A 127 -14.758 -0.781 7.630 1.00 0.00 O ATOM 1979 CB ASP A 127 -15.764 -2.195 10.506 1.00 0.00 C ATOM 1980 CG ASP A 127 -17.084 -1.685 9.959 1.00 0.00 C ATOM 1981 OD1 ASP A 127 -17.940 -2.520 9.595 1.00 0.00 O ATOM 1982 OD2 ASP A 127 -17.274 -0.456 9.886 1.00 0.00 O ATOM 0 H ASP A 127 -13.556 -3.243 10.935 1.00 0.00 H new ATOM 0 HA ASP A 127 -15.137 -3.057 8.644 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -15.929 -3.139 11.026 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -15.381 -1.489 11.242 1.00 0.00 H new ATOM 1987 N ASN A 128 -13.645 -0.232 9.510 1.00 0.00 N ATOM 1988 CA ASN A 128 -13.230 1.080 9.024 1.00 0.00 C ATOM 1989 C ASN A 128 -12.253 0.940 7.861 1.00 0.00 C ATOM 1990 O ASN A 128 -12.301 1.711 6.903 1.00 0.00 O ATOM 1991 CB ASN A 128 -12.593 1.894 10.157 1.00 0.00 C ATOM 1992 CG ASN A 128 -12.156 3.279 9.711 1.00 0.00 C ATOM 1993 OD1 ASN A 128 -12.948 4.222 9.710 1.00 0.00 O ATOM 1994 ND2 ASN A 128 -10.888 3.419 9.350 1.00 0.00 N ATOM 0 H ASN A 128 -13.323 -0.451 10.453 1.00 0.00 H new ATOM 0 HA ASN A 128 -14.115 1.608 8.669 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -13.306 1.989 10.976 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -11.730 1.353 10.547 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -10.539 4.332 9.058 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -10.262 2.614 9.364 1.00 0.00 H new ATOM 2001 N ILE A 129 -11.375 -0.055 7.949 1.00 0.00 N ATOM 2002 CA ILE A 129 -10.407 -0.330 6.896 1.00 0.00 C ATOM 2003 C ILE A 129 -11.116 -0.713 5.607 1.00 0.00 C ATOM 2004 O ILE A 129 -10.785 -0.195 4.556 1.00 0.00 O ATOM 2005 CB ILE A 129 -9.410 -1.444 7.301 1.00 0.00 C ATOM 2006 CG1 ILE A 129 -8.481 -0.944 8.413 1.00 0.00 C ATOM 2007 CG2 ILE A 129 -8.596 -1.910 6.098 1.00 0.00 C ATOM 2008 CD1 ILE A 129 -7.547 -2.007 8.953 1.00 0.00 C ATOM 0 H ILE A 129 -11.316 -0.688 8.747 1.00 0.00 H new ATOM 0 HA ILE A 129 -9.837 0.585 6.736 1.00 0.00 H new ATOM 0 HB ILE A 129 -9.980 -2.295 7.674 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -7.888 -0.112 8.032 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -9.086 -0.555 9.232 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -7.903 -2.692 6.408 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -9.268 -2.302 5.334 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -8.035 -1.069 5.691 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -6.921 -1.578 9.736 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -8.131 -2.829 9.365 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -6.915 -2.380 8.147 1.00 0.00 H new ATOM 2020 N ASN A 130 -12.107 -1.597 5.699 1.00 0.00 N ATOM 2021 CA ASN A 130 -12.891 -1.998 4.529 1.00 0.00 C ATOM 2022 C ASN A 130 -13.451 -0.773 3.820 1.00 0.00 C ATOM 2023 O ASN A 130 -13.345 -0.640 2.600 1.00 0.00 O ATOM 2024 CB ASN A 130 -14.052 -2.919 4.928 1.00 0.00 C ATOM 2025 CG ASN A 130 -13.606 -4.269 5.465 1.00 0.00 C ATOM 2026 OD1 ASN A 130 -14.277 -4.859 6.312 1.00 0.00 O ATOM 2027 ND2 ASN A 130 -12.480 -4.773 4.977 1.00 0.00 N ATOM 0 H ASN A 130 -12.387 -2.050 6.569 1.00 0.00 H new ATOM 0 HA ASN A 130 -12.224 -2.540 3.858 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -14.657 -2.419 5.685 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -14.693 -3.077 4.061 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -12.143 -5.679 5.303 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -11.951 -4.255 4.276 1.00 0.00 H new ATOM 2034 N ARG A 131 -14.021 0.132 4.605 1.00 0.00 N ATOM 2035 CA ARG A 131 -14.633 1.340 4.070 1.00 0.00 C ATOM 2036 C ARG A 131 -13.580 2.274 3.482 1.00 0.00 C ATOM 2037 O ARG A 131 -13.694 2.720 2.337 1.00 0.00 O ATOM 2038 CB ARG A 131 -15.411 2.058 5.172 1.00 0.00 C ATOM 2039 CG ARG A 131 -16.418 1.165 5.872 1.00 0.00 C ATOM 2040 CD ARG A 131 -17.154 1.903 6.975 1.00 0.00 C ATOM 2041 NE ARG A 131 -18.001 1.002 7.752 1.00 0.00 N ATOM 2042 CZ ARG A 131 -19.311 0.862 7.572 1.00 0.00 C ATOM 2043 NH1 ARG A 131 -19.943 1.564 6.638 1.00 0.00 N ATOM 2044 NH2 ARG A 131 -19.991 0.013 8.331 1.00 0.00 N ATOM 0 H ARG A 131 -14.072 0.051 5.620 1.00 0.00 H new ATOM 0 HA ARG A 131 -15.317 1.053 3.271 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -14.709 2.449 5.908 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -15.931 2.914 4.742 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -17.137 0.788 5.145 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -15.906 0.300 6.293 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -16.433 2.385 7.635 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -17.766 2.693 6.540 1.00 0.00 H new ATOM 0 HE ARG A 131 -17.558 0.443 8.481 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -19.423 2.217 6.052 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -20.948 1.450 6.507 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -19.509 -0.529 9.048 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -20.996 -0.098 8.197 1.00 0.00 H new ATOM 2058 N ASN A 132 -12.547 2.557 4.265 1.00 0.00 N ATOM 2059 CA ASN A 132 -11.490 3.468 3.835 1.00 0.00 C ATOM 2060 C ASN A 132 -10.707 2.876 2.669 1.00 0.00 C ATOM 2061 O ASN A 132 -10.225 3.607 1.804 1.00 0.00 O ATOM 2062 CB ASN A 132 -10.537 3.785 4.991 1.00 0.00 C ATOM 2063 CG ASN A 132 -9.519 4.850 4.624 1.00 0.00 C ATOM 2064 OD1 ASN A 132 -9.813 5.768 3.857 1.00 0.00 O ATOM 2065 ND2 ASN A 132 -8.316 4.734 5.163 1.00 0.00 N ATOM 0 H ASN A 132 -12.417 2.170 5.200 1.00 0.00 H new ATOM 0 HA ASN A 132 -11.964 4.394 3.508 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -11.114 4.119 5.853 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -10.016 2.875 5.289 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -7.592 5.420 4.948 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -8.112 3.959 5.794 1.00 0.00 H new ATOM 2072 N SER A 133 -10.588 1.554 2.647 1.00 0.00 N ATOM 2073 CA SER A 133 -9.918 0.867 1.558 1.00 0.00 C ATOM 2074 C SER A 133 -10.630 1.172 0.254 1.00 0.00 C ATOM 2075 O SER A 133 -9.995 1.471 -0.745 1.00 0.00 O ATOM 2076 CB SER A 133 -9.877 -0.649 1.794 1.00 0.00 C ATOM 2077 OG SER A 133 -9.047 -1.295 0.843 1.00 0.00 O ATOM 0 H SER A 133 -10.949 0.938 3.375 1.00 0.00 H new ATOM 0 HA SER A 133 -8.889 1.223 1.508 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.509 -0.853 2.800 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.886 -1.056 1.735 1.00 0.00 H new ATOM 0 HG SER A 133 -8.509 -0.626 0.370 1.00 0.00 H new ATOM 2083 N ARG A 134 -11.955 1.129 0.274 1.00 0.00 N ATOM 2084 CA ARG A 134 -12.729 1.474 -0.907 1.00 0.00 C ATOM 2085 C ARG A 134 -12.414 2.899 -1.343 1.00 0.00 C ATOM 2086 O ARG A 134 -12.269 3.176 -2.530 1.00 0.00 