USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 946 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 26 SER OG : rot 51:sc= -0.513 USER MOD Set 1.2: A 73 ASN : amide:sc= -1.9! K(o=-2.4!,f=1.3) USER MOD Set 2.1: A 32 SER OG : rot -150:sc= -0.455 USER MOD Set 2.2: A 33 SER OG : rot 98:sc= 1.57 USER MOD Set 2.3: A 100 LYS NZ :NH3+ 179:sc= 0.261 (180deg=-0.357) USER MOD Set 3.1: A 18 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 22 HIS : no HD1:sc= -4.6! K(o=-4.6!,f=-3.2) USER MOD Set 4.1: A 19 ASN : amide:sc= -6.38! C(o=-7.2!,f=-8.5!) USER MOD Set 4.2: A 85 THR OG1 : rot 51:sc= 0.00982 USER MOD Set 4.3: A 92 TYR OH : rot 15:sc= -0.821 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -43:sc= -0.997! USER MOD Single : A 11 TYR OH : rot -143:sc= -0.737 USER MOD Single : A 12 ASN : amide:sc= -1.64 K(o=-1.6,f=-10!) USER MOD Single : A 13 GLN : amide:sc= -7.29! C(o=-7.3!,f=-5.4!) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot -27:sc= 0.393 USER MOD Single : A 21 HIS : no HD1:sc= -1.73 K(o=-1.7,f=-0.59) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 151:sc= 0.0888 USER MOD Single : A 34 TYR OH : rot 30:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -3.59 X(o=-3.6,f=-3.6!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -1.5 K(o=-1.5,f=-6.7!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HD1:sc= -0.824 K(o=-0.82,f=-3.4!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= -3.48! K(o=-3.5!,f=-1.9) USER MOD Single : A 79 TYR OH : rot -97:sc= -1.08 USER MOD Single : A 90 HIS : no HD1:sc= -3.76 X(o=-3.8,f=-3.4!) USER MOD Single : A 93 LYS NZ :NH3+ -148:sc= -0.951 (180deg=-3.03!) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 110 TYR OH : rot 180:sc= -0.53 USER MOD Single : A 111 THR OG1 : rot 160:sc= -0.0259 USER MOD Single : A 112 TYR OH : rot 165:sc= -0.0883 USER MOD Single : A 114 ASN : amide:sc= -0.0454 K(o=-0.045,f=-1.3) USER MOD Single : A 115 LYS NZ :NH3+ -151:sc= -0.0419 (180deg=-0.382) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 SER OG : rot 180:sc= -0.0652 USER MOD Single : A 136 HIS : no HD1:sc= -4.01! C(o=-4!,f=-8.1!) USER MOD ----------------------------------------------------------------- ATOM 13 N VAL A 2 3.448 1.505 -2.528 1.00 0.00 N ATOM 14 CA VAL A 2 4.035 2.782 -2.903 1.00 0.00 C ATOM 15 C VAL A 2 3.313 3.359 -4.110 1.00 0.00 C ATOM 16 O VAL A 2 2.519 2.677 -4.752 1.00 0.00 O ATOM 17 CB VAL A 2 5.531 2.590 -3.119 1.00 0.00 C ATOM 18 CG1 VAL A 2 5.785 1.516 -4.157 1.00 0.00 C ATOM 19 CG2 VAL A 2 6.222 3.896 -3.484 1.00 0.00 C ATOM 0 HA VAL A 2 3.914 3.516 -2.106 1.00 0.00 H new ATOM 0 HB VAL A 2 5.965 2.258 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 2 6.859 1.393 -4.298 1.00 0.00 H new ATOM 0 HG12 VAL A 2 5.353 0.574 -3.819 1.00 0.00 H new ATOM 0 HG13 VAL A 2 5.326 1.807 -5.102 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.287 3.716 -3.629 1.00 0.00 H new ATOM 0 HG22 VAL A 2 5.792 4.290 -4.404 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.083 4.618 -2.680 1.00 0.00 H new ATOM 29 N THR A 3 3.552 4.603 -4.430 1.00 0.00 N ATOM 30 CA THR A 3 2.954 5.328 -5.536 1.00 0.00 C ATOM 31 C THR A 3 3.724 5.100 -6.808 1.00 0.00 C ATOM 32 O THR A 3 4.894 5.400 -6.857 1.00 0.00 O ATOM 33 CB THR A 3 2.866 6.794 -5.151 1.00 0.00 C ATOM 34 OG1 THR A 3 2.520 6.883 -3.782 1.00 0.00 O ATOM 35 CG2 THR A 3 1.693 7.443 -5.850 1.00 0.00 C ATOM 0 H THR A 3 4.207 5.177 -3.899 1.00 0.00 H new ATOM 0 HA THR A 3 1.946 4.962 -5.734 1.00 0.00 H new ATOM 0 HB THR A 3 3.818 7.262 -5.400 1.00 0.00 H new ATOM 0 HG1 THR A 3 2.462 7.826 -3.520 1.00 0.00 H new ATOM 0 HG21 THR A 3 1.638 8.494 -5.568 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.823 7.363 -6.929 1.00 0.00 H new ATOM 0 HG23 THR A 3 0.771 6.940 -5.557 1.00 0.00 H new ATOM 43 N TRP A 4 3.156 4.359 -7.746 1.00 0.00 N ATOM 44 CA TRP A 4 3.790 4.078 -9.010 1.00 0.00 C ATOM 45 C TRP A 4 3.678 5.274 -9.926 1.00 0.00 C ATOM 46 O TRP A 4 2.646 5.932 -9.942 1.00 0.00 O ATOM 47 CB TRP A 4 3.155 2.842 -9.592 1.00 0.00 C ATOM 48 CG TRP A 4 3.331 1.605 -8.752 1.00 0.00 C ATOM 49 CD1 TRP A 4 2.896 1.387 -7.504 1.00 0.00 C ATOM 50 CD2 TRP A 4 4.003 0.372 -9.116 1.00 0.00 C ATOM 51 NE1 TRP A 4 3.267 0.143 -7.066 1.00 0.00 N ATOM 52 CE2 TRP A 4 3.923 -0.550 -8.028 1.00 0.00 C ATOM 53 CE3 TRP A 4 4.663 -0.064 -10.285 1.00 0.00 C ATOM 54 CZ2 TRP A 4 4.509 -1.807 -8.085 1.00 0.00 C ATOM 55 CZ3 TRP A 4 5.198 -1.350 -10.381 1.00 0.00 C ATOM 56 CH2 TRP A 4 5.119 -2.219 -9.278 1.00 0.00 C ATOM 0 H TRP A 4 2.234 3.935 -7.644 1.00 0.00 H new ATOM 0 HA TRP A 4 4.855 3.889 -8.878 1.00 0.00 H new ATOM 0 HB2 TRP A 4 2.089 3.025 -9.730 1.00 0.00 H new ATOM 0 HB3 TRP A 4 3.578 2.660 -10.580 1.00 0.00 H new ATOM 0 HD1 TRP A 4 2.329 2.097 -6.921 1.00 0.00 H new ATOM 0 HE1 TRP A 4 3.073 -0.217 -6.131 1.00 0.00 H new ATOM 0 HE3 TRP A 4 4.756 0.611 -11.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 4.495 -2.458 -7.223 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 5.670 -1.675 -11.296 1.00 0.00 H new ATOM 0 HH2 TRP A 4 5.533 -3.214 -9.351 1.00 0.00 H new ATOM 67 N THR A 5 4.710 5.543 -10.698 1.00 0.00 N ATOM 68 CA THR A 5 4.765 6.693 -11.576 1.00 0.00 C ATOM 69 C THR A 5 5.216 6.276 -12.945 1.00 0.00 C ATOM 70 O THR A 5 6.120 5.460 -13.068 1.00 0.00 O ATOM 71 CB THR A 5 5.640 7.778 -10.980 1.00 0.00 C ATOM 72 OG1 THR A 5 4.763 8.661 -10.410 1.00 0.00 O ATOM 73 CG2 THR A 5 6.406 8.607 -12.001 1.00 0.00 C ATOM 0 H THR A 5 5.546 4.960 -10.734 1.00 0.00 H new ATOM 0 HA THR A 5 3.766 7.117 -11.680 1.00 0.00 H new ATOM 0 HB THR A 5 6.365 7.297 -10.323 1.00 0.00 H new ATOM 0 HG1 THR A 5 4.005 8.805 -11.014 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.004 9.358 -11.485 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.061 7.956 -12.580 1.00 0.00 H new ATOM 0 HG23 THR A 5 5.702 9.102 -12.670 1.00 0.00 H new ATOM 81 N CYS A 6 4.539 6.756 -13.984 1.00 0.00 N ATOM 82 CA CYS A 6 4.926 6.461 -15.355 1.00 0.00 C ATOM 83 C CYS A 6 4.907 7.736 -16.187 1.00 0.00 C ATOM 84 O CYS A 6 5.951 8.306 -16.465 1.00 0.00 O ATOM 85 CB CYS A 6 3.968 5.428 -15.900 1.00 0.00 C ATOM 86 SG CYS A 6 4.771 3.894 -16.325 1.00 0.00 S ATOM 0 H CYS A 6 3.717 7.353 -13.899 1.00 0.00 H new ATOM 0 HA CYS A 6 5.941 6.065 -15.394 1.00 0.00 H new ATOM 0 HB2 CYS A 6 3.192 5.233 -15.160 1.00 0.00 H new ATOM 0 HB3 CYS A 6 3.472 5.830 -16.784 1.00 0.00 H new ATOM 91 N GLY A 7 3.710 8.238 -16.519 1.00 0.00 N ATOM 92 CA GLY A 7 3.549 9.450 -17.308 1.00 0.00 C ATOM 93 C GLY A 7 3.715 10.687 -16.457 1.00 0.00 C ATOM 94 O GLY A 7 2.885 11.563 -16.564 1.00 0.00 O ATOM 0 H GLY A 7 2.827 7.807 -16.243 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.282 9.461 -18.115 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.563 9.455 -17.772 1.00 0.00 H new ATOM 98 N GLY A 8 4.698 10.733 -15.552 1.00 0.00 N ATOM 99 CA GLY A 8 4.877 11.836 -14.613 1.00 0.00 C ATOM 100 C GLY A 8 3.703 11.952 -13.647 1.00 0.00 C ATOM 101 O GLY A 8 3.562 12.976 -12.999 1.00 0.00 O ATOM 0 H GLY A 8 5.397 9.996 -15.453 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.798 11.688 -14.050 1.00 0.00 H new ATOM 0 HA3 GLY A 8 4.987 12.769 -15.165 1.00 0.00 H new ATOM 105 N LEU A 9 2.832 10.941 -13.585 1.00 0.00 N ATOM 106 CA LEU A 9 1.634 10.962 -12.771 1.00 0.00 C ATOM 107 C LEU A 9 1.792 9.908 -11.705 1.00 0.00 C ATOM 108 O LEU A 9 2.383 8.867 -11.970 1.00 0.00 O ATOM 109 CB LEU A 9 0.379 10.720 -13.611 1.00 0.00 C ATOM 110 CG LEU A 9 0.262 11.602 -14.864 1.00 0.00 C ATOM 111 CD1 LEU A 9 0.041 10.753 -16.114 1.00 0.00 C ATOM 112 CD2 LEU A 9 -0.837 12.638 -14.715 1.00 0.00 C ATOM 0 H LEU A 9 2.950 10.075 -14.111 1.00 0.00 H new ATOM 0 HA LEU A 9 1.509 11.944 -12.316 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.360 9.674 -13.917 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -0.498 10.885 -12.985 1.00 0.00 H new ATOM 0 HG LEU A 9 1.206 12.135 -14.977 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.038 11.403 -16.986 1.00 0.00 H new ATOM 0 HD12 LEU A 9 0.882 10.072 -16.244 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.879 10.178 -16.005 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.891 13.244 -15.620 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.791 12.136 -14.557 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.619 13.280 -13.861 1.00 0.00 H new ATOM 124 N LEU A 10 1.191 10.139 -10.548 1.00 0.00 N ATOM 125 CA LEU A 10 1.396 9.294 -9.386 1.00 0.00 C ATOM 126 C LEU A 10 0.139 8.472 -9.262 1.00 0.00 C ATOM 127 O LEU A 10 -0.945 9.010 -9.102 1.00 0.00 O ATOM 128 CB LEU A 10 1.693 10.142 -8.137 1.00 0.00 C ATOM 129 CG LEU A 10 3.101 10.739 -8.035 1.00 0.00 C ATOM 130 CD1 LEU A 10 4.133 9.684 -7.623 1.00 0.00 C ATOM 131 CD2 LEU A 10 3.491 11.452 -9.321 1.00 0.00 C ATOM 0 H LEU A 10 0.549 10.916 -10.390 1.00 0.00 H new ATOM 0 HA LEU A 10 2.263 8.642 -9.490 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.972 10.959 -8.100 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.520 9.524 -7.256 1.00 0.00 H new ATOM 0 HG LEU A 10 3.087 11.489 -7.244 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.119 10.144 -7.561 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.863 9.272 -6.651 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.152 8.885 -8.364 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.494 11.865 -9.218 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.473 10.744 -10.149 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.785 12.259 -9.518 1.00 0.00 H new ATOM 143 N TYR A 11 0.268 7.167 -9.219 1.00 0.00 N ATOM 144 CA TYR A 11 -0.839 6.232 -9.225 1.00 0.00 C ATOM 145 C TYR A 11 -0.767 5.412 -7.952 1.00 0.00 C ATOM 146 O TYR A 11 0.145 4.588 -7.769 1.00 0.00 O ATOM 147 CB TYR A 11 -0.750 5.336 -10.456 1.00 0.00 C ATOM 148 CG TYR A 11 -0.786 6.076 -11.766 1.00 0.00 C ATOM 149 CD1 TYR A 11 -2.015 6.541 -12.260 1.00 0.00 C ATOM 150 CD2 TYR A 11 0.406 6.367 -12.459 1.00 0.00 C ATOM 151 CE1 TYR A 11 -2.078 7.222 -13.475 1.00 0.00 C ATOM 152 CE2 TYR A 11 0.357 7.127 -13.627 1.00 0.00 C ATOM 153 CZ TYR A 11 -0.893 7.489 -14.185 1.00 0.00 C ATOM 154 OH TYR A 11 -0.972 7.962 -15.457 1.00 0.00 O ATOM 0 H TYR A 11 1.178 6.708 -9.177 1.00 0.00 H new ATOM 0 HA TYR A 11 -1.791 6.761 -9.265 1.00 0.00 H new ATOM 0 HB2 TYR A 11 0.173 4.758 -10.404 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -1.574 4.623 -10.432 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -2.919 6.370 -11.694 1.00 0.00 H new ATOM 0 HD2 TYR A 11 1.353 6.003 -12.087 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -3.031 7.543 -13.869 1.00 0.00 H new ATOM 0 HE2 TYR A 11 1.273 7.440 -14.106 1.00 0.00 H new ATOM 0 HH TYR A 11 -0.252 7.573 -15.996 1.00 0.00 H new ATOM 164 N ASN A 12 -1.676 5.684 -7.016 1.00 0.00 N ATOM 165 CA ASN A 12 -1.719 4.947 -5.775 1.00 0.00 C ATOM 166 C ASN A 12 -1.805 3.476 -6.105 1.00 0.00 C ATOM 167 O ASN A 12 -2.816 3.071 -6.624 1.00 0.00 O ATOM 168 CB ASN A 12 -2.883 5.417 -4.904 1.00 0.00 C ATOM 169 CG ASN A 12 -3.079 4.476 -3.745 1.00 0.00 C ATOM 170 OD1 ASN A 12 -4.140 3.978 -3.488 1.00 0.00 O ATOM 171 ND2 ASN A 12 -2.028 4.099 -3.065 1.00 0.00 N ATOM 0 H ASN A 12 -2.387 6.410 -7.103 1.00 0.00 H new ATOM 0 HA ASN A 12 -0.815 5.126 -5.193 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -2.687 6.424 -4.535 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -3.795 5.467 -5.499 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -2.120 3.395 -2.333 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -1.116 4.509 -3.267 1.00 0.00 H new ATOM 178 N GLN A 13 -0.820 2.665 -5.752 1.00 0.00 N ATOM 179 CA GLN A 13 -0.871 1.259 -6.024 1.00 0.00 C ATOM 180 C GLN A 13 -2.107 0.628 -5.475 1.00 0.00 C ATOM 181 O GLN A 13 -2.763 -0.013 -6.242 1.00 0.00 O ATOM 182 CB GLN A 13 0.281 0.557 -5.369 1.00 0.00 C ATOM 183 CG GLN A 13 0.196 -0.972 -5.461 1.00 0.00 C ATOM 184 CD GLN A 13 -0.159 -1.378 -6.876 1.00 0.00 C ATOM 185 OE1 GLN A 13 -0.937 -2.269 -7.122 1.00 0.00 O ATOM 186 NE2 GLN A 13 0.348 -0.637 -7.844 1.00 0.00 N ATOM 0 H GLN A 13 0.027 2.972 -5.273 1.00 0.00 H new ATOM 0 HA GLN A 13 -0.844 1.161 -7.109 1.00 0.00 H new ATOM 0 HB2 GLN A 13 1.210 0.890 -5.832 1.00 0.00 H new ATOM 0 HB3 GLN A 13 0.325 0.848 -4.320 1.00 0.00 H new ATOM 0 HG2 GLN A 13 1.148 -1.417 -5.173 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -0.555 -1.347 -4.765 1.00 0.00 H new ATOM 0 HE21 GLN A 13 1.004 0.112 -7.623 1.00 0.00 H new ATOM 0 HE22 GLN A 13 0.084 -0.814 -8.813 1.00 0.00 H new ATOM 195 N ASN A 14 -2.489 0.928 -4.233 1.00 0.00 N ATOM 196 CA ASN A 14 -3.709 0.439 -3.650 1.00 0.00 C ATOM 197 C ASN A 14 -4.873 0.710 -4.571 1.00 0.00 C ATOM 198 O ASN A 14 -5.742 -0.098 -4.640 1.00 0.00 O ATOM 199 CB ASN A 14 -4.014 1.171 -2.359 1.00 0.00 C ATOM 200 CG ASN A 14 -4.589 0.243 -1.335 1.00 0.00 C ATOM 201 OD1 ASN A 14 -5.778 0.073 -1.190 1.00 0.00 O ATOM 202 ND2 ASN A 14 -3.712 -0.300 -0.533 1.00 0.00 N ATOM 0 H ASN A 14 -1.945 1.524 -3.609 1.00 0.00 H new ATOM 0 HA ASN A 14 -3.577 -0.629 -3.476 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -3.102 1.625 -1.971 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -4.716 1.982 -2.554 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.023 -0.886 0.242 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.716 -0.138 -0.681 1.00 0.00 H new ATOM 209 N LYS A 15 -4.944 1.815 -5.299 1.00 0.00 N ATOM 210 CA LYS A 15 -5.896 2.084 -6.352 1.00 0.00 C ATOM 211 C LYS A 15 -5.567 1.334 -7.625 1.00 0.00 C ATOM 212 O LYS A 15 -6.461 0.828 -8.239 1.00 0.00 O ATOM 213 CB LYS A 15 -5.925 3.579 -6.616 1.00 0.00 C ATOM 214 CG LYS A 15 -6.992 4.244 -5.753 1.00 0.00 C ATOM 215 CD LYS A 15 -6.506 5.559 -5.147 1.00 0.00 C ATOM 216 CE LYS A 15 -7.598 6.227 -4.323 1.00 0.00 C ATOM 217 NZ LYS A 15 -7.149 7.573 -3.877 1.00 0.00 N ATOM 0 H LYS A 15 -4.297 2.591 -5.157 1.00 0.00 H new ATOM 0 HA LYS A 15 -6.876 1.738 -6.025 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.949 4.013 -6.400 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -6.130 3.766 -7.670 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -7.881 4.430 -6.356 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -7.286 3.564 -4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -5.636 5.372 -4.518 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -6.185 6.232 -5.943 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -8.508 6.316 -4.916 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -7.840 5.610 -3.