O ATOM 2087 CB ARG A 134 -14.226 1.313 -0.646 1.00 0.00 C ATOM 2088 CG ARG A 134 -14.625 -0.107 -0.289 1.00 0.00 C ATOM 2089 CD ARG A 134 -16.134 -0.272 -0.254 1.00 0.00 C ATOM 2090 NE ARG A 134 -16.775 0.615 0.714 1.00 0.00 N ATOM 2091 CZ ARG A 134 -18.057 0.526 1.058 1.00 0.00 C ATOM 2092 NH1 ARG A 134 -18.840 -0.381 0.486 1.00 0.00 N ATOM 2093 NH2 ARG A 134 -18.563 1.361 1.952 1.00 0.00 N ATOM 0 H ARG A 134 -12.510 0.861 1.087 1.00 0.00 H new ATOM 0 HA ARG A 134 -12.452 0.791 -1.710 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -14.520 1.980 0.164 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -14.778 1.626 -1.532 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -14.200 -0.799 -1.016 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -14.207 -0.369 0.683 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -16.540 -0.075 -1.246 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -16.377 -1.306 -0.010 1.00 0.00 H new ATOM 0 HE ARG A 134 -16.208 1.342 1.150 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -18.459 -1.012 -0.219 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -19.823 -0.447 0.752 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -17.970 2.073 2.378 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -19.546 1.292 2.215 1.00 0.00 H new ATOM 2107 N THR A 135 -12.281 3.794 -0.375 1.00 0.00 N ATOM 2108 CA THR A 135 -11.941 5.180 -0.658 1.00 0.00 C ATOM 2109 C THR A 135 -10.537 5.296 -1.264 1.00 0.00 C ATOM 2110 O THR A 135 -10.371 5.761 -2.394 1.00 0.00 O ATOM 2111 CB THR A 135 -12.005 6.034 0.624 1.00 0.00 C ATOM 2112 OG1 THR A 135 -13.239 5.792 1.315 1.00 0.00 O ATOM 2113 CG2 THR A 135 -11.887 7.518 0.302 1.00 0.00 C ATOM 0 H THR A 135 -12.404 3.584 0.616 1.00 0.00 H new ATOM 0 HA THR A 135 -12.672 5.549 -1.378 1.00 0.00 H new ATOM 0 HB THR A 135 -11.166 5.749 1.259 1.00 0.00 H new ATOM 0 HG1 THR A 135 -13.271 6.337 2.129 1.00 0.00 H new ATOM 0 HG21 THR A 135 -11.935 8.096 1.225 1.00 0.00 H new ATOM 0 HG22 THR A 135 -10.936 7.708 -0.195 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.705 7.814 -0.354 1.00 0.00 H new ATOM 2121 N GLN A 136 -9.536 4.844 -0.516 1.00 0.00 N ATOM 2122 CA GLN A 136 -8.140 5.023 -0.904 1.00 0.00 C ATOM 2123 C GLN A 136 -7.751 4.135 -2.082 1.00 0.00 C ATOM 2124 O GLN A 136 -7.086 4.591 -3.012 1.00 0.00 O ATOM 2125 CB GLN A 136 -7.215 4.750 0.284 1.00 0.00 C ATOM 2126 CG GLN A 136 -7.358 5.759 1.412 1.00 0.00 C ATOM 2127 CD GLN A 136 -6.421 5.478 2.571 1.00 0.00 C ATOM 2128 OE1 GLN A 136 -6.085 4.329 2.849 1.00 0.00 O ATOM 2129 NE2 GLN A 136 -5.982 6.531 3.247 1.00 0.00 N ATOM 0 H GLN A 136 -9.666 4.349 0.366 1.00 0.00 H new ATOM 0 HA GLN A 136 -8.026 6.060 -1.221 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -7.421 3.752 0.672 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -6.182 4.750 -0.063 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -7.162 6.759 1.026 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -8.387 5.752 1.772 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -6.285 7.469 2.984 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -5.341 6.403 4.030 1.00 0.00 H new ATOM 2138 N MET A 137 -8.164 2.872 -2.050 1.00 0.00 N ATOM 2139 CA MET A 137 -7.805 1.931 -3.106 1.00 0.00 C ATOM 2140 C MET A 137 -8.448 2.323 -4.426 1.00 0.00 C ATOM 2141 