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -7.901 8.021 -3.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -6.292 7.478 -3.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -6.940 8.162 -4.708 1.00 0.00 H new ATOM 231 N ALA A 16 -4.359 1.188 -8.092 1.00 0.00 N ATOM 232 CA ALA A 16 -4.010 0.326 -9.195 1.00 0.00 C ATOM 233 C ALA A 16 -4.512 -1.095 -9.031 1.00 0.00 C ATOM 234 O ALA A 16 -4.957 -1.640 -10.013 1.00 0.00 O ATOM 235 CB ALA A 16 -2.506 0.338 -9.342 1.00 0.00 C ATOM 0 H ALA A 16 -3.557 1.684 -7.702 1.00 0.00 H new ATOM 0 HA ALA A 16 -4.498 0.710 -10.091 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.216 -0.308 -10.171 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.168 1.355 -9.539 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -2.048 -0.025 -8.422 1.00 0.00 H new ATOM 241 N GLU A 17 -4.533 -1.646 -7.825 1.00 0.00 N ATOM 242 CA GLU A 17 -5.020 -2.974 -7.536 1.00 0.00 C ATOM 243 C GLU A 17 -6.475 -2.859 -7.112 1.00 0.00 C ATOM 244 O GLU A 17 -7.322 -3.621 -7.490 1.00 0.00 O ATOM 245 CB GLU A 17 -4.212 -3.651 -6.439 1.00 0.00 C ATOM 246 CG GLU A 17 -3.811 -2.702 -5.333 1.00 0.00 C ATOM 247 CD GLU A 17 -3.598 -3.364 -4.005 1.00 0.00 C ATOM 248 OE1 GLU A 17 -2.571 -4.046 -3.882 1.00 0.00 O ATOM 249 OE2 GLU A 17 -4.450 -3.170 -3.116 1.00 0.00 O ATOM 0 H GLU A 17 -4.197 -1.156 -6.995 1.00 0.00 H new ATOM 0 HA GLU A 17 -4.921 -3.589 -8.430 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -4.796 -4.468 -6.016 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.316 -4.093 -6.875 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.893 -2.190 -5.623 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.582 -1.939 -5.227 1.00 0.00 H new ATOM 256 N SER A 18 -6.902 -1.866 -6.361 1.00 0.00 N ATOM 257 CA SER A 18 -8.263 -1.720 -5.871 1.00 0.00 C ATOM 258 C SER A 18 -9.104 -1.318 -7.041 1.00 0.00 C ATOM 259 O SER A 18 -10.025 -2.010 -7.381 1.00 0.00 O ATOM 260 CB SER A 18 -8.390 -0.633 -4.827 1.00 0.00 C ATOM 261 OG SER A 18 -9.738 -0.370 -4.527 1.00 0.00 O ATOM 0 H SER A 18 -6.290 -1.107 -6.062 1.00 0.00 H new ATOM 0 HA SER A 18 -8.571 -2.661 -5.416 1.00 0.00 H new ATOM 0 HB2 SER A 18 -7.865 -0.933 -3.920 1.00 0.00 H new ATOM 0 HB3 SER A 18 -7.911 0.278 -5.186 1.00 0.00 H new ATOM 0 HG SER A 18 -9.791 0.335 -3.849 1.00 0.00 H new ATOM 267 N ASN A 19 -8.865 -0.234 -7.739 1.00 0.00 N ATOM 268 CA ASN A 19 -9.554 0.131 -8.961 1.00 0.00 C ATOM 269 C ASN A 19 -9.594 -0.994 -9.994 1.00 0.00 C ATOM 270 O ASN A 19 -10.550 -1.091 -10.756 1.00 0.00 O ATOM 271 CB ASN A 19 -8.919 1.350 -9.591 1.00 0.00 C ATOM 272 CG ASN A 19 -9.996 2.206 -10.185 1.00 0.00 C ATOM 273 OD1 ASN A 19 -10.676 1.846 -11.110 1.00 0.00 O ATOM 274 ND2 ASN A 19 -10.254 3.344 -9.609 1.00 0.00 N ATOM 0 H ASN A 19 -8.158 0.447 -7.463 1.00 0.00 H new ATOM 0 HA ASN A 19 -10.581 0.346 -8.666 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -8.360 1.913 -8.843 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -8.209 1.049 -10.361 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -11.026 3.921 -9.943 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -9.684 3.659 -8.824 1.00 0.00 H new ATOM 281 N SER A 20 -8.588 -1.877 -9.950 1.00 0.00 N ATOM 282 CA SER A 20 -8.550 -3.050 -10.800 1.00 0.00 C ATOM 283 C SER A 20 -9.285 -4.234 -10.192 1.00 0.00 C ATOM 284 O SER A 20 -9.638 -5.164 -10.903 1.00 0.00 O ATOM 285 CB SER A 20 -7.126 -3.437 -11.103 1.00 0.00 C ATOM 286 OG SER A 20 -6.558 -4.134 -10.034 1.00 0.00 O ATOM 0 H SER A 20 -7.787 -1.790 -9.324 1.00 0.00 H new ATOM 0 HA SER A 20 -9.063 -2.784 -11.724 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.096 -4.054 -12.001 1.00 0.00 H new ATOM 0 HB3 SER A 20 -6.539 -2.543 -11.312 1.00 0.00 H new ATOM 0 HG SER A 20 -6.995 -3.865 -9.199 1.00 0.00 H new ATOM 292 N HIS A 21 -9.567 -4.224 -8.890 1.00 0.00 N ATOM 293 CA HIS A 21 -10.263 -5.278 -8.184 1.00 0.00 C ATOM 294 C HIS A 21 -11.677 -5.328 -8.704 1.00 0.00 C ATOM 295 O HIS A 21 -12.217 -6.412 -8.806 1.00 0.00 O ATOM 296 CB HIS A 21 -10.191 -5.077 -6.667 1.00 0.00 C ATOM 297 CG HIS A 21 -9.004 -5.688 -5.990 1.00 0.00 C ATOM 298 ND1 HIS A 21 -8.932 -5.970 -4.643 1.00 0.00 N ATOM 299 CD2 HIS A 21 -7.840 -6.126 -6.575 1.00 0.00 C ATOM 300 CE1 HIS A 21 -7.719 -6.519 -4.400 1.00 0.00 C ATOM 301 NE2 HIS A 21 -7.024 -6.606 -5.556 1.00 0.00 N ATOM 0 H HIS A 21 -9.303 -3.448 -8.282 1.00 0.00 H new ATOM 0 HA HIS A 21 -9.785 -6.241 -8.367 1.00 0.00 H new ATOM 0 HB2 HIS A 21 -10.194 -4.007 -6.460 1.00 0.00 H new ATOM 0 HB3 HIS A 21 -11.095 -5.491 -6.220 1.00 0.00 H new ATOM 0 HD2 HIS A 21 -7.603 -6.102 -7.628 1.00 0.00 H new ATOM 0 HE1 HIS A 21 -7.362 -6.838 -3.432 1.00 0.00 H new ATOM 0 HE2 HIS A 21 -6.073 -6.960 -5.662 1.00 0.00 H new ATOM 310 N HIS A 22 -12.291 -4.171 -8.962 1.00 0.00 N ATOM 311 CA HIS A 22 -13.651 -4.075 -9.433 1.00 0.00 C ATOM 312 C HIS A 22 -13.700 -4.452 -10.896 1.00 0.00 C ATOM 313 O HIS A 22 -14.624 -5.169 -11.246 1.00 0.00 O ATOM 314 CB HIS A 22 -14.215 -2.674 -9.207 1.00 0.00 C ATOM 315 CG HIS A 22 -13.469 -1.784 -8.245 1.00 0.00 C ATOM 316 ND1 HIS A 22 -13.237 -0.438 -8.454 1.00 0.00 N ATOM 317 CD2 HIS A 22 -12.907 -2.151 -7.041 1.00 0.00 C ATOM 318 CE1 HIS A 22 -12.557 0.010 -7.378 1.00 0.00 C ATOM 319 NE2 HIS A 22 -12.385 -0.992 -6.486 1.00 0.00 N ATOM 0 H HIS A 22 -11.838 -3.265 -8.843 1.00 0.00 H new ATOM 0 HA HIS A 22 -14.273 -4.767 -8.866 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -14.261 -2.168 -10.171 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -15.240 -2.775 -8.850 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -12.879 -3.143 -6.615 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -12.202 1.022 -7.248 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -11.949 -0.910 -5.568 1.00 0.00 H new ATOM 328 N ALA A 23 -12.709 -3.978 -11.677 1.00 0.00 N ATOM 329 CA ALA A 23 -12.588 -4.286 -13.082 1.00 0.00 C ATOM 330 C ALA A 23 -12.922 -5.754 -13.378 1.00 0.00 C ATOM 331 O ALA A 23 -12.459 -6.652 -12.654 1.00 0.00 O ATOM 332 CB ALA A 23 -11.195 -3.926 -13.559 1.00 0.00 C ATOM 0 H ALA A 23 -11.971 -3.366 -11.329 1.00 0.00 H new ATOM 0 HA ALA A 23 -13.316 -3.689 -13.631 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -11.102 -4.158 -14.620 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -11.021 -2.861 -13.404 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -10.458 -4.499 -12.996 1.00 0.00 H new ATOM 338 N PRO A 24 -13.785 -5.996 -14.356 1.00 0.00 N ATOM 339 CA PRO A 24 -14.238 -7.338 -14.670 1.00 0.00 C ATOM 340 C PRO A 24 -13.122 -8.113 -15.347 1.00 0.00 C ATOM 341 O PRO A 24 -12.720 -7.771 -16.450 1.00 0.00 O ATOM 342 CB PRO A 24 -15.469 -7.179 -15.575 1.00 0.00 C ATOM 343 CG PRO A 24 -15.424 -5.746 -16.071 1.00 0.00 C ATOM 344 CD PRO A 24 -14.401 -5.015 -15.222 1.00 0.00 C ATOM 0 HA PRO A 24 -14.506 -7.903 -13.777 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -15.439 -7.883 -16.406 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.389 -7.375 -15.024 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -15.147 -5.711 -17.125 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -16.404 -5.277 -15.984 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -13.653 -4.533 -15.851 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -14.878 -4.230 -14.636 1.00 0.00 H new ATOM 352 N LEU A 25 -12.632 -9.165 -14.690 1.00 0.00 N ATOM 353 CA LEU A 25 -11.581 -10.020 -15.222 1.00 0.00 C ATOM 354 C LEU A 25 -11.968 -10.590 -16.570 1.00 0.00 C ATOM 355 O LEU A 25 -12.791 -11.491 -16.624 1.00 0.00 O ATOM 356 CB LEU A 25 -11.213 -11.097 -14.192 1.00 0.00 C ATOM 357 CG LEU A 25 -9.717 -11.239 -13.954 1.00 0.00 C ATOM 358 CD1 LEU A 25 -9.031 -9.889 -13.820 1.00 0.00 C ATOM 359 CD2 LEU A 25 -9.495 -12.079 -12.710 1.00 0.00 C ATOM 0 H LEU A 25 -12.959 -9.446 -13.766 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.685 -9.424 -15.399 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -11.701 -10.862 -13.246 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -11.610 -12.056 -14.526 1.00 0.00 H new ATOM 0 HG LEU A 25 -9.273 -11.731 -14.819 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.965 -10.038 -13.651 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -9.177 -9.314 -14.735 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -9.459 -9.345 -12.978 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -8.425 -12.187 -12.530 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -9.959 -11.590 -11.853 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -9.940 -13.064 -12.852 1.00 0.00 H new ATOM 371 N SER A 26 -11.456 -9.999 -17.640 1.00 0.00 N ATOM 372 CA SER A 26 -11.797 -10.413 -18.988 1.00 0.00 C ATOM 373 C SER A 26 -10.836 -9.765 -19.976 1.00 0.00 C ATOM 374 O SER A 26 -10.164 -8.783 -19.675 1.00 0.00 O ATOM 375 CB SER A 26 -13.238 -10.005 -19.342 1.00 0.00 C ATOM 376 OG SER A 26 -14.108 -11.092 -19.373 1.00 0.00 O ATOM 0 H SER A 26 -10.796 -9.223 -17.596 1.00 0.00 H new ATOM 0 HA SER A 26 -11.719 -11.499 -19.044 1.00 0.00 H new ATOM 0 HB2 SER A 26 -13.596 -9.278 -18.613 1.00 0.00 H new ATOM 0 HB3 SER A 26 -13.244 -9.511 -20.314 1.00 0.00 H new ATOM 0 HG SER A 26 -14.018 -11.607 -18.544 1.00 0.00 H new ATOM 382 N ASP A 27 -10.816 -10.237 -21.208 1.00 0.00 N ATOM 383 CA ASP A 27 -9.968 -9.708 -22.266 1.00 0.00 C ATOM 384 C ASP A 27 -10.853 -8.789 -23.142 1.00 0.00 C ATOM 385 O ASP A 27 -11.345 -9.128 -24.218 1.00 0.00 O ATOM 386 CB ASP A 27 -9.349 -10.831 -23.062 1.00 0.00 C ATOM 387 CG ASP A 27 -8.821 -10.390 -24.425 1.00 0.00 C ATOM 388 OD1 ASP A 27 -8.554 -9.192 -24.679 1.00 0.00 O ATOM 389 OD2 ASP A 27 -8.569 -11.266 -25.245 1.00 0.00 O ATOM 0 H ASP A 27 -11.401 -11.016 -21.510 1.00 0.00 H new ATOM 0 HA ASP A 27 -9.137 -9.134 -21.857 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -8.531 -11.266 -22.487 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -10.091 -11.617 -23.205 1.00 0.00 H new ATOM 394 N GLY A 28 -11.193 -7.621 -22.626 1.00 0.00 N ATOM 395 CA GLY A 28 -11.956 -6.675 -23.414 1.00 0.00 C ATOM 396 C GLY A 28 -13.415 -7.074 -23.402 1.00 0.00 C ATOM 397 O GLY A 28 -13.912 -7.785 -24.266 1.00 0.00 O ATOM 0 H GLY A 28 -10.958 -7.311 -21.683 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -11.839 -5.670 -23.009 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -11.582 -6.652 -24.438 1.00 0.00 H new ATOM 401 N LYS A 29 -14.137 -6.626 -22.379 1.00 0.00 N ATOM 402 CA LYS A 29 -15.576 -6.871 -22.248 1.00 0.00 C ATOM 403 C LYS A 29 -16.254 -5.757 -21.479 1.00 0.00 C ATOM 404 O LYS A 29 -17.210 -5.970 -20.740 1.00 0.00 O ATOM 405 CB LYS A 29 -15.787 -8.258 -21.637 1.00 0.00 C ATOM 406 CG LYS A 29 -16.089 -9.291 -22.734 1.00 0.00 C ATOM 407 CD LYS A 29 -17.076 -10.354 -22.232 1.00 0.00 C ATOM 408 CE LYS A 29 -18.369 -10.321 -23.061 1.00 0.00 C ATOM 409 NZ LYS A 29 -19.557 -10.353 -22.169 1.00 0.00 N ATOM 0 H LYS A 29 -13.742 -6.080 -21.613 1.00 0.00 H new ATOM 0 HA LYS A 29 -16.051 -6.867 -23.229 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -14.897 -8.557 -21.083 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -16.610 -8.226 -20.923 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -16.504 -8.788 -23.608 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -15.163 -9.770 -23.052 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -16.620 -11.342 -22.297 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -17.306 -10.178 -21.181 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -18.392 -9.421 -23.675 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -18.394 -11.172 -23.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -20.423 -10.330 -22.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -19.541 -11.224 -21.