O MET A 137 -7.834 2.167 -5.472 1.00 0.00 O ATOM 2142 CB MET A 137 -8.193 0.491 -2.747 1.00 0.00 C ATOM 2143 CG MET A 137 -7.179 -0.259 -1.884 1.00 0.00 C ATOM 2144 SD MET A 137 -6.857 0.515 -0.282 1.00 0.00 S ATOM 2145 CE MET A 137 -5.493 1.604 -0.687 1.00 0.00 C ATOM 0 H MET A 137 -8.744 2.478 -1.309 1.00 0.00 H new ATOM 0 HA MET A 137 -6.721 1.973 -3.211 1.00 0.00 H new ATOM 0 HB2 MET A 137 -9.149 0.509 -2.224 1.00 0.00 H new ATOM 0 HB3 MET A 137 -8.345 -0.068 -3.670 1.00 0.00 H new ATOM 0 HG2 MET A 137 -7.539 -1.274 -1.719 1.00 0.00 H new ATOM 0 HG3 MET A 137 -6.240 -0.339 -2.432 1.00 0.00 H new ATOM 0 HE1 MET A 137 -4.791 1.633 0.146 1.00 0.00 H new ATOM 0 HE2 MET A 137 -4.984 1.234 -1.577 1.00 0.00 H new ATOM 0 HE3 MET A 137 -5.873 2.608 -0.877 1.00 0.00 H new ATOM 2155 N ALA A 138 -9.678 2.836 -4.386 1.00 0.00 N ATOM 2156 CA ALA A 138 -10.333 3.295 -5.607 1.00 0.00 C ATOM 2157 C ALA A 138 -9.664 4.559 -6.127 1.00 0.00 C ATOM 2158 O ALA A 138 -9.533 4.750 -7.337 1.00 0.00 O ATOM 2159 CB ALA A 138 -11.815 3.535 -5.384 1.00 0.00 C ATOM 0 H ALA A 138 -10.232 2.942 -3.536 1.00 0.00 H new ATOM 0 HA ALA A 138 -10.230 2.509 -6.355 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -12.272 3.876 -6.313 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -12.290 2.607 -5.065 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -11.949 4.295 -4.614 1.00 0.00 H new ATOM 2165 N LEU A 139 -9.241 5.416 -5.204 1.00 0.00 N ATOM 2166 CA LEU A 139 -8.510 6.625 -5.559 1.00 0.00 C ATOM 2167 C LEU A 139 -7.250 6.251 -6.332 1.00 0.00 C ATOM 2168 O LEU A 139 -7.005 6.761 -7.425 1.00 0.00 O ATOM 2169 CB LEU A 139 -8.171 7.422 -4.287 1.00 0.00 C ATOM 2170 CG LEU A 139 -7.542 8.807 -4.495 1.00 0.00 C ATOM 2171 CD1 LEU A 139 -7.812 9.690 -3.288 1.00 0.00 C ATOM 2172 CD2 LEU A 139 -6.041 8.698 -4.719 1.00 0.00 C ATOM 0 H LEU A 139 -9.393 5.295 -4.203 1.00 0.00 H new ATOM 0 HA LEU A 139 -9.128 7.257 -6.198 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -9.086 7.546 -3.708 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -7.489 6.825 -3.682 1.00 0.00 H new ATOM 0 HG LEU A 139 -7.994 9.252 -5.381 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.362 10.670 -3.446 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.888 9.803 -3.153 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.381 9.232 -2.398 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -5.621 9.694 -4.863 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -5.576 8.231 -3.851 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.848 8.091 -5.604 1.00 0.00 H new ATOM 2184 N ILE A 140 -6.470 5.334 -5.766 1.00 0.00 N ATOM 2185 CA ILE A 140 -5.268 4.834 -6.422 1.00 0.00 C ATOM 2186 C ILE A 140 -5.637 4.076 -7.696 1.00 0.00 C ATOM 2187 O ILE A 140 -4.967 4.201 -8.721 1.00 0.00 O ATOM 2188 CB ILE A 140 -4.463 3.904 -5.483 1.00 0.00 C ATOM 2189 CG1 ILE A 140 -4.034 4.660 -4.221 1.00 0.00 C ATOM 2190 CG2 ILE A 140 -3.246 3.333 -6.201 1.00 0.00 C ATOM 2191 CD1 ILE A 140 -3.312 3.793 -3.211 1.00 0.00 C ATOM 0 H ILE A 140 -6.651 4.921 -4.851 1.00 0.00 H new ATOM 0 HA ILE A 140 -4.646 5.693 -6.676 1.00 0.00 H new ATOM 0 HB ILE A 140 -5.106 3.075 -5.190 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -3.385 5.488 -4.507 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -4.916 5.094 -3.750 