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -19.539 -9.527 -21.537 1.00 0.00 H new ATOM 423 N THR A 30 -15.753 -4.553 -21.643 1.00 0.00 N ATOM 424 CA THR A 30 -16.245 -3.394 -20.901 1.00 0.00 C ATOM 425 C THR A 30 -16.531 -2.291 -21.882 1.00 0.00 C ATOM 426 O THR A 30 -15.843 -2.206 -22.900 1.00 0.00 O ATOM 427 CB THR A 30 -15.247 -2.973 -19.860 1.00 0.00 C ATOM 428 OG1 THR A 30 -14.140 -2.778 -20.633 1.00 0.00 O ATOM 429 CG2 THR A 30 -14.959 -4.038 -18.845 1.00 0.00 C ATOM 0 H THR A 30 -14.994 -4.341 -22.291 1.00 0.00 H new ATOM 0 HA THR A 30 -17.164 -3.644 -20.371 1.00 0.00 H new ATOM 0 HB THR A 30 -15.588 -2.120 -19.274 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.569 -2.097 -20.220 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.231 -3.666 -18.124 1.00 0.00 H new ATOM 0 HG22 THR A 30 -15.880 -4.305 -18.326 1.00 0.00 H new ATOM 0 HG23 THR A 30 -14.557 -4.919 -19.346 1.00 0.00 H new ATOM 437 N GLY A 31 -17.587 -1.512 -21.623 1.00 0.00 N ATOM 438 CA GLY A 31 -18.017 -0.420 -22.489 1.00 0.00 C ATOM 439 C GLY A 31 -16.860 0.344 -23.095 1.00 0.00 C ATOM 440 O GLY A 31 -16.659 0.265 -24.300 1.00 0.00 O ATOM 0 H GLY A 31 -18.171 -1.627 -20.795 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -18.639 -0.821 -23.289 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -18.639 0.268 -21.916 1.00 0.00 H new ATOM 444 N SER A 32 -16.102 1.067 -22.269 1.00 0.00 N ATOM 445 CA SER A 32 -14.905 1.742 -22.698 1.00 0.00 C ATOM 446 C SER A 32 -13.994 0.792 -23.419 1.00 0.00 C ATOM 447 O SER A 32 -13.720 1.092 -24.581 1.00 0.00 O ATOM 448 CB SER A 32 -14.220 2.359 -21.491 1.00 0.00 C ATOM 449 OG SER A 32 -13.102 3.118 -21.806 1.00 0.00 O ATOM 0 H SER A 32 -16.314 1.193 -21.279 1.00 0.00 H new ATOM 0 HA SER A 32 -15.164 2.537 -23.398 1.00 0.00 H new ATOM 0 HB2 SER A 32 -14.936 2.987 -20.961 1.00 0.00 H new ATOM 0 HB3 SER A 32 -13.926 1.563 -20.806 1.00 0.00 H new ATOM 0 HG SER A 32 -12.464 3.085 -21.063 1.00 0.00 H new ATOM 455 N SER A 33 -13.458 -0.201 -22.696 1.00 0.00 N ATOM 456 CA SER A 33 -12.555 -1.202 -23.264 1.00 0.00 C ATOM 457 C SER A 33 -11.871 -2.004 -22.177 1.00 0.00 C ATOM 458 O SER A 33 -11.891 -3.227 -22.186 1.00 0.00 O ATOM 459 CB SER A 33 -11.465 -0.530 -24.114 1.00 0.00 C ATOM 460 OG SER A 33 -10.975 0.680 -23.520 1.00 0.00 O ATOM 0 H SER A 33 -13.641 -0.330 -21.701 1.00 0.00 H new ATOM 0 HA SER A 33 -13.162 -1.863 -23.882 1.00 0.00 H new ATOM 0 HB2 SER A 33 -10.637 -1.225 -24.252 1.00 0.00 H new ATOM 0 HB3 SER A 33 -11.865 -0.309 -25.104 1.00 0.00 H new ATOM 0 HG SER A 33 -10.144 0.493 -23.036 1.00 0.00 H new ATOM 466 N TYR A 34 -11.187 -1.299 -21.283 1.00 0.00 N ATOM 467 CA TYR A 34 -10.493 -1.875 -20.174 1.00 0.00 C ATOM 468 C TYR A 34 -11.431 -2.447 -19.130 1.00 0.00 C ATOM 469 O TYR A 34 -12.404 -1.777 -18.851 1.00 0.00 O ATOM 470 CB TYR A 34 -9.598 -0.813 -19.574 1.00 0.00 C ATOM 471 CG TYR A 34 -8.756 -0.094 -20.617 1.00 0.00 C ATOM 472 CD1 TYR A 34 -9.261 1.089 -21.214 1.00 0.00 C ATOM 473 CD2 TYR A 34 -7.445 -0.540 -20.907 1.00 0.00 C ATOM 474 CE1 TYR A 34 -8.464 1.807 -22.114 1.00 0.00 C ATOM 475 CE2 TYR A 34 -6.659 0.190 -21.798 1.00 0.00 C ATOM 476 CZ TYR A 34 -7.170 1.347 -22.432 1.00 0.00 C ATOM 477 OH TYR A 34 -6.388 2.030 -23.303 1.00 0.00 O ATOM 0 H TYR A 34 -11.108 -0.283 -21.325 1.00 0.00 H new ATOM 0 HA TYR A 34 -9.900 -2.716 -20.532 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -10.211 -0.085 -19.044 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -8.940 -1.273 -18.837 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -10.256 1.435 -20.976 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -7.058 -1.435 -20.444 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.841 2.713 -22.565 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -5.649 -0.131 -22.006 1.00 0.00 H new ATOM 0 HH TYR A 34 -6.606 2.984 -23.260 1.00 0.00 H new ATOM 487 N PRO A 35 -11.044 -3.477 -18.400 1.00 0.00 N ATOM 488 CA PRO A 35 -9.783 -4.134 -18.641 1.00 0.00 C ATOM 489 C PRO A 35 -9.798 -4.972 -19.940 1.00 0.00 C ATOM 490 O PRO A 35 -10.839 -5.474 -20.379 1.00 0.00 O ATOM 491 CB PRO A 35 -9.552 -4.927 -17.392 1.00 0.00 C ATOM 492 CG PRO A 35 -10.860 -5.151 -16.761 1.00 0.00 C ATOM 493 CD PRO A 35 -11.794 -4.136 -17.364 1.00 0.00 C ATOM 0 HA PRO A 35 -8.962 -3.441 -18.822 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -9.071 -5.877 -17.625 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -8.887 -4.391 -16.715 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -11.214 -6.165 -16.947 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -10.797 -5.029 -15.680 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -12.683 -4.617 -17.771 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.133 -3.422 -16.613 1.00 0.00 H new ATOM 501 N HIS A 36 -8.682 -4.880 -20.677 1.00 0.00 N ATOM 502 CA HIS A 36 -8.510 -5.734 -21.856 1.00 0.00 C ATOM 503 C HIS A 36 -7.198 -6.478 -21.882 1.00 0.00 C ATOM 504 O HIS A 36 -6.257 -5.958 -21.306 1.00 0.00 O ATOM 505 CB HIS A 36 -8.728 -4.834 -23.046 1.00 0.00 C ATOM 506 CG HIS A 36 -7.679 -3.767 -23.261 1.00 0.00 C ATOM 507 ND1 HIS A 36 -7.574 -3.008 -24.407 1.00 0.00 N ATOM 508 CD2 HIS A 36 -6.685 -3.365 -22.402 1.00 0.00 C ATOM 509 CE1 HIS A 36 -6.515 -2.187 -24.261 1.00 0.00 C ATOM 510 NE2 HIS A 36 -5.954 -2.404 -23.058 1.00 0.00 N ATOM 0 H HIS A 36 -7.908 -4.244 -20.485 1.00 0.00 H new ATOM 0 HA HIS A 36 -9.233 -6.550 -21.853 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -8.780 -5.453 -23.942 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -9.698 -4.348 -22.938 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -6.511 -3.734 -21.402 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -6.172 -1.470 -24.992 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -5.125 -1.934 -22.694 1.00 0.00 H new ATOM 519 N TRP A 37 -7.130 -7.656 -22.494 1.00 0.00 N ATOM 520 CA TRP A 37 -5.867 -8.376 -22.615 1.00 0.00 C ATOM 521 C TRP A 37 -4.734 -7.427 -23.032 1.00 0.00 C ATOM 522 O TRP A 37 -4.930 -6.417 -23.719 1.00 0.00 O ATOM 523 CB TRP A 37 -5.980 -9.493 -23.623 1.00 0.00 C ATOM 524 CG TRP A 37 -4.738 -10.180 -24.027 1.00 0.00 C ATOM 525 CD1 TRP A 37 -3.746 -10.607 -23.244 1.00 0.00 C ATOM 526 CD2 TRP A 37 -4.288 -10.470 -25.367 1.00 0.00 C ATOM 527 NE1 TRP A 37 -2.739 -11.157 -23.965 1.00 0.00 N ATOM 528 CE2 TRP A 37 -3.012 -11.120 -25.290 1.00 0.00 C ATOM 529 CE3 TRP A 37 -4.852 -10.258 -26.647 1.00 0.00 C ATOM 530 CZ2 TRP A 37 -2.337 -11.552 -26.419 1.00 0.00 C ATOM 531 CZ3 TRP A 37 -4.200 -10.711 -27.800 1.00 0.00 C ATOM 532 CH2 TRP A 37 -2.962 -11.370 -27.661 1.00 0.00 C ATOM 0 H TRP A 37 -7.930 -8.131 -22.912 1.00 0.00 H new ATOM 0 HA TRP A 37 -5.636 -8.799 -21.638 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -6.661 -10.242 -23.219 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -6.447 -9.089 -24.521 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -3.745 -10.524 -22.167 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -1.887 -11.548 -23.562 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -5.796 -9.741 -26.736 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -1.363 -12.013 -26.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -4.637 -10.559 -28.776 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.475 -11.750 -28.547 1.00 0.00 H new ATOM 543 N PHE A 38 -3.540 -7.761 -22.640 1.00 0.00 N ATOM 544 CA PHE A 38 -2.376 -6.966 -22.787 1.00 0.00 C ATOM 545 C PHE A 38 -1.374 -7.847 -23.446 1.00 0.00 C ATOM 546 O PHE A 38 -0.503 -8.376 -22.759 1.00 0.00 O ATOM 547 CB PHE A 38 -1.850 -6.504 -21.438 1.00 0.00 C ATOM 548 CG PHE A 38 -0.493 -5.848 -21.476 1.00 0.00 C ATOM 549 CD1 PHE A 38 -0.090 -5.147 -22.633 1.00 0.00 C ATOM 550 CD2 PHE A 38 0.405 -6.048 -20.408 1.00 0.00 C ATOM 551 CE1 PHE A 38 1.146 -4.525 -22.667 1.00 0.00 C ATOM 552 CE2 PHE A 38 1.683 -5.496 -20.476 1.00 0.00 C ATOM 553 CZ PHE A 38 2.061 -4.758 -21.621 1.00 0.00 C ATOM 0 H PHE A 38 -3.351 -8.653 -22.182 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.586 -6.068 -23.367 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.564 -5.803 -21.007 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.803 -7.363 -20.769 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.745 -5.096 -23.490 1.00 0.00 H new ATOM 0 HD2 PHE A 38 0.105 -6.624 -19.545 1.00 0.00 H new ATOM 0 HE1 PHE A 38 1.406 -3.869 -23.485 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.379 -5.631 -19.661 1.00 0.00 H new ATOM 0 HZ PHE A 38 3.065 -4.367 -21.695 1.00 0.00 H new ATOM 563 N THR A 39 -1.485 -8.008 -24.765 1.00 0.00 N ATOM 564 CA THR A 39 -0.535 -8.721 -25.612 1.00 0.00 C ATOM 565 C THR A 39 0.874 -8.483 -25.140 1.00 0.00 C ATOM 566 O THR A 39 1.601 -9.433 -24.999 1.00 0.00 O ATOM 567 CB THR A 39 -0.645 -8.221 -27.051 1.00 0.00 C ATOM 568 OG1 THR A 39 -0.514 -6.819 -27.037 1.00 0.00 O ATOM 569 CG2 THR A 39 -2.002 -8.507 -27.649 1.00 0.00 C ATOM 0 H THR A 39 -2.272 -7.629 -25.291 1.00 0.00 H new ATOM 0 HA THR A 39 -0.768 -9.785 -25.560 1.00 0.00 H new ATOM 0 HB THR A 39 0.126 -8.724 -27.635 1.00 0.00 H new ATOM 0 HG1 THR A 39 -0.580 -6.475 -27.952 1.00 0.00 H new ATOM 0 HG21 THR A 39 -2.034 -8.134 -28.673 1.00 0.00 H new ATOM 0 HG22 THR A 39 -2.180 -9.582 -27.649 1.00 0.00 H new ATOM 0 HG23 THR A 39 -2.772 -8.011 -27.058 1.00 0.00 H new ATOM 577 N ASN A 40 1.249 -7.274 -24.711 1.00 0.00 N ATOM 578 CA ASN A 40 2.547 -7.004 -24.107 1.00 0.00 C ATOM 579 C ASN A 40 3.615 -7.384 -25.131 1.00 0.00 C ATOM 580 O ASN A 40 4.762 -7.598 -24.826 1.00 0.00 O ATOM 581 CB ASN A 40 2.711 -7.698 -22.738 1.00 0.00 C ATOM 582 CG ASN A 40 4.045 -7.411 -22.119 1.00 0.00 C ATOM 583 OD1 ASN A 40 4.603 -6.344 -22.256 1.00 0.00 O ATOM 584 ND2 ASN A 40 4.673 -8.388 -21.534 1.00 0.00 N ATOM 0 H ASN A 40 0.650 -6.451 -24.776 1.00 0.00 H new ATOM 0 HA ASN A 40 2.650 -5.945 -23.870 1.00 0.00 H new ATOM 0 HB2 ASN A 40 1.920 -7.365 -22.066 1.00 0.00 H new ATOM 0 HB3 ASN A 40 2.592 -8.775 -22.861 1.00 0.00 H new ATOM 0 HD21 ASN A 40 5.626 -8.252 -21.196 1.00 0.00 H new ATOM 0 HD22 ASN A 40 4.213 -9.290 -21.413 1.00 0.00 H new ATOM 591 N GLY A 41 3.258 -7.520 -26.398 1.00 0.00 N ATOM 592 CA GLY A 41 4.130 -8.058 -27.393 1.00 0.00 C ATOM 593 C GLY A 41 3.669 -9.388 -27.935 1.00 0.00 C ATOM 594 O GLY A 41 3.817 -9.570 -29.136 1.00 0.00 O ATOM 0 H GLY A 41 2.340 -7.252 -26.754 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.213 -7.348 -28.215 1.00 0.00 H new ATOM 0 HA3 GLY A 41 5.127 -8.173 -26.968 1.00 0.00 H new ATOM 598 N TYR A 42 3.263 -10.318 -27.067 1.00 0.00 N ATOM 599 CA TYR A 42 2.757 -11.625 -27.445 1.00 0.00 C ATOM 600 C TYR A 42 1.761 -11.539 -28.587 1.00 0.00 C ATOM 601 O TYR A 42 1.063 -10.540 -28.751 1.00 0.00 O ATOM 602 CB TYR A 42 2.117 -12.277 -26.224 1.00 0.00 C ATOM 603 CG TYR A 42 3.097 -12.700 -25.161 1.00 0.00 C ATOM 604 CD1 TYR A 42 3.775 -13.913 -25.306 1.00 0.00 C ATOM 605 CD2 TYR A 42 3.354 -11.914 -24.022 1.00 0.00 C ATOM 606 CE1 TYR A 42 4.701 -14.317 -24.340 1.00 0.00 C ATOM 607 CE2 TYR A 42 4.235 -12.330 -23.031 1.00 0.00 C ATOM 608 CZ TYR A 42 4.927 -13.546 -23.186 1.00 0.00 C ATOM 609 OH TYR A 42 5.739 -14.032 -22.220 1.00 0.00 O ATOM 0 H TYR A 42 3.281 -10.172 -26.058 1.00 0.00 H new ATOM 0 HA TYR A 42 3.591 -12.232 -27.799 1.00 0.00 H new ATOM 0 HB2 TYR A 42 1.403 -11.579 -25.786 1.00 0.00 H new ATOM 0 HB3 TYR A 42 1.551 -13.150 -26.548 1.00 0.00 H new ATOM 0 HD1 TYR A 42 3.583 -14.539 -26.165 1.00 0.00 H new ATOM 0 HD2 TYR A 42 2.854 -10.963 -23.915 1.00 0.00 H new ATOM 0 HE1 TYR A 42 5.251 -15.235 -24.482 1.00 0.00 H new ATOM 0 HE2 TYR A 42 4.387 -11.725 -22.149 1.00 0.00 H new ATOM 0 HH TYR A 42 5.798 -13.385 -21.486 1.00 0.00 H new ATOM 619 N ASP A 43 1.665 -12.625 -29.342 1.00 0.00 N ATOM 620 CA ASP A 43 0.719 -12.672 -30.451 1.00 0.00 C ATOM 621 C ASP A 43 -0.671 -13.047 -29.941 1.00 0.00 C ATOM 622 O ASP A 43 -1.679 -12.567 -30.444 1.00 0.00 O ATOM 623 CB ASP A 43 1.148 -13.743 -31.464 1.00 0.00 C ATOM 624 CG ASP A 43 1.573 -13.168 -32.818 1.00 0.00 C ATOM 625 OD1 ASP A 43 1.138 -12.052 -33.175 1.00 0.00 O ATOM 626 OD2 ASP A 43 2.386 -13.852 -33.477 1.00 0.00 O ATOM 0 H ASP A 43 2.219 -13.471 -29.212 1.00 0.00 H new ATOM 0 HA ASP A 43 0.700 -11.688 -30.920 1.00 0.00 H new ATOM 0 HB2 ASP A 43 1.975 -14.316 -31.046 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.323 -14.439 -31.617 1.00 0.00 H new ATOM 631 N GLY A 44 -0.728 -13.936 -28.939 1.00 0.00 N ATOM 632 CA GLY A 44 -1.965 -14.443 -28.376 1.00 0.00 C ATOM 633 C GLY A 44 -1.990 -15.963 -28.377 1.00 0.00 C ATOM 634 O GLY A 44 -3.014 -16.561 -28.664 1.00 0.00 O ATOM 0 H GLY A 44 0.105 -14.323 -28.497 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.080 -14.076 -27.356 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -2.811 -14.063 -28.949 1.00 0.00 H new ATOM 638 N ASP A 45 -0.881 -16.598 -28.024 1.00 0.00 N ATOM 639 CA ASP A 45 -0.796 -18.048 -27.984 1.00 0.00 C ATOM 640 C ASP A 45 0.138 -18.465 -26.862 1.00 0.00 C ATOM 641 O ASP A 45 -0.339 -19.080 -25.913 1.00 0.00 O ATOM 642 CB ASP A 45 -0.254 -18.592 -29.312 1.00 0.00 C ATOM 643 CG ASP A 45 -1.171 -19.613 -29.957 1.00 0.00 C ATOM 644 OD1 ASP A 45 -1.135 -20.781 -29.500 1.00 0.00 O ATOM 645 OD2 ASP A 45 -1.898 -19.220 -30.886 1.00 0.00 O ATOM 0 H ASP A 45 -0.018 -16.123 -27.758 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.794 -18.452 -27.815 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.102 -17.762 -30.002 1.00 0.00 H new ATOM 0 HB3 ASP A 45 0.722 -19.047 -29.140 1.00 0.00 H new ATOM 650 N GLY A 46 1.447 -18.202 -27.024 1.00 0.00 N ATOM 651 CA GLY A 46 2.460 -18.608 -26.085 1.00 0.00 C ATOM 652 C GLY A 46 3.515 -17.564 -26.084 1.00 0.00 C ATOM 653 O GLY A 46 3.577 -16.845 -25.131 1.00 0.00 O ATOM 0 H GLY A 46 1.816 -17.694 -27.828 1.00 0.00 H new ATOM 0 HA2 GLY A 46 2.034 -18.723 -25.088 1.00 0.00 H new ATOM 0 HA3 GLY A 46 2.878 -19.575 -26.367 1.00 0.00 H new ATOM 657 N LYS A 47 4.353 -17.455 -27.104 1.00 0.00 N ATOM 658 CA LYS A 47 5.403 -16.448 -27.212 1.00 0.00 C ATOM 659 C LYS A 47 4.962 -15.320 -28.135 1.00 0.00 C ATOM 660 O LYS A 47 3.780 -15.171 -28.444 1.00 0.00 O ATOM 661 CB LYS A 47 6.699 -17.134 -27.632 1.00 0.00 C ATOM 662 CG LYS A 47 6.547 -17.795 -29.009 1.00 0.00 C ATOM 663 CD LYS A 47 7.885 -18.381 -29.469 1.00 0.00 C ATOM 664 CE LYS A 47 7.785 -19.907 -29.575 1.00 0.00 C ATOM 665 NZ LYS A 47 8.931 -20.441 -30.353 1.00 0.00 N ATOM 0 H LYS A 47 4.322 -18.084 -27.906 1.00 0.00 H new ATOM 0 HA LYS A 47 5.593 -15.972 -26.250 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.508 -16.404 -27.662 1.00 0.00 H new ATOM 0 HB3 LYS A 47 6.974 -17.885 -26.892 1.00 0.00 H new ATOM 0 HG2 LYS A 47 5.795 -18.583 -28.961 1.00 0.00 H new ATOM 0 HG3 LYS A 47 6.195 -17.062 -29.735 1.00 0.00 H new ATOM 0 HD2 LYS A 47 8.162 -17.959 -30.435 1.00 0.00 H new ATOM 0 HD3 LYS A 47 8.671 -18.109 -28.765 1.00 0.00 H new ATOM 0 HE2 LYS A 47 7.775 -20.349 -28.578 1.00 0.00 H new ATOM 0 HE3 LYS A 47 6.848 -20.185 -30.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 8.854 -21.476 -30.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 8.922 -20.032 -31.