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -2.695 2.682 -5.522 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -3.571 2.760 -7.069 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -2.600 4.148 -6.526 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -3.039 4.395 -2.344 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -3.966 2.980 -2.896 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -2.411 3.380 -3.664 1.00 0.00 H new ATOM 2203 N ARG A 141 -6.722 3.313 -7.612 1.00 0.00 N ATOM 2204 CA ARG A 141 -7.214 2.499 -8.721 1.00 0.00 C ATOM 2205 C ARG A 141 -7.367 3.335 -9.986 1.00 0.00 C ATOM 2206 O ARG A 141 -6.784 3.020 -11.021 1.00 0.00 O ATOM 2207 CB ARG A 141 -8.568 1.887 -8.355 1.00 0.00 C ATOM 2208 CG ARG A 141 -8.951 0.675 -9.183 1.00 0.00 C ATOM 2209 CD ARG A 141 -10.448 0.628 -9.443 1.00 0.00 C ATOM 2210 NE ARG A 141 -10.847 1.666 -10.385 1.00 0.00 N ATOM 2211 CZ ARG A 141 -10.783 1.514 -11.704 1.00 0.00 C ATOM 2212 NH1 ARG A 141 -10.477 0.331 -12.222 1.00 0.00 N ATOM 2213 NH2 ARG A 141 -11.050 2.531 -12.506 1.00 0.00 N ATOM 0 H ARG A 141 -7.289 3.241 -6.767 1.00 0.00 H new ATOM 0 HA ARG A 141 -6.488 1.708 -8.909 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -8.552 1.603 -7.303 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -9.340 2.648 -8.468 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -8.416 0.698 -10.133 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -8.642 -0.233 -8.665 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.722 -0.351 -9.837 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -10.988 0.756 -8.505 1.00 0.00 H new ATOM 0 HE ARG A 141 -11.192 2.552 -10.014 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -10.291 -0.462 -11.608 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -10.428 0.215 -13.234 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -11.306 3.437 -12.113 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -11.000 2.410 -13.518 1.00 0.00 H new ATOM 2227 N ASP A 142 -8.147 4.406 -9.890 1.00 0.00 N ATOM 2228 CA ASP A 142 -8.380 5.281 -11.035 1.00 0.00 C ATOM 2229 C ASP A 142 -7.112 6.042 -11.390 1.00 0.00 C ATOM 2230 O ASP A 142 -6.789 6.204 -12.561 1.00 0.00 O ATOM 2231 CB ASP A 142 -9.518 6.268 -10.757 1.00 0.00 C ATOM 2232 CG ASP A 142 -10.865 5.589 -10.623 1.00 0.00 C ATOM 2233 OD1 ASP A 142 -11.332 4.976 -11.604 1.00 0.00 O ATOM 2234 OD2 ASP A 142 -11.466 5.661 -9.534 1.00 0.00 O ATOM 0 H ASP A 142 -8.627 4.689 -9.036 1.00 0.00 H new ATOM 0 HA ASP A 142 -8.668 4.653 -11.878 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -9.301 6.817 -9.841 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -9.564 6.999 -11.564 1.00 0.00 H new ATOM 2239 N ARG A 143 -6.395 6.487 -10.366 1.00 0.00 N ATOM 2240 CA ARG A 143 -5.145 7.224 -10.539 1.00 0.00 C ATOM 2241 C ARG A 143 -4.179 6.461 -11.451 1.00 0.00 C ATOM 2242 O ARG A 143 -3.688 7.000 -12.448 1.00 0.00 O ATOM 2243 CB ARG A 143 -4.503 7.457 -9.166 1.00 0.00 C ATOM 2244 CG ARG A 143 -3.273 8.352 -9.174 1.00 0.00 C ATOM 2245 CD ARG A 143 -3.619 9.793 -9.515 1.00 0.00 C ATOM 2246 NE ARG A 143 -2.549 10.713 -9.131 1.00 0.00 N ATOM 2247 CZ ARG A 143 -1.924 11.531 -9.976 1.00 0.00 C ATOM 2248 NH1 ARG A 143 -2.208 11.503 -11.275 1.00 0.00 N ATOM 2249 NH2 ARG A 143 -1.005 12.373 -9.521 1.00 0.00 N ATOM 0 H ARG A 143 -6.662 6.348 -9.391 1.00 0.00 H new ATOM 0 HA ARG A 143 -5.363 8.182 -11.010 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -5.249 7.896 -8.503 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -4.228 6.491 -8.742 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -2.792 8.316 -8.196 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -2.552 7.971 -9.898 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -3.805 9.879 -10.586 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -4.541 10.076 -9.007 1.00 0.00 H new ATOM 0 HE ARG A 143 -2.263 10.729 -8.152 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -2.909 10.852 -11.630 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -1.725 12.132 -11.916 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -0.779 12.393 -8.527 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -0.525 13.001 -10.166 1.00 0.00 H new ATOM 2263 N ILE A 144 -3.932 5.198 -11.119 1.00 0.00 N ATOM 2264 CA ILE A 144 -2.992 4.385 -11.878 1.00 0.00 C ATOM 2265 C ILE A 144 -3.606 3.918 -13.199 1.00 0.00 C ATOM 2266 O ILE A 144 -2.900 3.751 -14.193 1.00 0.00 O ATOM 2267 CB ILE A 144 -2.490 3.168 -11.059 1.00 0.00 C ATOM 2268 CG1 ILE A 144 -1.360 2.454 -11.805 1.00 0.00 C ATOM 2269 CG2 ILE A 144 -3.628 2.200 -10.758 1.00 0.00 C ATOM 2270 CD1 ILE A 144 -0.753 1.306 -11.032 1.00 0.00 C ATOM 0 H ILE A 144 -4.369 4.718 -10.332 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.132 5.017 -12.099 1.00 0.00 H new ATOM 0 HB ILE A 144 -2.104 3.536 -10.108 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -1.743 2.079 -12.754 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -0.578 3.176 -12.040 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -3.246 1.357 -10.183 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -4.399 2.712 -10.182 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -4.054 1.838 -11.693 1.00 0.00 H new ATOM 0 HD11 ILE A 144 0.040 0.849 -11.623 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -0.339 1.677 -10.094 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -1.522 0.563 -10.820 1.00 0.00 H new ATOM 2282 N GLU A 145 -4.923 3.734 -13.219 1.00 0.00 N ATOM 2283 CA GLU A 145 -5.611 3.334 -14.441 1.00 0.00 C ATOM 2284 C GLU A 145 -5.551 4.465 -15.463 1.00 0.00 C ATOM 2285 O GLU A 145 -5.379 4.231 -16.659 1.00 0.00 O ATOM 2286 CB GLU A 145 -7.063 2.949 -14.144 1.00 0.00 C ATOM 2287 CG GLU A 145 -7.796 2.352 -15.335 1.00 0.00 C ATOM 2288 CD GLU A 145 -9.180 1.859 -14.976 1.00 0.00 C ATOM 2289 OE1 GLU A 145 -9.315 0.681 -14.586 1.00 0.00 O ATOM 2290 OE2 GLU A 145 -10.148 2.647 -15.081 1.00 0.00 O ATOM 0 H GLU A 145 -5.531 3.855 -12.409 1.00 0.00 H new ATOM 0 HA GLU A 145 -5.110 2.459 -14.855 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -7.078 2.232 -13.323 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -7.601 3.834 -13.804 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -7.874 3.102 -16.122 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -7.213 1.525 -15.739 1.00 0.00 H new ATOM 2297 N GLN A 146 -5.674 5.695 -14.974 1.00 0.00 N ATOM 2298 CA GLN A 146 -5.514 6.877 -15.810 1.00 0.00 C ATOM 2299 C GLN A 146 -4.098 6.947 -16.362 1.00 0.00 C ATOM 2300 O GLN A 146 -3.890 7.356 -17.502 1.00 0.00 O ATOM 2301 CB GLN A 146 -5.820 8.147 -15.014 1.00 0.00 C ATOM 2302 CG GLN A 