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 9.821 -20.190 -29.877 1.00 0.00 H new ATOM 679 N LEU A 48 5.911 -14.514 -28.550 1.00 0.00 N ATOM 680 CA LEU A 48 5.677 -13.383 -29.407 1.00 0.00 C ATOM 681 C LEU A 48 6.331 -13.612 -30.763 1.00 0.00 C ATOM 682 O LEU A 48 7.077 -14.591 -30.952 1.00 0.00 O ATOM 683 CB LEU A 48 6.145 -12.087 -28.722 1.00 0.00 C ATOM 684 CG LEU A 48 6.392 -12.154 -27.213 1.00 0.00 C ATOM 685 CD1 LEU A 48 7.728 -12.858 -26.954 1.00 0.00 C ATOM 686 CD2 LEU A 48 6.362 -10.770 -26.605 1.00 0.00 C ATOM 0 H LEU A 48 6.891 -14.633 -28.293 1.00 0.00 H new ATOM 0 HA LEU A 48 4.608 -13.270 -29.587 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.068 -11.763 -29.203 1.00 0.00 H new ATOM 0 HB3 LEU A 48 5.399 -11.315 -28.910 1.00 0.00 H new ATOM 0 HG LEU A 48 5.598 -12.728 -26.736 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.910 -12.909 -25.881 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.693 -13.867 -27.365 1.00 0.00 H new ATOM 0 HD13 LEU A 48 8.532 -12.299 -27.432 1.00 0.00 H new ATOM 0 HD21 LEU A 48 6.540 -10.840 -25.532 1.00 0.00 H new ATOM 0 HD22 LEU A 48 7.137 -10.155 -27.062 1.00 0.00 H new ATOM 0 HD23 LEU A 48 5.387 -10.316 -26.782 1.00 0.00 H new ATOM 698 N PRO A 49 6.098 -12.702 -31.704 1.00 0.00 N ATOM 699 CA PRO A 49 6.672 -12.796 -33.037 1.00 0.00 C ATOM 700 C PRO A 49 8.158 -12.445 -33.015 1.00 0.00 C ATOM 701 O PRO A 49 8.654 -11.791 -32.090 1.00 0.00 O ATOM 702 CB PRO A 49 5.861 -11.827 -33.920 1.00 0.00 C ATOM 703 CG PRO A 49 5.147 -10.881 -32.956 1.00 0.00 C ATOM 704 CD PRO A 49 5.272 -11.515 -31.575 1.00 0.00 C ATOM 0 HA PRO A 49 6.614 -13.811 -33.431 1.00 0.00 H new ATOM 0 HB2 PRO A 49 6.514 -11.276 -34.597 1.00 0.00 H new ATOM 0 HB3 PRO A 49 5.145 -12.368 -34.538 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.602 -9.890 -32.973 1.00 0.00 H new ATOM 0 HG3 PRO A 49 4.101 -10.756 -33.235 1.00 0.00 H new ATOM 0 HD2 PRO A 49 5.720 -10.813 -30.872 1.00 0.00 H new ATOM 0 HD3 PRO A 49 4.288 -11.775 -31.184 1.00 0.00 H new ATOM 712 N LYS A 50 8.888 -12.940 -34.024 1.00 0.00 N ATOM 713 CA LYS A 50 10.312 -12.664 -34.163 1.00 0.00 C ATOM 714 C LYS A 50 10.505 -11.145 -34.290 1.00 0.00 C ATOM 715 O LYS A 50 10.478 -10.608 -35.392 1.00 0.00 O ATOM 716 CB LYS A 50 10.904 -13.497 -35.311 1.00 0.00 C ATOM 717 CG LYS A 50 12.163 -12.835 -35.899 1.00 0.00 C ATOM 718 CD LYS A 50 13.206 -13.859 -36.321 1.00 0.00 C ATOM 719 CE LYS A 50 14.610 -13.326 -36.031 1.00 0.00 C ATOM 720 NZ LYS A 50 15.125 -12.573 -37.202 1.00 0.00 N ATOM 0 H LYS A 50 8.506 -13.537 -34.757 1.00 0.00 H new ATOM 0 HA LYS A 50 10.873 -12.973 -33.281 1.00 0.00 H new ATOM 0 HB2 LYS A 50 11.152 -14.494 -34.948 1.00 0.00 H new ATOM 0 HB3 LYS A 50 10.157 -13.620 -36.095 1.00 0.00 H new ATOM 0 HG2 LYS A 50 11.884 -12.227 -36.760 1.00 0.00 H new ATOM 0 HG3 LYS A 50 12.596 -12.161 -35.160 1.00 0.00 H new ATOM 0 HD2 LYS A 50 13.046 -14.795 -35.786 1.00 0.00 H new ATOM 0 HD3 LYS A 50 13.104 -14.078 -37.384 1.00 0.00 H new ATOM 0 HE2 LYS A 50 14.587 -12.678 -35.155 1.00 0.00 H new ATOM 0 HE3 LYS A 50 15.280 -14.154 -35.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 16.079 -12.216 -36.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 15.164 -13.202 -38.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 14.493 -11.773 -37.405 1.00 0.00 H new ATOM 734 N GLY A 51 10.842 -10.489 -33.189 1.00 0.00 N ATOM 735 CA GLY A 51 11.017 -9.050 -33.175 1.00 0.00 C ATOM 736 C GLY A 51 10.076 -8.379 -32.208 1.00 0.00 C ATOM 737 O GLY A 51 9.340 -7.494 -32.631 1.00 0.00 O ATOM 0 H GLY A 51 11.000 -10.939 -32.287 1.00 0.00 H new ATOM 0 HA2 GLY A 51 12.046 -8.812 -32.905 1.00 0.00 H new ATOM 0 HA3 GLY A 51 10.851 -8.654 -34.177 1.00 0.00 H new ATOM 741 N ARG A 52 10.103 -8.784 -30.931 1.00 0.00 N ATOM 742 CA ARG A 52 9.291 -8.178 -29.879 1.00 0.00 C ATOM 743 C ARG A 52 9.989 -8.267 -28.545 1.00 0.00 C ATOM 744 O ARG A 52 10.612 -9.281 -28.254 1.00 0.00 O ATOM 745 CB ARG A 52 7.937 -8.901 -29.812 1.00 0.00 C ATOM 746 CG ARG A 52 6.890 -8.182 -30.670 1.00 0.00 C ATOM 747 CD ARG A 52 6.496 -6.829 -30.076 1.00 0.00 C ATOM 748 NE ARG A 52 6.272 -5.811 -31.109 1.00 0.00 N ATOM 749 CZ ARG A 52 6.079 -4.527 -30.892 1.00 0.00 C ATOM 750 NH1 ARG A 52 6.046 -4.052 -29.677 1.00 0.00 N ATOM 751 NH2 ARG A 52 5.887 -3.711 -31.885 1.00 0.00 N ATOM 0 H ARG A 52 10.695 -9.547 -30.602 1.00 0.00 H new ATOM 0 HA ARG A 52 9.138 -7.124 -30.111 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.052 -9.929 -30.156 1.00 0.00 H new ATOM 0 HB3 ARG A 52 7.596 -8.948 -28.778 1.00 0.00 H new ATOM 0 HG2 ARG A 52 7.284 -8.036 -31.676 1.00 0.00 H new ATOM 0 HG3 ARG A 52 6.004 -8.810 -30.763 1.00 0.00 H new ATOM 0 HD2 ARG A 52 5.590 -6.946 -29.482 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.280 -6.490 -29.399 1.00 0.00 H new ATOM 0 HE ARG A 52 6.265 -6.126 -32.079 1.00 0.00 H new ATOM 0 HH11 ARG A 52 6.171 -4.678 -28.881 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.896 -3.055 -29.523 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.885 -4.064 -32.842 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.738 -2.718 -31.707 1.00 0.00 H new ATOM 765 N THR A 53 9.838 -7.227 -27.740 1.00 0.00 N ATOM 766 CA THR A 53 10.471 -7.149 -26.434 1.00 0.00 C ATOM 767 C THR A 53 9.462 -6.741 -25.384 1.00 0.00 C ATOM 768 O THR A 53 9.103 -5.562 -25.312 1.00 0.00 O ATOM 769 CB THR A 53 11.705 -6.275 -26.494 1.00 0.00 C ATOM 770 OG1 THR A 53 12.691 -7.005 -27.186 1.00 0.00 O ATOM 771 CG2 THR A 53 12.285 -5.957 -25.120 1.00 0.00 C ATOM 0 H THR A 53 9.272 -6.412 -27.975 1.00 0.00 H new ATOM 0 HA THR A 53 10.827 -8.134 -26.131 1.00 0.00 H new ATOM 0 HB THR A 53 11.424 -5.335 -26.970 1.00 0.00 H new ATOM 0 HG1 THR A 53 13.510 -6.471 -27.248 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.167 -5.327 -25.234 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.539 -5.432 -24.523 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.563 -6.884 -24.619 1.00 0.00 H new ATOM 779 N PRO A 54 8.903 -7.731 -24.676 1.00 0.00 N ATOM 780 CA PRO A 54 7.930 -7.474 -23.626 1.00 0.00 C ATOM 781 C PRO A 54 8.586 -6.866 -22.381 1.00 0.00 C ATOM 782 O PRO A 54 9.808 -6.733 -22.264 1.00 0.00 O ATOM 783 CB PRO A 54 7.305 -8.843 -23.291 1.00 0.00 C ATOM 784 CG PRO A 54 8.254 -9.891 -23.824 1.00 0.00 C ATOM 785 CD PRO A 54 9.231 -9.150 -24.737 1.00 0.00 C ATOM 0 HA PRO A 54 7.183 -6.753 -23.958 1.00 0.00 H new ATOM 0 HB2 PRO A 54 7.169 -8.954 -22.215 1.00 0.00 H new ATOM 0 HB3 PRO A 54 6.321 -8.942 -23.749 1.00 0.00 H new ATOM 0 HG2 PRO A 54 8.782 -10.389 -23.011 1.00 0.00 H new ATOM 0 HG3 PRO A 54 7.715 -10.662 -24.374 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.259 -9.319 -24.416 1.00 0.00 H new ATOM 0 HD3 PRO A 54 9.152 -9.517 -25.760 1.00 0.00 H new ATOM 793 N ILE A 55 7.750 -6.471 -21.428 1.00 0.00 N ATOM 794 CA ILE A 55 8.214 -5.802 -20.217 1.00 0.00 C ATOM 795 C ILE A 55 8.584 -6.856 -19.208 1.00 0.00 C ATOM 796 O ILE A 55 7.753 -7.662 -18.861 1.00 0.00 O ATOM 797 CB ILE A 55 7.163 -4.826 -19.693 1.00 0.00 C ATOM 798 CG1 ILE A 55 6.546 -4.023 -20.841 1.00 0.00 C ATOM 799 CG2 ILE A 55 7.848 -3.888 -18.708 1.00 0.00 C ATOM 800 CD1 ILE A 55 5.554 -3.008 -20.354 1.00 0.00 C ATOM 0 H ILE A 55 6.740 -6.604 -21.471 1.00 0.00 H new ATOM 0 HA ILE A 55 9.097 -5.199 -20.430 1.00 0.00 H new ATOM 0 HB ILE A 55 6.358 -5.375 -19.204 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.337 -3.518 -21.395 1.00 0.00 H new ATOM 0 HG13 ILE A 55 6.055 -4.704 -21.536 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.120 -3.177 -18.316 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.269 -4.467 -17.886 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.646 -3.347 -19.216 1.00 0.00 H new ATOM 0 HD11 ILE A 55 5.143 -2.463 -21.204 1.00 0.00 H new ATOM 0 HD12 ILE A 55 4.747 -3.513 -19.823 1.00 0.00 H new ATOM 0 HD13 ILE A 55 6.050 -2.309 -19.680 1.00 0.00 H new ATOM 812 N LYS A 56 9.856 -7.014 -18.877 1.00 0.00 N ATOM 813 CA LYS A 56 10.291 -7.993 -17.895 1.00 0.00 C ATOM 814 C LYS A 56 10.057 -7.424 -16.501 1.00 0.00 C ATOM 815 O LYS A 56 10.465 -6.304 -16.207 1.00 0.00 O ATOM 816 CB LYS A 56 11.749 -8.350 -18.201 1.00 0.00 C ATOM 817 CG LYS A 56 12.381 -9.156 -17.051 1.00 0.00 C ATOM 818 CD LYS A 56 12.882 -10.523 -17.511 1.00 0.00 C ATOM 819 CE LYS A 56 14.407 -10.514 -17.598 1.00 0.00 C ATOM 820 NZ LYS A 56 14.852 -11.305 -18.772 1.00 0.00 N ATOM 0 H LYS A 56 10.616 -6.467 -19.282 1.00 0.00 H new ATOM 0 HA LYS A 56 9.722 -8.922 -17.940 1.00 0.00 H new ATOM 0 HB2 LYS A 56 11.798 -8.929 -19.123 1.00 0.00 H new ATOM 0 HB3 LYS A 56 12.322 -7.438 -18.366 1.00 0.00 H new ATOM 0 HG2 LYS A 56 13.211 -8.591 -16.627 1.00 0.00 H new ATOM 0 HG3 LYS A 56 11.647 -9.289 -16.256 1.00 0.00 H new ATOM 0 HD2 LYS A 56 12.553 -11.294 -16.814 1.00 0.00 H new ATOM 0 HD3 LYS A 56 12.455 -10.769 -18.483 1.00 0.00 H new ATOM 0 HE2 LYS A 56 14.769 -9.489 -17.681 1.00 0.00 H new ATOM 0 HE3 LYS A 56 14.834 -10.930 -16.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 15.891 -11.294 -18.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 14.520 -12.286 -18.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 14.457 -10.890 -19.640 1.00 0.00 H new ATOM 834 N PHE A 57 9.552 -8.276 -15.618 1.00 0.00 N ATOM 835 CA PHE A 57 9.264 -7.911 -14.245 1.00 0.00 C ATOM 836 C PHE A 57 10.099 -8.754 -13.310 1.00 0.00 C ATOM 837 O PHE A 57 10.800 -8.229 -12.462 1.00 0.00 O ATOM 838 CB PHE A 57 7.784 -8.145 -13.986 1.00 0.00 C ATOM 839 CG PHE A 57 6.904 -7.766 -15.164 1.00 0.00 C ATOM 840 CD1 PHE A 57 6.638 -8.705 -16.187 1.00 0.00 C ATOM 841 CD2 PHE A 57 6.293 -6.506 -15.206 1.00 0.00 C ATOM 842 CE1 PHE A 57 5.719 -8.390 -17.200 1.00 0.00 C ATOM 843 CE2 PHE A 57 5.444 -6.161 -16.265 1.00 0.00 C ATOM 844 CZ PHE A 57 5.165 -7.095 -17.279 1.00 0.00 C ATOM 0 H PHE A 57 9.331 -9.246 -15.841 1.00 0.00 H new ATOM 0 HA PHE A 57 9.505 -6.862 -14.073 1.00 0.00 H new ATOM 0 HB2 PHE A 57 7.625 -9.196 -13.746 1.00 0.00 H new ATOM 0 HB3 PHE A 57 7.479 -7.569 -13.113 1.00 0.00 H new ATOM 0 HD1 PHE A 57 7.140 -9.661 -16.189 1.00 0.00 H new ATOM 0 HD2 PHE A 57 6.478 -5.795 -14.415 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.435 -9.142 -17.922 1.00 0.00 H new ATOM 0 HE2 PHE A 57 5.003 -5.176 -16.303 1.00 0.00 H new ATOM 0 HZ PHE A 57 4.532 -6.823 -18.111 1.00 0.00 H new ATOM 854 N GLY A 58 10.034 -10.077 -13.477 1.00 0.00 N ATOM 855 CA GLY A 58 10.721 -11.029 -12.618 1.00 0.00 C ATOM 856 C GLY A 58 9.776 -12.107 -12.102 1.00 0.00 C ATOM 857 O GLY A 58 10.216 -13.047 -11.454 1.00 0.00 O ATOM 0 H GLY A 58 9.495 -10.517 -14.223 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.537 -11.495 -13.171 1.00 0.00 H new ATOM 0 HA3 GLY A 58 11.167 -10.502 -11.775 1.00 0.00 H new ATOM 861 N LYS A 59 8.460 -11.940 -12.312 1.00 0.00 N ATOM 862 CA LYS A 59 7.466 -12.934 -11.917 1.00 0.00 C ATOM 863 C LYS A 59 7.574 -14.166 -12.755 1.00 0.00 C ATOM 864 O LYS A 59 8.326 -14.153 -13.686 1.00 0.00 O ATOM 865 CB LYS A 59 6.089 -12.297 -11.923 1.00 0.00 C ATOM 866 CG LYS A 59 5.633 -12.030 -10.489 1.00 0.00 C ATOM 867 CD LYS A 59 5.227 -13.345 -9.807 1.00 0.00 C ATOM 868 CE LYS A 59 5.001 -13.119 -8.309 1.00 0.00 C ATOM 869 NZ LYS A 59 4.612 -14.396 -7.651 1.00 0.00 N ATOM 0 H LYS A 59 8.063 -11.113 -12.759 1.00 0.00 H new ATOM 0 HA LYS A 59 7.655 -13.271 -10.898 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.113 -11.364 -12.486 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.377 -12.953 -12.424 1.00 0.00 H new ATOM 0 HG2 LYS A 59 6.436 -11.554 -9.927 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.791 -11.338 -10.490 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.317 -13.734 -10.264 1.00 0.00 H new ATOM 0 HD3 LYS A 59 6.004 -14.095 -9.955 1.00 0.00 H new ATOM 0 HE2 LYS A 59 5.910 -12.727 -7.851 1.00 0.00 H new ATOM 0 HE3 LYS A 59 4.221 -12.372 -8.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 4.461 -14.231 -6.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 3.734 -14.753 -8.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 5.369 -15.097 -7.779 1.00 0.00 H new ATOM 883 N SER A 60 6.875 -15.228 -12.402 1.00 0.00 N ATOM 884 CA SER A 60 6.898 -16.464 -13.142 1.00 0.00 C ATOM 885 C SER A 60 5.657 -16.539 -13.969 1.00 0.00 C ATOM 886 O SER A 60 5.751 -16.836 -15.118 1.00 0.00 O ATOM 887 CB SER A 60 6.894 -17.656 -12.215 1.00 0.00 C ATOM 888 OG SER A 60 8.201 -18.055 -11.924 1.00 0.00 O ATOM 0 H SER A 60 6.269 -15.251 -11.582 1.00 0.00 H new ATOM 0 HA SER A 60 7.801 -16.483 -13.752 1.00 0.00 H new ATOM 0 HB2 SER A 60 6.370 -17.405 -11.293 1.00 0.00 H new ATOM 0 HB3 SER A 60 6.350 -18.481 -12.676 1.00 0.00 H new ATOM 0 HG SER A 60 8.181 -18.827 -11.321 1.00 0.00 H new ATOM 894 N ASP A 61 4.465 -16.276 -13.438 1.00 0.00 N ATOM 895 CA ASP A 61 3.215 -16.303 -14.192 1.00 0.00 C ATOM 896 C ASP A 61 3.157 -15.080 -15.099 1.00 0.00 C ATOM 897 O ASP A 61 2.676 -15.177 -16.215 1.00 0.00 O ATOM 898 CB ASP A 61 2.018 -16.237 -13.225 1.00 0.00 C ATOM 899 CG ASP A 61 1.388 -17.597 -12.959 1.00 0.00 C ATOM 900 OD1 ASP A 61 2.140 -18.482 -12.491 1.00 0.00 O ATOM 901 OD2 ASP A 61 0.206 -17.772 -13.299 1.00 0.00 O ATOM 0 H ASP A 61 4.339 -16.034 -12.455 1.00 0.00 H new ATOM 0 HA ASP A 61 3.171 -17.222 -14.776 1.00 0.00 H new ATOM 0 HB2 ASP A 61 2.346 -15.804 -12.280 1.00 0.00 H new ATOM 0 HB3 ASP A 61 1.263 -15.568 -13.637 1.00 0.00 H new ATOM 906 N CYS A 62 3.591 -13.916 -14.575 1.00 0.00 N ATOM 907 CA CYS A 62 3.614 -12.693 -15.373 1.00 0.00 C ATOM 908 C CYS A 62 4.723 -12.767 -16.414 1.00 0.00 C ATOM 909 O CYS A 62 4.779 -11.950 -17.319 1.00 0.00 O ATOM 910 CB CYS A 62 3.736 -11.507 -14.427 1.00 0.00 C ATOM 911 SG CYS A 62 4.092 -9.931 -15.019 1.00 0.00 S ATOM 0 H CYS A 62 3.924 -13.806 -13.617 1.00 0.00 H new ATOM 0 HA CYS A 62 2.690 -12.569 -15.938 1.00 0.00 H new ATOM 0 HB2 CYS A 62 2.796 -11.437 -13.880 1.00 0.00 H new ATOM 0 HB3 CYS A 62 4.509 -11.757 -13.701 1.00 0.00 H new ATOM 916 N ASP A 63 5.637 -13.720 -16.246 1.00 0.00 N ATOM 917 CA ASP A 63 6.679 -13.967 -17.229 1.00 0.00 C ATOM 918 C ASP A 63 6.310 -15.082 -18.196 1.00 0.00 C ATOM 919 O ASP A 63 6.643 -15.010 -19.373 1.00 0.00 O ATOM 920 CB ASP A 63 7.931 -14.370 -16.496 1.00 0.00 C ATOM 921 CG ASP A 63 9.026 -14.933 -17.391 1.00 0.00 C ATOM 922 OD1 ASP A 63 9.400 -14.251 -18.367 1.00 0.00 O ATOM 923 OD2 ASP A 63 9.577 -15.990 -17.018 1.00 0.00 O ATOM 0 H ASP A 63 5.673 -14.334 -15.433 1.00 0.00 H new ATOM 0 HA ASP A 63 6.819 -13.054 -17.808 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.322 -13.502 -15.965 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.674 -15.115 -15.743 1.00 0.00 H new ATOM 928 N ARG A 64 5.560 -16.080 -17.734 1.00 0.00 N ATOM 929 CA ARG A 64 5.186 -17.210 -18.525 1.00 0.00 C ATOM 930 C ARG A 64 4.525 -16.714 -19.800 1.00 0.00 C ATOM 931 O ARG A 64 3.904 -15.640 -19.852 1.00 0.00 O ATOM 932 CB ARG A 64 4.295 -18.124 -17.696 1.00 0.00 C ATOM 933 CG ARG A 64 2.807 -18.060 -18.036 1.00 0.00 C ATOM 934 CD ARG A 64 1.918 -18.985 -17.215 1.00 0.00 C ATOM 935 NE ARG A 64 2.569 -19.570 -16.044 1.00 0.00 N ATOM 936 CZ ARG A 64 3.420 -20.580 -16.076 1.00 0.00 C ATOM 937 NH1 ARG A 64 3.618 -21.280 -17.171 1.00 0.00 N ATOM 938 NH2 ARG A 64 4.090 -20.903 -15.016 1.00 0.00 N ATOM 0 H ARG A 64 5.198 -16.110 -16.781 1.00 0.00 H new ATOM 0 HA ARG A 64 6.053 -17.800 -18.821 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.637 -19.151 -17.822 1.00 0.00 H new ATOM 0 HB3 ARG A 64 4.422 -17.873 -16.643 1.00 0.00 H new ATOM 0 HG2 ARG A 64 2.463 -17.035 -17.900 1.00 0.00 H new ATOM 0 HG3 ARG A 64 2.680 -18.301 -19.091 1.00 0.00 H new ATOM 0 HD2 ARG A 64 1.041 -18.428 -16.887 1.00 0.00 H new ATOM 0 HD3 ARG A 64 1.562 -19.790 -17.857 1.00 0.00 H new ATOM 0 HE ARG A 64 2.349 -19.168 -15.133 1.00 0.00 H new ATOM 0 HH11 ARG A 64 3.109 -21.048 -18.024 1.00 0.00 H new ATOM 0 HH12 ARG A 64 4.281 -22.055 -17.168 1.00 0.00 H new ATOM 0 HH21 ARG A 64 3.962 -20.377 -14.152 1.00 0.00 H new ATOM 0 HH22 ARG A 64 4.746 -21.684 -15.045 1.00 0.00 H new ATOM 952 N PRO A 65 4.352 -17.650 -20.725 1.00 0.00 N ATOM 953 CA PRO A 65 3.593 -17.384 -21.917 1.00 0.00 C ATOM 954 C PRO A 65 2.078 -17.280 -21.714 1.00 0.00 C ATOM 955 O PRO A 65 1.461 -18.194 -21.152 1.00 0.00 O ATOM 956 CB PRO A 65 3.984 -18.497 -22.876 1.00 0.00 C ATOM 957 CG PRO A 65 4.530 -19.635 -22.048 1.00 0.00 C ATOM 958 CD PRO A 65 4.773 -19.042 -20.667 1.00 0.00 C ATOM 0 HA PRO A 65 3.831 -16.393 -22.303 1.00 0.00 H new ATOM 0 HB2 PRO A 65 3.121 -18.824 -23.457 1.00 0.00 H new ATOM 0 HB3 PRO A 65 4.732 -18.146 -23.587 1.00 0.00 H new ATOM 0 HG2 PRO A 65 3.823 -20.463 -22.002 1.00 0.00 H new ATOM 0 HG3 PRO A 65 5.453 -20.027 -22.476 1.00 0.00 H new ATOM 0 HD2 PRO A 65 4.209 -19.585 -19.909 1.00 0.00 H new ATOM 0 HD3 PRO A 65 5.826 -19.116 -20.395 1.00 0.00 H new ATOM 966 N PRO A 66 1.462 -16.176 -22.126 1.00 0.00 N ATOM 967 CA PRO A 66 0.033 -15.959 -21.999 1.00 0.00 C ATOM 968 C PRO A 66 -0.748 -16.812 -22.957 1.00 0.00 C ATOM 969 O PRO A 66 -0.145 -17.341 -23.863 1.00 0.00 O ATOM 970 CB PRO A 66 -0.209 -14.472 -22.263 1.00 0.00 C ATOM 971 CG PRO A 66 1.025 -13.956 -22.973 1.00 0.00 C ATOM 972 CD PRO A 66 2.059 -15.057 -22.807 1.00 0.00 C ATOM 0 HA PRO A 66 -0.307 -16.242 -21.003 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -1.099 -14.326 -22.876 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -0.373 -13.934 -21.329 1.00 0.00 H new ATOM 0 HG2 PRO A 66 0.822 -13.760 -24.026 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.371 -13.020 -22.535 1.00 0.00 H new ATOM 0 HD2 PRO A 66 2.434 -15.369 -23.782 1.00 0.00 H new ATOM 0 HD3 PRO A 66 2.913 -14.686 -22.241 1.00 0.00 H new ATOM 980 N LYS A 67 -2.057 -16.970 -22.752 1.00 0.00 N ATOM 981 CA LYS A 67 -2.905 -17.764 -23.644 1.00 0.00 C ATOM 982 C LYS A 67 -4.057 -16.910 -24.086 1.00 0.00 C ATOM 983 O LYS A 67 -4.686 -16.343 -23.229 1.00 0.00 O ATOM 984 CB LYS A 67 -3.299 -19.058 -22.928 1.00 0.00 C ATOM 985 CG LYS A 67 -4.376 -19.824 -23.713 1.00 0.00 C ATOM 986 CD LYS A 67 -3.825 -21.128 -24.278 1.00 0.00 C ATOM 987 CE LYS A 67 -4.887 -21.811 -25.148 1.00 0.00 C ATOM 988 NZ LYS A 67 -4.315 -23.028 -25.782 1.00 0.00 N ATOM 0 H LYS A 67 -2.558 -16.553 -21.967 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.387 -18.072 -24.552 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -2.419 -19.689 -22.802 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -3.670 -18.826 -21.930 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.223 -20.037 -23.060 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.749 -19.201 -24.526 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -2.931 -20.929 -24.869 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -3.528 -21.790 -23.465 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -5.751 -22.079 -24.540 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -5.239 -21.122 -25.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -5.040 -23.486 -26.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.504 -22.761 -26.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -4.000 -23.689 -25.043 1.00 0.00 H new ATOM 1002 N HIS A 68 -4.349 -16.836 -25.373 1.00 0.00 N ATOM 1003 CA HIS A 68 -5.513 -16.127 -25.880 1.00 0.00 C ATOM 1004 C HIS A 68 -6.390 -17.069 -26.692 1.00 0.00 C ATOM 1005 O HIS A 68 -5.956 -18.130 -27.149 1.00 0.00 O ATOM 1006 CB HIS A 68 -5.008 -14.923 -26.658 1.00 0.00 C ATOM 1007 CG HIS A 68 -6.071 -14.019 -27.171 1.00 0.00 C ATOM 1008 ND1 HIS A 68 -6.405 -13.829 -28.502 1.00 0.00 N ATOM 1009 CD2 HIS A 68 -6.912 -13.262 -26.406 1.00 0.00 C ATOM 1010 CE1 HIS A 68 -7.422 -12.940 -28.560 1.00 0.00 C ATOM 1011 NE2 HIS A 68 -7.763 -12.617 -27.302 1.00 0.00 N ATOM 0 H HIS A 68 -3.781 -17.269 -26.101 1.00 0.00 H new ATOM 0 HA HIS A 68 -6.154 -15.765 -25.077 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -4.341 -14.348 -26.016 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -4.414 -15.276 -27.501 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -6.917 -13.180 -25.329 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -7.880 -12.557 -29.460 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -8.528 -11.995 -27.042 1.00 0.00 H new ATOM 1020 N SER A 69 -7.633 -16.678 -26.886 1.00 0.00 N ATOM 1021 CA SER A 69 -8.591 -17.455 -27.653 1.00 0.00 C ATOM 1022 C SER A 69 -9.636 -16.540 -28.268 1.00 0.00 C ATOM 1023 O SER A 69 -9.562 -15.313 -28.148 1.00 0.00 O ATOM 1024 CB SER A 69 -9.249 -18.509 -26.768 1.00 0.00 C ATOM 1025 OG SER A 69 -8.947 -19.802 -27.252 1.00 0.00 O ATOM 0 H SER A 69 -8.011 -15.807 -26.514 1.00 0.00 H new ATOM 0 HA SER A 69 -8.064 -17.966 -28.459 1.00 0.00 H new ATOM 0 HB2 SER A 69 -8.898 -18.405 -25.741 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.329 -18.360 -26.752 1.00 0.00 H new ATOM 0 HG SER A 69 -9.371 -20.474 -26.678 1.00 0.00 H new ATOM 1031 N LYS A 70 -10.571 -17.116 -29.017 1.00 0.00 N ATOM 1032 CA LYS A 70 -11.669 -16.368 -29.618 1.00 0.00 C ATOM 1033 C LYS A 70 -12.827 -16.200 -28.643 1.00 0.00 C ATOM 1034 O LYS A 70 -13.851 -16.836 -28.792 1.00 0.00 O ATOM 1035 CB LYS A 70 -12.064 -17.046 -30.939 1.00 0.00 C ATOM 1036 CG LYS A 70 -11.821 -16.083 -32.106 1.00 0.00 C ATOM 1037 CD LYS A 70 -10.472 -16.379 -32.771 1.00 0.00 C ATOM 1038 CE LYS A 70 -10.071 -15.223 -33.693 1.00 0.00 C ATOM 1039 NZ LYS A 70 -8.633 -15.338 -34.059 1.00 0.00 N ATOM 0 H LYS A 70 -10.589 -18.115 -29.224 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.351 -15.352 -29.850 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.482 -17.957 -31.080 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -13.113 -17.339 -30.909 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.623 -16.179 -32.838 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.838 -15.054 -31.747 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -9.707 -16.528 -32.009 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.536 -17.305 -33.343 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.686 -15.235 -34.593 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -10.253 -14.270 -33.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.370 -14.550 -34.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -8.052 -15.305 -33.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.471 -16.240 -34.551 1.00 0.00 H new ATOM 1053 N ASP A 71 -12.616 -15.404 -27.610 1.00 0.00 N ATOM 1054 CA ASP A 71 -13.646 -15.141 -26.608 1.00 0.00 C ATOM 1055 C ASP A 71 -13.122 -14.130 -25.593 1.00 0.00 C ATOM 1056 O ASP A 71 -13.826 -13.207 -25.193 1.00 0.00 O ATOM 1057 CB ASP A 71 -13.988 -16.438 -25.849 1.00 0.00 C ATOM 1058 CG ASP A 71 -15.422 -16.920 -26.104 1.00 0.00 C ATOM 1059 OD1 ASP A 71 -16.318 -16.071 -26.329 1.00 0.00 O ATOM 1060 OD2 ASP A 71 -15.600 -18.156 -26.011 1.00 0.00 O ATOM 0 H ASP A 71 -11.734 -14.922 -27.438 1.00 0.00 H new ATOM 0 HA ASP A 71 -14.532 -14.757 -27.114 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.289 -17.221 -26.145 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.850 -16.274 -24.780 1.00 0.00 H new ATOM 1065 N GLY A 72 -11.851 -14.300 -25.203 1.00 0.00 N ATOM 1066 CA GLY A 72 -11.209 -13.445 -24.236 1.00 0.00 C ATOM 1067 C GLY A 72 -10.706 -14.242 -23.061 1.00 0.00 C ATOM 1068 O GLY A 72 -9.507 -14.342 -22.878 1.00 0.00 O ATOM 0 H GLY A 72 -11.250 -15.042 -25.560 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -10.378 -12.919 -24.706 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -11.913 -12.687 -23.892 1.00 0.00 H new ATOM 1072 N ASN A 73 -11.610 -14.858 -22.313 1.00 0.00 N ATOM 1073 CA ASN A 73 -11.334 -15.554 -21.059 1.00 0.00 C ATOM 1074 C ASN A 73 -12.059 -16.876 -21.128 1.00 0.00 C ATOM 1075 O ASN A 73 -12.952 -17.088 -20.324 1.00 0.00 O ATOM 1076 CB ASN A 73 -11.769 -14.774 -19.797 1.00 0.00 C ATOM 1077 CG ASN A 73 -13.040 -14.001 -20.009 1.00 0.00 C ATOM 1078 OD1 ASN A 73 -14.106 -14.285 -19.506 1.00 0.00 O ATOM 1079 ND2 ASN A 73 -12.954 -13.028 -20.886 1.00 0.00 N ATOM 0 H ASN A 73 -12.596 -14.889 -22.571 1.00 0.00 H new ATOM 0 HA ASN A 73 -10.255 -15.673 -20.959 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -11.905 -15.472 -18.971 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -10.974 -14.087 -19.506 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -13.788 -12.504 -21.150 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -12.053 -12.796 -21.304 1.00 0.00 H new ATOM 1086 N GLY A 74 -11.779 -17.681 -22.152 1.00 0.00 N ATOM 1087 CA GLY A 74 -12.398 -18.978 -22.322 1.00 0.00 C ATOM 1088 C GLY A 74 -12.130 -19.886 -21.132 1.00 0.00 C ATOM 1089 O GLY A 74 -12.708 -19.746 -20.072 1.00 0.00 O ATOM 0 H GLY A 74 -11.112 -17.443 -22.886 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -13.473 -18.855 -22.451 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.019 -19.446 -23.230 1.00 0.00 H new ATOM 1093 N LYS A 75 -11.310 -20.922 -21.313 1.00 0.00 N ATOM 1094 CA LYS A 75 -10.973 -21.849 -20.236 1.00 0.00 C ATOM 1095 C LYS A 75 -10.278 -21.098 -19.100 1.00 0.00 C ATOM 1096 O LYS A 75 -10.868 -20.516 -18.213 1.00 0.00 O ATOM 1097 CB LYS A 75 -10.134 -23.000 -20.813 1.00 0.00 C ATOM 1098 CG LYS A 75 -11.049 -24.049 -21.458 1.00 0.00 C ATOM 1099 CD LYS A 75 -10.574 -25.456 -21.081 1.00 0.00 C ATOM 1100 CE LYS A 75 -11.457 -26.507 -21.762 1.00 0.00 C ATOM 1101 NZ LYS A 75 -11.364 -27.802 -21.035 1.00 0.00 N ATOM 0 H LYS A 75 -10.864 -21.140 -22.204 1.00 0.00 H new ATOM 0 HA LYS A 75 -11.872 -22.289 -19.804 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.433 -22.614 -21.553 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.541 -23.460 -20.022 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -12.077 -23.901 -21.126 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.044 -23.932 -22.542 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -9.535 -25.591 -21.383 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.611 -25.584 -19.999 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -12.492 -26.166 -21.782 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -11.145 -26.639 -22.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -11.966 -28.508 -21.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -10.378 -28.132 -21.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.683 -27.673 -20.054 1.00 0.00 H new ATOM 1115 N THR A 76 -8.965 -21.164 -19.065 1.00 0.00 N ATOM 1116 CA THR A 76 -8.178 -20.511 -18.031 1.00 0.00 C ATOM 1117 C THR A 76 -7.223 -19.535 -18.635 1.00 0.00 C ATOM 1118 O THR A 76 -6.225 -19.234 -18.014 1.00 0.00 O ATOM 1119 CB THR A 76 -7.520 -21.558 -17.126 1.00 0.00 C ATOM 1120 OG1 THR A 76 -7.729 -21.114 -15.823 1.00 0.00 O ATOM 1121 CG2 THR A 76 -6.026 -21.792 -17.356 1.00 0.00 C ATOM 0 H THR A 76 -8.408 -21.672 -19.752 1.00 0.00 H new ATOM 0 HA THR A 76 -8.828 -19.922 -17.384 1.00 0.00 H new ATOM 0 HB THR A 76 -7.972 -22.525 -17.348 1.00 0.00 H new ATOM 0 HG1 THR A 76 -7.328 -21.749 -15.193 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.666 -22.551 -16.662 1.00 0.00 H new ATOM 0 HG22 THR A 76 -5.864 -22.130 -18.380 1.00 0.00 H new ATOM 0 HG23 THR A 76 -5.482 -20.862 -17.190 1.00 0.00 H new ATOM 1129 N ASP A 77 -7.407 -19.152 -19.891 1.00 0.00 N ATOM 1130 CA ASP A 77 -6.548 -18.268 -20.668 1.00 0.00 C ATOM 1131 C ASP A 77 -5.724 -17.342 -19.807 1.00 0.00 C ATOM 1132 O ASP A 77 -6.253 -16.401 -19.290 1.00 0.00 O ATOM 1133 CB ASP A 77 -7.387 -17.428 -21.620 1.00 0.00 C ATOM 1134 CG ASP A 77 -8.473 -18.106 -22.413 1.00 0.00 C ATOM 1135 OD1 ASP A 77 -8.600 -19.347 -22.319 1.00 0.00 O ATOM 1136 OD2 ASP A 77 -9.161 -17.404 -23.163 1.00 0.00 O ATOM 0 H ASP A 77 -8.212 -19.471 -20.429 1.00 0.00 H new ATOM 0 HA ASP A 77 -5.863 -18.912 -21.219 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.850 -16.631 -21.038 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -6.708 -16.952 -22.328 1.00 0.00 H new ATOM 1141 N HIS A 78 -4.483 -17.664 -19.480 1.00 0.00 N ATOM 1142 CA HIS A 78 -3.709 -16.971 -18.463 1.00 0.00 C ATOM 1143 C HIS A 78 -3.005 -15.845 -19.163 1.00 0.00 C ATOM 1144 O HIS A 78 -1.791 -15.892 -19.327 1.00 0.00 O ATOM 1145 CB HIS A 78 -2.789 -17.923 -17.701 1.00 0.00 C ATOM 1146 CG HIS A 78 -2.011 -18.867 -18.578 1.00 0.00 C ATOM 1147 ND1 HIS A 78 -0.671 -18.743 -18.863 1.00 0.00 N ATOM 1148 CD2 HIS A 78 -2.496 -19.974 -19.235 1.00 0.00 C ATOM 1149 CE1 HIS A 78 -0.330 -19.784 -19.652 1.00 0.00 C ATOM 1150 NE2 HIS A 78 -1.417 -20.543 -19.900 1.00 0.00 N ATOM 0 H HIS A 78 -3.975 -18.430 -19.923 1.00 0.00 H new ATOM 0 HA HIS A 78 -4.343 -16.559 -17.678 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.088 -17.335 -17.108 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -3.388 -18.506 -17.001 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -3.515 -20.331 -19.234 1.00 0.00 H new ATOM 0 HE1 HIS A 78 0.663 -19.980 -20.028 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -1.442 -21.386 -20.474 1.00 0.00 H new ATOM 1159 N TYR A 79 -3.760 -14.940 -19.758 1.00 0.00 N ATOM 1160 CA TYR A 79 -3.257 -13.814 -20.501 1.00 0.00 C ATOM 1161 C TYR A 79 -3.085 -12.592 -19.616 1.00 0.00 C ATOM 1162 O TYR A 79 -3.928 -12.287 -18.783 1.00 0.00 O ATOM 1163 CB TYR A 79 -4.220 -13.532 -21.621 1.00 0.00 C ATOM 1164 CG TYR A 79 -5.629 -13.220 -21.206 1.00 0.00 C ATOM 1165 CD1 TYR A 79 -6.039 -11.917 -20.917 1.00 0.00 C ATOM 1166 CD2 TYR A 79 -6.539 -14.251 -21.024 1.00 0.00 