146 -7.291 8.331 -14.683 1.00 0.00 C ATOM 2303 CD GLN A 146 -7.530 9.549 -13.816 1.00 0.00 C ATOM 2304 OE1 GLN A 146 -6.667 9.941 -13.029 1.00 0.00 O ATOM 2305 NE2 GLN A 146 -8.696 10.157 -13.952 1.00 0.00 N ATOM 0 H GLN A 146 -5.885 5.898 -13.997 1.00 0.00 H new ATOM 0 HA GLN A 146 -6.218 6.804 -16.639 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -5.249 8.128 -14.086 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -5.475 9.011 -15.582 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -7.861 8.426 -15.607 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -7.661 7.443 -14.170 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -9.383 9.800 -14.616 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -8.908 10.984 -13.393 1.00 0.00 H new ATOM 2314 N ALA A 147 -3.130 6.544 -15.545 1.00 0.00 N ATOM 2315 CA ALA A 147 -1.735 6.520 -15.967 1.00 0.00 C ATOM 2316 C ALA A 147 -1.511 5.472 -17.053 1.00 0.00 C ATOM 2317 O ALA A 147 -0.757 5.700 -17.998 1.00 0.00 O ATOM 2318 CB ALA A 147 -0.821 6.259 -14.779 1.00 0.00 C ATOM 0 H ALA A 147 -3.286 6.230 -14.587 1.00 0.00 H new ATOM 0 HA ALA A 147 -1.492 7.498 -16.383 1.00 0.00 H new ATOM 0 HB1 ALA A 147 0.216 6.245 -15.114 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -0.952 7.048 -14.039 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -1.071 5.297 -14.332 1.00 0.00 H new ATOM 2324 N ALA A 148 -2.179 4.329 -16.917 1.00 0.00 N ATOM 2325 CA ALA A 148 -2.086 3.259 -17.906 1.00 0.00 C ATOM 2326 C ALA A 148 -2.870 3.614 -19.167 1.00 0.00 C ATOM 2327 O ALA A 148 -2.663 3.029 -20.229 1.00 0.00 O ATOM 2328 CB ALA A 148 -2.581 1.946 -17.316 1.00 0.00 C ATOM 0 H ALA A 148 -2.792 4.120 -16.129 1.00 0.00 H new ATOM 0 HA ALA A 148 -1.039 3.140 -18.183 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -2.505 1.159 -18.066 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -1.972 1.683 -16.451 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -3.621 2.055 -17.008 1.00 0.00 H new ATOM 2334 N GLY A 149 -3.787 4.562 -19.034 1.00 0.00 N ATOM 2335 CA GLY A 149 -4.498 5.070 -20.189 1.00 0.00 C ATOM 2336 C GLY A 149 -3.720 6.171 -20.874 1.00 0.00 C ATOM 2337 O GLY A 149 -3.812 6.352 -22.090 1.00 0.00 O ATOM 0 H GLY A 149 -4.051 4.989 -18.146 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -4.679 4.258 -20.893 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -5.473 5.448 -19.881 1.00 0.00 H new ATOM 2341 N GLU A 150 -2.956 6.909 -20.081 1.00 0.00 N ATOM 2342 CA GLU A 150 -2.103 7.973 -20.588 1.00 0.00 C ATOM 2343 C GLU A 150 -0.919 7.358 -21.327 1.00 0.00 C ATOM 2344 O GLU A 150 -0.638 7.698 -22.478 1.00 0.00 O ATOM 2345 CB GLU A 150 -1.628 8.843 -19.416 1.00 0.00 C ATOM 2346 CG GLU A 150 -1.243 10.270 -19.788 1.00 0.00 C ATOM 2347 CD GLU A 150 0.028 10.362 -20.605 1.00 0.00 C ATOM 2348 OE1 GLU A 150 1.099 9.992 -20.090 1.00 0.00 O ATOM 2349 OE2 GLU A 150 -0.036 10.843 -21.758 1.00 0.00 O ATOM 0 H GLU A 150 -2.910 6.787 -19.069 1.00 0.00 H new ATOM 0 HA GLU A 150 -2.657 8.603 -21.284 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -2.419 8.880 -18.666 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -0.769 8.361 -18.950 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -2.060 10.723 -20.350 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -1.122 10.854 -18.876 1.00 0.00 H new