C ATOM 1167 CE1 TYR A 79 -7.315 -11.656 -20.433 1.00 0.00 C ATOM 1168 CE2 TYR A 79 -7.826 -14.021 -20.548 1.00 0.00 C ATOM 1169 CZ TYR A 79 -8.237 -12.708 -20.290 1.00 0.00 C ATOM 1170 OH TYR A 79 -9.491 -12.441 -19.873 1.00 0.00 O ATOM 0 H TYR A 79 -4.779 -14.976 -19.732 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.270 -14.051 -20.900 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -3.838 -12.692 -22.202 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -4.239 -14.396 -22.285 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.352 -11.098 -21.072 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -6.240 -15.262 -21.259 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -7.598 -10.648 -20.167 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -8.501 -14.847 -20.379 1.00 0.00 H new ATOM 0 HH TYR A 79 -9.556 -12.600 -18.908 1.00 0.00 H new ATOM 1180 N LEU A 80 -1.974 -11.883 -19.772 1.00 0.00 N ATOM 1181 CA LEU A 80 -1.729 -10.677 -18.986 1.00 0.00 C ATOM 1182 C LEU A 80 -2.714 -9.616 -19.386 1.00 0.00 C ATOM 1183 O LEU A 80 -2.870 -9.418 -20.564 1.00 0.00 O ATOM 1184 CB LEU A 80 -0.280 -10.216 -19.191 1.00 0.00 C ATOM 1185 CG LEU A 80 0.585 -10.587 -17.990 1.00 0.00 C ATOM 1186 CD1 LEU A 80 2.056 -10.526 -18.366 1.00 0.00 C ATOM 1187 CD2 LEU A 80 0.320 -9.639 -16.845 1.00 0.00 C ATOM 0 H LEU A 80 -1.232 -12.119 -20.431 1.00 0.00 H new ATOM 0 HA LEU A 80 -1.866 -10.882 -17.924 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.127 -10.674 -20.093 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -0.256 -9.137 -19.342 1.00 0.00 H new ATOM 0 HG LEU A 80 0.334 -11.602 -17.682 1.00 0.00 H new ATOM 0 HD11 LEU A 80 2.664 -10.793 -17.501 1.00 0.00 H new ATOM 0 HD12 LEU A 80 2.253 -11.226 -19.178 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.307 -9.516 -18.689 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.943 -9.914 -15.994 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.556 -8.621 -17.154 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.730 -9.697 -16.560 1.00 0.00 H new ATOM 1199 N LEU A 81 -3.429 -8.979 -18.483 1.00 0.00 N ATOM 1200 CA LEU A 81 -4.384 -7.920 -18.769 1.00 0.00 C ATOM 1201 C LEU A 81 -3.930 -6.676 -17.999 1.00 0.00 C ATOM 1202 O LEU A 81 -3.605 -6.756 -16.810 1.00 0.00 O ATOM 1203 CB LEU A 81 -5.793 -8.464 -18.472 1.00 0.00 C ATOM 1204 CG LEU A 81 -6.680 -7.507 -17.725 1.00 0.00 C ATOM 1205 CD1 LEU A 81 -7.004 -6.321 -18.517 1.00 0.00 C ATOM 1206 CD2 LEU A 81 -7.955 -8.195 -17.271 1.00 0.00 C ATOM 0 H LEU A 81 -3.361 -9.191 -17.488 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.428 -7.605 -19.812 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.274 -8.728 -19.414 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -5.701 -9.383 -17.893 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.122 -7.177 -16.849 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -7.646 -5.660 -17.936 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.085 -5.796 -18.779 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -7.522 -6.622 -19.427 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.581 -7.483 -16.733 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.496 -8.569 -18.140 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -7.705 -9.028 -16.613 1.00 0.00 H new ATOM 1218 N GLU A 82 -3.953 -5.533 -18.678 1.00 0.00 N ATOM 1219 CA GLU A 82 -3.733 -4.272 -18.028 1.00 0.00 C ATOM 1220 C GLU A 82 -5.006 -3.471 -17.750 1.00 0.00 C ATOM 1221 O GLU A 82 -5.996 -3.497 -18.489 1.00 0.00 O ATOM 1222 CB GLU A 82 -2.763 -3.505 -18.897 1.00 0.00 C ATOM 1223 CG GLU A 82 -3.384 -2.896 -20.115 1.00 0.00 C ATOM 1224 CD GLU A 82 -2.810 -3.446 -21.365 1.00 0.00 C ATOM 1225 OE1 GLU A 82 -1.682 -3.005 -21.664 1.00 0.00 O ATOM 1226 OE2 GLU A 82 -3.622 -3.981 -22.137 1.00 0.00 O ATOM 0 H GLU A 82 -4.124 -5.468 -19.682 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.328 -4.452 -17.032 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -2.305 -2.715 -18.302 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -1.961 -4.175 -19.207 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -4.459 -3.074 -20.101 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -3.239 -1.816 -20.094 1.00 0.00 H new ATOM 1233 N PHE A 83 -4.888 -2.457 -16.914 1.00 0.00 N ATOM 1234 CA PHE A 83 -6.023 -1.625 -16.588 1.00 0.00 C ATOM 1235 C PHE A 83 -5.653 -0.193 -16.348 1.00 0.00 C ATOM 1236 O PHE A 83 -4.748 0.050 -15.569 1.00 0.00 O ATOM 1237 CB PHE A 83 -6.701 -2.163 -15.356 1.00 0.00 C ATOM 1238 CG PHE A 83 -7.998 -1.508 -14.996 1.00 0.00 C ATOM 1239 CD1 PHE A 83 -9.091 -1.642 -15.869 1.00 0.00 C ATOM 1240 CD2 PHE A 83 -8.129 -0.786 -13.792 1.00 0.00 C ATOM 1241 CE1 PHE A 83 -10.303 -1.020 -15.595 1.00 0.00 C ATOM 1242 CE2 PHE A 83 -9.363 -0.232 -13.478 1.00 0.00 C ATOM 1243 CZ PHE A 83 -10.415 -0.331 -14.384 1.00 0.00 C ATOM 0 H PHE A 83 -4.019 -2.193 -16.451 1.00 0.00 H new ATOM 0 HA PHE A 83 -6.690 -1.651 -17.450 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -6.879 -3.229 -15.497 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.017 -2.063 -14.513 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -8.988 -2.236 -16.765 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -7.286 -0.666 -13.127 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -11.127 -1.067 -16.291 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.506 0.274 -12.534 1.00 0.00 H new ATOM 0 HZ PHE A 83 -11.355 0.143 -14.142 1.00 0.00 H new ATOM 1253 N PRO A 84 -6.327 0.782 -16.928 1.00 0.00 N ATOM 1254 CA PRO A 84 -5.991 2.188 -16.829 1.00 0.00 C ATOM 1255 C PRO A 84 -6.320 2.706 -15.490 1.00 0.00 C ATOM 1256 O PRO A 84 -7.488 2.894 -15.270 1.00 0.00 O ATOM 1257 CB PRO A 84 -6.746 2.928 -17.947 1.00 0.00 C ATOM 1258 CG PRO A 84 -7.820 1.958 -18.364 1.00 0.00 C ATOM 1259 CD PRO A 84 -7.463 0.613 -17.763 1.00 0.00 C ATOM 0 HA PRO A 84 -4.920 2.344 -16.958 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -7.172 3.865 -17.589 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.086 3.175 -18.779 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -8.797 2.290 -18.012 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -7.878 1.891 -19.450 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -8.301 0.220 -17.188 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -7.250 -0.110 -18.551 1.00 0.00 H new ATOM 1267 N THR A 85 -5.331 2.950 -14.651 1.00 0.00 N ATOM 1268 CA THR A 85 -5.494 3.443 -13.308 1.00 0.00 C ATOM 1269 C THR A 85 -5.229 4.906 -13.205 1.00 0.00 C ATOM 1270 O THR A 85 -4.187 5.318 -13.648 1.00 0.00 O ATOM 1271 CB THR A 85 -4.692 2.642 -12.298 1.00 0.00 C ATOM 1272 OG1 THR A 85 -4.554 3.324 -11.078 1.00 0.00 O ATOM 1273 CG2 THR A 85 -3.274 2.384 -12.803 1.00 0.00 C ATOM 0 H THR A 85 -4.354 2.802 -14.903 1.00 0.00 H new ATOM 0 HA THR A 85 -6.544 3.300 -13.054 1.00 0.00 H new ATOM 0 HB THR A 85 -5.242 1.711 -12.158 1.00 0.00 H new ATOM 0 HG1 THR A 85 -5.434 3.627 -10.771 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.722 1.808 -12.060 1.00 0.00 H new ATOM 0 HG22 THR A 85 -3.317 1.824 -13.737 1.00 0.00 H new ATOM 0 HG23 THR A 85 -2.770 3.335 -12.973 1.00 0.00 H new ATOM 1281 N PHE A 86 -6.162 5.724 -12.767 1.00 0.00 N ATOM 1282 CA PHE A 86 -6.007 7.150 -12.643 1.00 0.00 C ATOM 1283 C PHE A 86 -5.363 7.519 -11.317 1.00 0.00 C ATOM 1284 O PHE A 86 -5.379 6.749 -10.344 1.00 0.00 O ATOM 1285 CB PHE A 86 -7.385 7.785 -12.756 1.00 0.00 C ATOM 1286 CG PHE A 86 -8.015 7.721 -14.124 1.00 0.00 C ATOM 1287 CD1 PHE A 86 -8.374 6.487 -14.688 1.00 0.00 C ATOM 1288 CD2 PHE A 86 -8.217 8.898 -14.866 1.00 0.00 C ATOM 1289 CE1 PHE A 86 -8.968 6.389 -15.932 1.00 0.00 C ATOM 1290 CE2 PHE A 86 -8.793 8.820 -16.136 1.00 0.00 C ATOM 1291 CZ PHE A 86 -9.173 7.565 -16.654 1.00 0.00 C ATOM 0 H PHE A 86 -7.084 5.397 -12.477 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.352 7.517 -13.434 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -8.051 7.297 -12.044 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -7.310 8.831 -12.457 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -8.179 5.583 -14.131 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -7.929 9.855 -14.457 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -9.265 5.431 -16.333 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -8.947 9.717 -16.718 1.00 0.00 H new ATOM 0 HZ PHE A 86 -9.632 7.513 -17.630 1.00 0.00 H new ATOM 1301 N PRO A 87 -4.846 8.745 -11.232 1.00 0.00 N ATOM 1302 CA PRO A 87 -4.204 9.236 -10.014 1.00 0.00 C ATOM 1303 C PRO A 87 -5.209 9.648 -8.956 1.00 0.00 C ATOM 1304 O PRO A 87 -5.048 9.221 -7.811 1.00 0.00 O ATOM 1305 CB PRO A 87 -3.399 10.474 -10.432 1.00 0.00 C ATOM 1306 CG PRO A 87 -3.927 10.903 -11.790 1.00 0.00 C ATOM 1307 CD PRO A 87 -4.802 9.753 -12.286 1.00 0.00 C ATOM 0 HA PRO A 87 -3.590 8.447 -9.580 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -3.515 11.275 -9.702 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -2.335 10.243 -10.486 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -4.503 11.825 -11.711 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -3.108 11.097 -12.483 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.806 10.108 -12.518 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -4.394 9.330 -13.204 1.00 0.00 H new ATOM 1315 N ASP A 88 -6.258 10.375 -9.372 1.00 0.00 N ATOM 1316 CA ASP A 88 -7.359 10.739 -8.490 1.00 0.00 C ATOM 1317 C ASP A 88 -7.872 9.508 -7.712 1.00 0.00 C ATOM 1318 O ASP A 88 -8.353 9.632 -6.585 1.00 0.00 O ATOM 1319 CB ASP A 88 -8.525 11.342 -9.271 1.00 0.00 C ATOM 1320 CG ASP A 88 -8.633 10.760 -10.664 1.00 0.00 C ATOM 1321 OD1 ASP A 88 -8.804 9.526 -10.728 1.00 0.00 O ATOM 1322 OD2 ASP A 88 -8.753 11.561 -11.610 1.00 0.00 O ATOM 0 H ASP A 88 -6.359 10.722 -10.326 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.972 11.482 -7.792 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -9.455 11.164 -8.730 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -8.397 12.422 -9.338 1.00 0.00 H new ATOM 1327 N GLY A 89 -7.693 8.307 -8.278 1.00 0.00 N ATOM 1328 CA GLY A 89 -8.103 7.072 -7.683 1.00 0.00 C ATOM 1329 C GLY A 89 -9.596 6.926 -7.795 1.00 0.00 C ATOM 1330 O GLY A 89 -10.152 6.175 -6.997 1.00 0.00 O ATOM 0 H GLY A 89 -7.245 8.187 -9.187 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.608 6.237 -8.178 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.803 7.045 -6.636 1.00 0.00 H new ATOM 1334 N HIS A 90 -10.236 7.696 -8.687 1.00 0.00 N ATOM 1335 CA HIS A 90 -11.681 7.625 -8.854 1.00 0.00 C ATOM 1336 C HIS A 90 -12.041 6.502 -9.744 1.00 0.00 C ATOM 1337 O HIS A 90 -11.283 6.244 -10.614 1.00 0.00 O ATOM 1338 CB HIS A 90 -12.201 8.966 -9.327 1.00 0.00 C ATOM 1339 CG HIS A 90 -11.946 9.355 -10.764 1.00 0.00 C ATOM 1340 ND1 HIS A 90 -11.501 10.584 -11.186 1.00 0.00 N ATOM 1341 CD2 HIS A 90 -12.190 8.634 -11.902 1.00 0.00 C ATOM 1342 CE1 HIS A 90 -11.336 10.539 -12.528 1.00 0.00 C ATOM 1343 NE2 HIS A 90 -11.752 9.352 -12.990 1.00 0.00 N ATOM 0 H HIS A 90 -9.772 8.369 -9.297 1.00 0.00 H new ATOM 0 HA HIS A 90 -12.164 7.417 -7.899 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -13.278 8.984 -9.162 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -11.767 9.737 -8.690 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -12.652 7.659 -11.939 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -10.931 11.337 -13.133 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -11.745 9.041 -13.961 1.00 0.00 H new ATOM 1352 N ASP A 91 -13.141 5.810 -9.623 1.00 0.00 N ATOM 1353 CA ASP A 91 -13.559 4.745 -10.540 1.00 0.00 C ATOM 1354 C ASP A 91 -13.779 5.270 -11.958 1.00 0.00 C ATOM 1355 O ASP A 91 -14.366 6.332 -12.178 1.00 0.00 O ATOM 1356 CB ASP A 91 -14.900 4.203 -10.040 1.00 0.00 C ATOM 1357 CG ASP A 91 -15.584 3.302 -11.072 1.00 0.00 C ATOM 1358 OD1 ASP A 91 -14.926 2.306 -11.447 1.00 0.00 O ATOM 1359 OD2 ASP A 91 -16.754 3.585 -11.404 1.00 0.00 O ATOM 0 H ASP A 91 -13.804 5.965 -8.863 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.778 3.985 -10.566 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.742 3.642 -9.119 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -15.558 5.037 -9.796 1.00 0.00 H new ATOM 1364 N TYR A 92 -13.264 4.556 -12.929 1.00 0.00 N ATOM 1365 CA TYR A 92 -13.256 4.979 -14.307 1.00 0.00 C ATOM 1366 C TYR A 92 -14.480 4.382 -14.917 1.00 0.00 C ATOM 1367 O TYR A 92 -14.743 3.228 -14.705 1.00 0.00 O ATOM 1368 CB TYR A 92 -11.958 4.515 -14.979 1.00 0.00 C ATOM 1369 CG TYR A 92 -10.800 4.271 -14.042 1.00 0.00 C ATOM 1370 CD1 TYR A 92 -10.447 5.246 -13.100 1.00 0.00 C ATOM 1371 CD2 TYR A 92 -10.109 3.060 -14.037 1.00 0.00 C ATOM 1372 CE1 TYR A 92 -9.416 5.026 -12.175 1.00 0.00 C ATOM 1373 CE2 TYR A 92 -9.049 2.887 -13.136 1.00 0.00 C ATOM 1374 CZ TYR A 92 -8.672 3.857 -12.186 1.00 0.00 C ATOM 1375 OH TYR A 92 -7.736 3.634 -11.209 1.00 0.00 O ATOM 0 H TYR A 92 -12.830 3.645 -12.779 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.278 6.062 -14.426 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -12.161 3.595 -15.528 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -11.659 5.264 -15.712 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -10.979 6.186 -13.086 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -10.386 2.268 -14.717 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -9.197 5.784 -11.438 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -8.492 1.962 -13.172 1.00 0.00 H new ATOM 0 HH TYR A 92 -7.881 4.259 -10.468 1.00 0.00 H new ATOM 1385 N LYS A 93 -15.247 5.091 -15.721 1.00 0.00 N ATOM 1386 CA LYS A 93 -16.401 4.549 -16.437 1.00 0.00 C ATOM 1387 C LYS A 93 -15.958 3.636 -17.580 1.00 0.00 C ATOM 1388 O LYS A 93 -16.152 3.942 -18.752 1.00 0.00 O ATOM 1389 CB LYS A 93 -17.273 5.708 -16.893 1.00 0.00 C ATOM 1390 CG LYS A 93 -16.461 6.843 -17.543 1.00 0.00 C ATOM 1391 CD LYS A 93 -17.334 7.693 -18.462 1.00 0.00 C ATOM 1392 CE LYS A 93 -18.651 8.088 -17.794 1.00 0.00 C ATOM 1393 NZ LYS A 93 -19.730 7.139 -18.186 1.00 0.00 N ATOM 0 H LYS A 93 -15.088 6.082 -15.903 1.00 0.00 H new ATOM 0 HA LYS A 93 -16.997 3.917 -15.779 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -18.013 5.342 -17.605 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -17.822 6.103 -16.038 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -16.026 7.472 -16.767 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -15.633 6.421 -18.112 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -16.789 8.592 -18.750 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -17.543 7.140 -19.378 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -18.532 8.088 -16.710 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -18.925 9.102 -18.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -20.640 7.642 -18.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -19.520 6.743 -19.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -19.784 6.368 -17.490 1.00 0.00 H new ATOM 1407 N PHE A 94 -15.263 2.568 -17.264 1.00 0.00 N ATOM 1408 CA PHE A 94 -14.759 1.588 -18.169 1.00 0.00 C ATOM 1409 C PHE A 94 -15.890 0.708 -18.643 1.00 0.00 C ATOM 1410 O PHE A 94 -15.771 0.182 -19.731 1.00 0.00 O ATOM 1411 CB PHE A 94 -13.695 0.786 -17.458 1.00 0.00 C ATOM 1412 CG PHE A 94 -14.022 0.370 -16.040 1.00 0.00 C ATOM 1413 CD1 PHE A 94 -15.097 -0.484 -15.732 1.00 0.00 C ATOM 1414 CD2 PHE A 94 -13.291 0.915 -14.983 1.00 0.00 C ATOM 1415 CE1 PHE A 94 -15.424 -0.783 -14.404 1.00 0.00 C ATOM 1416 CE2 PHE A 94 -13.619 0.651 -13.644 1.00 0.00 C ATOM 1417 CZ PHE A 94 -14.679 -0.223 -13.344 1.00 0.00 C ATOM 0 H PHE A 94 -15.024 2.356 -16.295 1.00 0.00 H new ATOM 0 HA PHE A 94 -14.318 2.061 -19.046 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.492 -0.111 -18.042 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -12.775 1.371 -17.442 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -15.679 -0.916 -16.533 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -12.450 1.557 -15.201 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -16.250 -1.445 -14.190 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -13.059 1.118 -12.847 1.00 0.00 H new ATOM 0 HZ PHE A 94 -14.919 -0.462 -12.319 1.00 0.00 H new ATOM 1427 N ASP A 95 -16.976 0.598 -17.880 1.00 0.00 N ATOM 1428 CA ASP A 95 -18.116 -0.234 -18.215 1.00 0.00 C ATOM 1429 C ASP A 95 -19.050 0.587 -19.099 1.00 0.00 C ATOM 1430 O ASP A 95 -19.676 0.044 -19.998 1.00 0.00 O ATOM 1431 CB ASP A 95 -18.843 -0.646 -16.931 1.00 0.00 C ATOM 1432 CG ASP A 95 -20.301 -1.054 -17.185 1.00 0.00 C ATOM 1433 OD1 ASP A 95 -21.145 -0.124 -17.255 1.00 0.00 O ATOM 1434 OD2 ASP A 95 -20.524 -2.271 -17.356 1.00 0.00 O ATOM 0 H ASP A 95 -17.084 1.096 -16.997 1.00 0.00 H new ATOM 0 HA ASP A 95 -17.795 -1.135 -18.738 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -18.312 -1.478 -16.468 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -18.819 0.182 -16.222 1.00 0.00 H new ATOM 1439 N SER A 96 -19.088 1.912 -18.894 1.00 0.00 N ATOM 1440 CA SER A 96 -19.973 2.785 -19.637 1.00 0.00 C ATOM 1441 C SER A 96 -19.307 3.095 -20.965 1.00 0.00 C ATOM 1442 O SER A 96 -18.345 3.858 -21.028 1.00 0.00 O ATOM 1443 CB SER A 96 -20.258 4.047 -18.845 1.00 0.00 C ATOM 1444 OG SER A 96 -21.484 4.636 -19.185 1.00 0.00 O ATOM 0 H SER A 96 -18.505 2.394 -18.210 1.00 0.00 H new ATOM 0 HA SER A 96 -20.934 2.302 -19.815 1.00 0.00 H new ATOM 0 HB2 SER A 96 -20.256 3.811 -17.781 1.00 0.00 H new ATOM 0 HB3 SER A 96 -19.456 4.765 -19.014 1.00 0.00 H new ATOM 0 HG SER A 96 -21.620 5.443 -18.646 1.00 0.00 H new ATOM 1450 N LYS A 97 -19.789 2.472 -22.044 1.00 0.00 N ATOM 1451 CA LYS A 97 -19.243 2.700 -23.378 1.00 0.00 C ATOM 1452 C LYS A 97 -19.368 4.185 -23.688 1.00 0.00 C ATOM 1453 O LYS A 97 -18.433 4.767 -24.228 1.00 0.00 O ATOM 1454 CB LYS A 97 -19.928 1.754 -24.381 1.00 0.00 C ATOM 1455 CG LYS A 97 -21.225 2.331 -24.960 1.00 0.00 C ATOM 1456 CD LYS A 97 -21.827 1.435 -26.015 1.00 0.00 C ATOM 1457 CE LYS A 97 -23.237 1.926 -26.354 1.00 0.00 C ATOM 1458 NZ LYS A 97 -23.977 0.842 -27.048 1.00 0.00 N ATOM 0 H LYS A 97 -20.559 1.804 -22.016 1.00 0.00 H new ATOM 0 HA LYS A 97 -18.182 2.459 -23.447 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -19.238 1.537 -25.196 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -20.147 0.807 -23.888 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -21.946 2.478 -24.156 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -21.024 3.312 -25.391 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -21.204 1.438 -26.909 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -21.864 0.406 -25.656 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -23.762 2.217 -25.444 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -23.184 2.811 -26.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -24.936 1.170 -27.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -23.477 0.585 -27.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -24.037 0.010 -26.427 1.00 0.00 H new ATOM 1472 N LYS A 98 -20.581 4.735 -23.497 1.00 0.00 N ATOM 1473 CA LYS A 98 -20.936 6.083 -23.852 1.00 0.00 C ATOM 1474 C LYS A 98 -21.766 6.695 -22.724 1.00 0.00 C ATOM 1475 O LYS A 98 -22.786 6.107 -22.382 1.00 0.00 O ATOM 1476 CB LYS A 98 -21.537 6.212 -25.246 1.00 0.00 C ATOM 1477 CG LYS A 98 -20.453 6.613 -26.272 1.00 0.00 C ATOM 1478 CD LYS A 98 -20.695 5.919 -27.619 1.00 0.00 C ATOM 1479 CE LYS A 98 -19.379 5.771 -28.393 1.00 0.00 C ATOM 1480 NZ LYS A 98 -18.742 4.459 -28.088 1.00 0.00 N ATOM 0 H LYS A 98 -21.353 4.219 -23.076 1.00 0.00 H new ATOM 0 HA LYS A 98 -20.027 6.678 -23.944 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -21.992 5.266 -25.541 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -22.331 6.959 -25.238 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -20.458 7.694 -26.409 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -19.468 6.344 -25.891 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -21.139 4.937 -27.454 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -21.407 6.496 -28.209 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -19.568 5.850 -29.463 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -18.701 6.582 -28.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -17.852 4.373 -28.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -18.544 4.398 -27.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -19.385 3.689 -28.363 1.00 0.00 H new ATOM 1494 N PRO A 99 -21.334 7.845 -22.200 1.00 0.00 N ATOM 1495 CA PRO A 99 -20.081 8.482 -22.628 1.00 0.00 C ATOM 1496 C PRO A 99 -18.850 7.724 -22.096 1.00 0.00 C ATOM 1497 O PRO A 99 -18.992 6.715 -21.405 1.00 0.00 O ATOM 1498 CB PRO A 99 -20.117 9.929 -22.149 1.00 0.00 C ATOM 1499 CG PRO A 99 -21.163 9.918 -21.041 1.00 0.00 C ATOM 1500 CD PRO A 99 -21.951 8.598 -21.134 1.00 0.00 C ATOM 0 HA PRO A 99 -19.993 8.455 -23.714 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -19.144 10.252 -21.778 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -20.394 10.610 -22.954 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -20.684 10.007 -20.066 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -21.835 10.770 -21.145 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -21.908 8.050 -20.193 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -23.004 8.785 -21.346 1.00 0.00 H new ATOM 1508 N LYS A 100 -17.662 8.157 -22.510 1.00 0.00 N ATOM 1509 CA LYS A 100 -16.409 7.557 -22.082 1.00 0.00 C ATOM 1510 C LYS A 100 -15.407 8.651 -21.782 1.00 0.00 C ATOM 1511 O LYS A 100 -15.064 9.406 -22.677 1.00 0.00 O ATOM 1512 CB LYS A 100 -15.969 6.539 -23.134 1.00 0.00 C ATOM 1513 CG LYS A 100 -14.451 6.456 -23.191 1.00 0.00 C ATOM 1514 CD LYS A 100 -13.975 5.188 -23.874 1.00 0.00 C ATOM 1515 CE LYS A 100 -12.443 5.043 -23.793 1.00 0.00 C ATOM 1516 NZ LYS A 100 -11.916 5.475 -22.461 1.00 0.00 N ATOM 0 H LYS A 100 -17.545 8.938 -23.155 1.00 0.00 H new ATOM 0 HA LYS A 100 -16.513 7.000 -21.151 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -16.384 5.559 -22.897 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -16.361 6.824 -24.111 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -14.061 7.323 -23.724 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -14.048 6.496 -22.179 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -14.448 4.323 -23.409 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -14.286 5.198 -24.919 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -12.166 4.005 -23.975 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -11.979 5.639 -24.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -10.884 5.347 -22.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -12.144 6.478 -22.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -12.353 4.901 -21.712 1.00 0.00 H new ATOM 1530 N GLU A 101 -14.976 8.721 -20.533 1.00 0.00 N ATOM 1531 CA GLU A 101 -13.963 9.689 -20.144 1.00 0.00 C ATOM 1532 C GLU A 101 -12.581 9.273 -20.700 1.00 0.00 C ATOM 1533 O GLU A 101 -12.322 8.076 -20.963 1.00 0.00 O ATOM 1534 CB GLU A 101 -13.958 9.841 -18.612 1.00 0.00 C ATOM 1535 CG GLU A 101 -12.884 10.843 -18.144 1.00 0.00 C ATOM 1536 CD GLU A 101 -13.104 12.254 -18.719 1.00 0.00 C ATOM 1537 OE1 GLU A 101 -14.075 12.885 -18.276 1.00 0.00 O ATOM 1538 OE2 GLU A 101 -12.443 12.620 -19.716 1.00 0.00 O ATOM 0 H GLU A 101 -15.309 8.124 -19.776 1.00 0.00 H new ATOM 0 HA GLU A 101 -14.196 10.663 -20.573 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -14.939 10.176 -18.276 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.777 8.870 -18.150 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -12.888 10.893 -17.055 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.900 10.482 -18.443 1.00 0.00 H new ATOM 1545 N ASN A 102 -11.703 10.254 -20.894 1.00 0.00 N ATOM 1546 CA ASN A 102 -10.325 10.070 -21.260 1.00 0.00 C ATOM 1547 C ASN A 102 -9.640 9.042 -20.394 1.00 0.00 C ATOM 1548 O ASN A 102 -9.749 9.137 -19.175 1.00 0.00 O ATOM 1549 CB ASN A 102 -9.548 11.373 -21.214 1.00 0.00 C ATOM 1550 CG ASN A 102 -8.612 11.455 -22.391 1.00 0.00 C ATOM 1551 OD1 ASN A 102 -7.455 11.099 -22.352 1.00 0.00 O ATOM 1552 ND2 ASN A 102 -9.138 11.810 -23.539 1.00 0.00 N ATOM 0 H ASN A 102 -11.956 11.237 -20.793 1.00 0.00 H new ATOM 0 HA ASN A 102 -10.334 9.705 -22.287 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -10.237 12.218 -21.227 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -8.983 11.437 -20.284 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -8.574 11.785 -24.388 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -10.112 12.111 -23.582 1.00 0.00 H new ATOM 1559 N PRO A 103 -9.051 8.018 -21.000 1.00 0.00 N ATOM 1560 CA PRO A 103 -8.318 6.992 -20.275 1.00 0.00 C ATOM 1561 C PRO A 103 -6.996 7.526 -19.692 1.00 0.00 C ATOM 1562 O PRO A 103 -6.786 8.720 -19.533 1.00 0.00 O ATOM 1563 CB PRO A 103 -8.113 5.845 -21.287 1.00 0.00 C ATOM 1564 CG PRO A 103 -8.290 6.478 -22.664 1.00 0.00 C ATOM 1565 CD PRO A 103 -8.931 7.844 -22.434 1.00 0.00 C ATOM 0 HA PRO A 103 -8.867 6.644 -19.400 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -7.122 5.403 -21.183 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -8.837 5.046 -21.126 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -7.330 6.580 -23.170 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -8.921 5.856 -23.299 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -8.320 8.635 -22.869 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -9.909 7.897 -22.912 1.00 0.00 H new ATOM 1573 N GLY A 104 -6.125 6.603 -19.290 1.00 0.00 N ATOM 1574 CA GLY A 104 -4.822 6.946 -18.776 1.00 0.00 C ATOM 1575 C GLY A 104 -3.720 6.081 -19.359 1.00 0.00 C ATOM 1576 O GLY A 104 -3.990 4.976 -19.862 1.00 0.00 O ATOM 0 H GLY A 104 -6.312 5.601 -19.316 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -4.612 7.993 -18.996 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -4.825 6.843 -17.691 1.00 0.00 H new ATOM 1580 N PRO A 105 -2.485 6.577 -19.304 1.00 0.00 N ATOM 1581 CA PRO A 105 -1.327 5.863 -19.820 1.00 0.00 C ATOM 1582 C PRO A 105 -0.929 4.748 -18.861 1.00 0.00 C ATOM 1583 O PRO A 105 -0.871 3.611 -19.314 1.00 0.00 O ATOM 1584 CB PRO A 105 -0.208 6.917 -19.973 1.00 0.00 C ATOM 1585 CG PRO A 105 -0.634 8.106 -19.108 1.00 0.00 C ATOM 1586 CD PRO A 105 -2.109 7.878 -18.760 1.00 0.00 C ATOM 0 HA PRO A 105 -1.532 5.385 -20.778 1.00 0.00 H new ATOM 0 HB2 PRO A 105 0.752 6.519 -19.645 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -0.090 7.214 -21.015 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.026 8.167 -18.205 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.502 9.045 -19.646 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -2.258 7.901 -17.680 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -2.731 8.667 -19.184 1.00 0.00 H new ATOM 1594 N ALA A 106 -0.558 5.092 -17.630 1.00 0.00 N ATOM 1595 CA ALA A 106 -0.207 4.112 -16.646 1.00 0.00 C ATOM 1596 C ALA A 106 -1.336 3.150 -16.382 1.00 0.00 C ATOM 1597 O ALA A 106 -2.487 3.579 -16.238 1.00 0.00 O ATOM 1598 CB ALA A 106 0.207 4.806 -15.397 1.00 0.00 C ATOM 0 H ALA A 106 -0.497 6.056 -17.303 1.00 0.00 H new ATOM 0 HA ALA A 106 0.624 3.518 -17.026 1.00 0.00 H new ATOM 0 HB1 ALA A 106 0.476 4.067 -14.642 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.067 5.444 -15.603 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -0.618 5.416 -15.029 1.00 0.00 H new ATOM 1604 N ARG A 107 -1.000 1.861 -16.359 1.00 0.00 N ATOM 1605 CA ARG A 107 -1.971 0.805 -16.150 1.00 0.00 C ATOM 1606 C ARG A 107 -1.425 -0.290 -15.289 1.00 0.00 C ATOM 1607 O ARG A 107 -0.248 -0.599 -15.419 1.00 0.00 O ATOM 1608 CB ARG A 107 -2.409 0.225 -17.492 1.00 0.00 C ATOM 1609 CG ARG A 107 -3.005 1.273 -18.415 1.00 0.00 C ATOM 1610 CD ARG A 107 -4.134 0.763 -19.280 1.00 0.00 C ATOM 1611 NE ARG A 107 -3.951 1.097 -20.686 1.00 0.00 N ATOM 1612 CZ ARG A 107 -2.914 0.744 -21.405 1.00 0.00 C ATOM 1613 NH1 ARG A 107 -1.925 0.082 -20.899 1.00 0.00 N ATOM 1614 NH2 ARG A 107 -2.847 1.075 -22.659 1.00 0.00 N ATOM 0 H ARG A 107 -0.045 1.526 -16.485 1.00 0.00 H new ATOM 0 HA ARG A 107 -2.827 1.244 -15.637 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -1.552 -0.238 -17.980 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.143 -0.563 -17.321 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.370 2.106 -17.814 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -2.217 1.665 -19.058 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -4.209 -0.319 -19.173 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.076 1.184 -18.929 1.00 0.00 H new ATOM 0 HE ARG A 107 -4.681 1.644 -21.143 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -1.938 -0.180 -19.913 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -1.132 -0.178 -21.486 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -3.603 1.611 -23.086 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -2.039 0.799 -23.217 1.00 0.00 H new ATOM 1628 N VAL A 108 -2.262 -0.921 -14.489 1.00 0.00 N ATOM 1629 CA VAL A 108 -1.850 -2.017 -13.626 1.00 0.00 C ATOM 1630 C VAL A 108 -1.769 -3.313 -14.417 1.00 0.00 C ATOM 1631 O VAL A 108 -2.694 -3.687 -15.125 1.00 0.00 O ATOM 1632 CB VAL A 108 -2.806 -2.116 -12.452 1.00 0.00 C ATOM 1633 CG1 VAL A 108 -4.246 -2.289 -12.873 1.00 0.00 C ATOM 1634 CG2 VAL A 108 -2.399 -3.220 -11.499 1.00 0.00 C ATOM 0 H VAL A 108 -3.253 -0.689 -14.417 1.00 0.00 H new ATOM 0 HA VAL A 108 -0.852 -1.827 -13.232 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.739 -1.160 -11.932 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -4.879 -2.353 -11.988 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -4.553 -1.436 -13.477 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -4.347 -3.203 -13.458 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.105 -3.263 -10.670 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.399 -4.174 -12.026 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.399 -3.018 -11.114 1.00 0.00 H new ATOM 1644 N ILE A 109 -0.640 -3.980 -14.364 1.00 0.00 N ATOM 1645 CA ILE A 109 -0.429 -5.239 -15.050 1.00 0.00 C ATOM 1646 C ILE A 109 -0.574 -6.380 -14.098 1.00 0.00 C ATOM 1647 O ILE A 109 -0.167 -6.247 -12.945 1.00 0.00 O ATOM 1648 CB ILE A 109 0.932 -5.211 -15.729 1.00 0.00 C ATOM 1649 CG1 ILE A 109 1.036 -4.019 -16.654 1.00 0.00 C ATOM 1650 CG2 ILE A 109 1.183 -6.497 -16.503 1.00 0.00 C ATOM 1651 CD1 ILE A 109 -0.150 -3.874 -17.557 1.00 0.00 C ATOM 0 H ILE A 109 0.172 -3.661 -13.836 1.00 0.00 H new ATOM 0 HA ILE A 109 -1.186 -5.382 -15.821 1.00 0.00 H new ATOM 0 HB ILE A 109 1.693 -5.124 -14.953 1.00 0.00 H new ATOM 0 HG12 ILE A 109 1.145 -3.113 -16.059 1.00 0.00 H new ATOM 0 HG13 ILE A 109 1.937 -4.113 -17.260 1.00 0.00 H new ATOM 0 HG21 ILE A 109 2.163 -6.450 -16.978 1.00 0.00 H new ATOM 0 HG22 ILE A 109 1.152 -7.345 -15.819 1.00 0.00 H new ATOM 0 HG23 ILE A 109 0.415 -6.618 -17.267 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -0.016 -3.001 -18.196 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -0.247 -4.766 -18.176 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -1.051 -3.749 -16.957 1.00 0.00 H new ATOM 1663 N TYR A 110 -1.065 -7.509 -14.580 1.00 0.00 N ATOM 1664 CA TYR A 110 -1.308 -8.677 -13.772 1.00 0.00 C ATOM 1665 C TYR A 110 -1.798 -9.826 -14.645 1.00 0.00 C ATOM 1666 O TYR A 110 -2.424 -9.683 -15.701 1.00 0.00 O ATOM 1667 CB TYR A 110 -2.387 -8.330 -12.751 1.00 0.00 C ATOM 1668 CG TYR A 110 -3.704 -7.938 -13.376 1.00 0.00 C ATOM 1669 CD1 TYR A 110 -4.509 -8.912 -13.997 1.00 0.00 C ATOM 1670 CD2 TYR A 110 -4.171 -6.611 -13.291 1.00 0.00 C ATOM 1671 CE1 TYR A 110 -5.732 -8.606 -14.554 1.00 0.00 C ATOM 1672 CE2 TYR A 110 -5.406 -6.284 -13.815 1.00 0.00 C ATOM 1673 CZ TYR A 110 -6.189 -7.281 -14.410 1.00 0.00 C ATOM 1674 OH TYR A 110 -7.460 -6.910 -14.689 1.00 0.00 O ATOM 0 H TYR A 110 -1.308 -7.635 -15.563 1.00 0.00 H new ATOM 0 HA TYR A 110 -0.387 -8.981 -13.275 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -2.545 -9.187 -12.096 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -2.033 -7.511 -12.124 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -4.157 -9.932 -14.038 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -3.565 -5.853 -12.818 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -6.315 -9.349 -15.078 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -5.765 -5.267 -13.766 1.00 0.00 H new ATOM 0 HH TYR A 110 -7.565 -5.950 -14.520 1.00 0.00 H new ATOM 1684 N THR A 111 -1.449 -11.024 -14.242 1.00 0.00 N ATOM 1685 CA THR A 111 -1.800 -12.223 -15.003 1.00 0.00 C ATOM 1686 C THR A 111 -3.214 -12.611 -14.677 1.00 0.00 C ATOM 1687 O THR A 111 -3.778 -12.069 -13.742 1.00 0.00 O ATOM 1688 CB THR A 111 -0.824 -13.337 -14.670 1.00 0.00 C ATOM 1689 OG1 THR A 111 -1.155 -13.927 -13.455 1.00 0.00 O ATOM 1690 CG2 THR A 111 0.555 -12.778 -14.428 1.00 0.00 C ATOM 0 H THR A 111 -0.920 -11.206 -13.389 1.00 0.00 H new ATOM 0 HA THR A 111 -1.735 -12.030 -16.074 1.00 0.00 H new ATOM 0 HB THR A 111 -0.859 -14.035 -15.506 1.00 0.00 H new ATOM 0 HG1 THR A 111 -0.746 -14.816 -13.401 1.00 0.00 H new ATOM 0 HG21 THR A 111 1.241 -13.591 -14.191 1.00 0.00 H new ATOM 0 HG22 THR A 111 0.901 -12.262 -15.324 1.00 0.00 H new ATOM 0 HG23 THR A 111 0.522 -12.076 -13.594 1.00 0.00 H new ATOM 1698 N TYR A 112 -3.809 -13.507 -15.426 1.00 0.00 N ATOM 1699 CA TYR A 112 -5.151 -13.961 -15.216 1.00 0.00 C ATOM 1700 C TYR A 112 -5.148 -15.455 -14.866 1.00 0.00 C ATOM 1701 O TYR A 112 -4.361 -16.192 -15.460 1.00 0.00 O ATOM 1702 CB TYR A 112 -6.013 -13.557 -16.424 1.00 0.00 C ATOM 1703 CG TYR A 112 -7.279 -14.360 -16.636 1.00 0.00 C ATOM 1704 CD1 TYR A 112 -7.229 -15.748 -16.842 1.00 0.00 C ATOM 1705 CD2 TYR A 112 -8.540 -13.768 -16.526 1.00 0.00 C ATOM 1706 CE1 TYR A 112 -8.350 -16.530 -17.045 1.00 0.00 C ATOM 1707 CE2 TYR A 112 -9.693 -14.535 -16.687 1.00 0.00 C ATOM 1708 CZ TYR A 112 -9.608 -15.917 -16.981 1.00 0.00 C ATOM 1709 OH TYR A 112 -10.717 -16.660 -17.158 1.00 0.00 O ATOM 0 H TYR A 112 -3.353 -13.951 -16.223 1.00 0.00 H new ATOM 0 HA TYR A 112 -5.614 -13.479 -14.355 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -6.286 -12.507 -16.315 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -5.402 -13.635 -17.323 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -6.263 -16.230 -16.842 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -8.622 -12.712 -16.315 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -8.259 -17.587 -17.248 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -10.662 -14.069 -16.586 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.500 -16.157 -16.852 1.00 0.00 H new ATOM 1719 N PRO A 113 -6.154 -15.925 -14.116 1.00 0.00 N ATOM 1720 CA PRO A 113 -7.125 -15.035 -13.468 1.00 0.00 C ATOM 1721 C PRO A 113 -6.461 -14.330 -12.302 1.00 0.00 C ATOM 1722 O PRO A 113 -6.566 -13.114 -12.244 1.00 0.00 O ATOM 1723 CB PRO A 113 -8.301 -15.884 -12.998 1.00 0.00 C ATOM 1724 CG PRO A 113 -7.769 -17.317 -13.025 1.00 0.00 C ATOM 1725 CD PRO A 113 -6.455 -17.314 -13.832 1.00 0.00 C ATOM 0 HA PRO A 113 -7.483 -14.274 -14.161 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -8.622 -15.598 -11.996 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -9.163 -15.768 -13.655 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -7.595 -17.679 -12.012 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -8.497 -17.987 -13.482 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -5.649 -17.778 -13.264 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -6.564 -17.884 -14.754 1.00 0.00 H new ATOM 1733 N ASN A 114 -5.691 -15.043 -11.489 1.00 0.00 N ATOM 1734 CA ASN A 114 -5.013 -14.502 -10.339 1.00 0.00 C ATOM 1735 C ASN A 114 -4.328 -13.231 -10.708 1.00 0.00 C ATOM 1736 O ASN A 114 -3.337 -13.393 -11.407 1.00 0.00 O ATOM 1737 CB ASN A 114 -3.950 -15.488 -9.869 1.00 0.00 C ATOM 1738 CG ASN A 114 -4.523 -16.774 -9.358 1.00 0.00 C ATOM 1739 OD1 ASN A 114 -5.718 -16.998 -9.359 1.00 0.00 O ATOM 1740 ND2 ASN A 114 -3.680 -17.628 -8.855 1.00 0.00 N ATOM 0 H ASN A 114 -5.523 -16.040 -11.624 1.00 0.00 H new ATOM 0 HA ASN A 114 -5.745 -14.321 -9.552 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -3.272 -15.703 -10.695 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -3.356 -15.024 -9.082 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -4.018 -18.502 -8.453 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -2.681 -17.423 -8.863 1.00 0.00 H new ATOM 1747 N LYS A 115 -4.840 -12.067 -10.273 1.00 0.00 N ATOM 1748 CA LYS A 115 -4.324 -10.759 -10.631 1.00 0.00 C ATOM 1749 C LYS A 115 -2.976 -10.626 -9.984 1.00 0.00 C ATOM 1750 O LYS A 115 -2.892 -9.945 -8.971 1.00 0.00 O ATOM 1751 CB LYS A 115 -5.319 -9.670 -10.198 1.00 0.00 C ATOM 1752 CG LYS A 115 -6.001 -9.054 -11.401 1.00 0.00 C ATOM 1753 CD LYS A 115 -7.450 -8.688 -11.166 1.00 0.00 C ATOM 1754 CE LYS A 115 -8.228 -9.953 -10.785 1.00 0.00 C ATOM 1755 NZ LYS A 115 -8.659 -9.908 -9.376 1.00 0.00 N ATOM 0 H LYS A 115 -5.644 -12.022 -9.647 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.206 -10.642 -11.708 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.067 -10.099 -9.531 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.796 -8.897 -9.635 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.454 -8.159 -11.697 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.944 -9.753 -12.236 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.527 -7.945 -10.372 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -7.876 -8.240 -12.064 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -9.099 -10.056 -11.432 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.603 -10.831 -10.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.724 -10.876 -9.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -7.967 -9.367 -8.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -9.590 -9.449 -9.312 1.00 0.00 H new ATOM 1769 N VAL A 116 -1.964 -11.333 -10.479 1.00 0.00 N ATOM 1770 CA VAL A 116 -0.612 -11.374 -9.947 1.00 0.00 C ATOM 1771 C VAL A 116 -0.002 -10.047 -10.335 1.00 0.00 C ATOM 1772 O VAL A 116 0.792 -10.005 -11.267 1.00 0.00 O ATOM 1773 CB VAL A 116 0.148 -12.593 -10.501 1.00 0.00 C ATOM 1774 CG1 VAL A 116 1.663 -12.423 -10.337 1.00 0.00 C ATOM 1775 CG2 VAL A 116 -0.310 -13.881 -9.818 1.00 0.00 C ATOM 0 H VAL A 116 -2.074 -11.922 -11.305 1.00 0.00 H new ATOM 0 HA VAL A 116 -0.576 -11.500 -8.865 1.00 0.00 H new ATOM 0 HB VAL A 116 -0.079 -12.663 -11.565 1.00 0.00 H new ATOM 0 HG11 VAL A 116 2.173 -13.299 -10.737 1.00 0.00 H new ATOM 0 HG12 VAL A 116 1.990 -11.535 -10.877 1.00 0.00 H new ATOM 0 HG13 VAL A 116 1.905 -12.314 -9.280 1.00 0.00 H new ATOM 0 HG21 VAL A 116 0.243 -14.726 -10.228 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -0.123 -13.811 -8.746 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -1.376 -14.026 -9.992 1.00 0.00 H new ATOM 1785 N PHE A 117 -0.457 -8.965 -9.722 1.00 0.00 N ATOM 1786 CA PHE A 117 0.006 -7.612 -9.929 1.00 0.00 C ATOM 1787 C PHE A 117 1.510 -7.586 -10.153 1.00 0.00 C ATOM 1788 O PHE A 117 2.257 -7.893 -9.226 1.00 0.00 O ATOM 1789 CB PHE A 117 -0.385 -6.809 -8.706 1.00 0.00 C ATOM 1790 CG PHE A 117 0.311 -5.468 -8.664 1.00 0.00 C ATOM 1791 CD1 PHE A 117 -0.142 -4.428 -9.484 1.00 0.00 C ATOM 1792 CD2 PHE A 117 1.436 -5.276 -7.840 1.00 0.00 C ATOM 1793 CE1 PHE A 117 0.510 -3.199 -9.501 1.00 0.00 C ATOM 1794 CE2 PHE A 117 2.078 -4.047 -7.818 1.00 0.00 C ATOM 1795 CZ PHE A 117 1.638 -3.035 -8.682 1.00 0.00 C ATOM 0 H PHE A 117 -1.202 -9.017 -9.028 1.00 0.00 H new ATOM 0 HA PHE A 117 -0.449 -7.180 -10.820 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -1.464 -6.658 -8.701 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.138 -7.374 -7.807 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -1.008 -4.581 -10.111 1.00 0.00 H new ATOM 0 HD2 PHE A 117 1.799 -6.086 -7.225 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.158 -2.393 -10.127 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.905 -3.872 -7.145 1.00 0.00 H new ATOM 0 HZ PHE A 117 2.182 -2.103 -8.719 1.00 0.00 H new ATOM 1805 N CYS A 118 1.925 -7.472 -11.414 1.00 0.00 N ATOM 1806 CA CYS A 118 3.335 -7.477 -11.726 1.00 0.00 C ATOM 1807 C CYS A 118 3.869 -6.070 -11.474 1.00 0.00 C ATOM 1808 O CYS A 118 4.974 -5.908 -10.967 1.00 0.00 O ATOM 1809 CB CYS A 118 3.509 -7.897 -13.179 1.00 0.00 C ATOM 1810 SG CYS A 118 4.718 -9.100 -13.495 1.00 0.00 S ATOM 0 H CYS A 118 1.307 -7.377 -12.220 1.00 0.00 H new ATOM 0 HA CYS A 118 3.890 -8.181 -11.105 1.00 0.00 H new ATOM 0 HB2 CYS A 118 2.552 -8.270 -13.544 1.00 0.00 H new ATOM 0 HB3 CYS A 118 3.749 -7.010 -13.765 1.00 0.00 H new ATOM 1815 N GLY A 119 3.081 -5.053 -11.836 1.00 0.00 N ATOM 1816 CA GLY A 119 3.469 -3.677 -11.658 1.00 0.00 C ATOM 1817 C GLY A 119 2.662 -2.793 -12.564 1.00 0.00 C ATOM 1818 O GLY A 119 1.484 -3.039 -12.792 1.00 0.00 O ATOM 0 H GLY A 119 2.161 -5.175 -12.259 1.00 0.00 H new ATOM 0 HA2 GLY A 119 3.320 -3.380 -10.620 1.00 0.00 H new ATOM 0 HA3 GLY A 119 4.531 -3.560 -11.874 1.00 0.00 H new ATOM 1822 N ILE A 120 3.269 -1.717 -13.035 1.00 0.00 N ATOM 1823 CA ILE A 120 2.538 -0.708 -13.799 1.00 0.00 C ATOM 1824 C ILE A 120 3.306 -0.458 -15.041 1.00 0.00 C ATOM 1825 O ILE A 120 4.507 -0.588 -14.991 1.00 0.00 O ATOM 1826 CB ILE A 120 2.260 0.577 -13.018 1.00 0.00 C ATOM 1827 CG1 ILE A 120 1.782 0.279 -11.593 1.00 0.00 C ATOM 1828 CG2 ILE A 120 1.252 1.478 -13.747 1.00 0.00 C ATOM 1829 CD1 ILE A 120 0.334 0.505 -11.310 1.00 0.00 C ATOM 0 H ILE A 120 4.261 -1.516 -12.905 1.00 0.00 H new ATOM 0 HA ILE A 120 1.543 -1.087 -14.031 1.00 0.00 H new ATOM 0 HB ILE A 120 3.205 1.116 -12.951 1.00 0.00 H new ATOM 0 HG12 ILE A 120 2.014 -0.762 -11.367 1.00 0.00 H new ATOM 0 HG13 ILE A 120 2.363 0.892 -10.904 1.00 0.00 H new ATOM 0 HG21 ILE A 120 1.081 2.381 -13.161 1.00 0.00 H new ATOM 0 HG22 ILE A 120 1.648 1.750 -14.725 1.00 0.00 H new ATOM 0 HG23 ILE A 120 0.311 0.943 -13.873 1.00 0.00 H new ATOM 0 HD11 ILE A 120 0.124 0.258 -10.269 1.00 0.00 H new ATOM 0 HD12 ILE A 120 0.087 1.551 -11.492 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -0.267 -0.129 -11.962 1.00 0.00 H new ATOM 1841 N ILE A 121 2.686 -0.117 -16.145 1.00 0.00 N ATOM 1842 CA ILE A 121 3.366 0.106 -17.406 1.00 0.00 C ATOM 1843 C ILE A 121 2.766 1.319 -18.057 1.00 0.00 C ATOM 1844 O ILE A 121 1.602 1.624 -17.799 1.00 0.00 O ATOM 1845 CB ILE A 121 3.289 -1.135 -18.295 1.00 0.00 C ATOM 1846 CG1 ILE A 121 1.921 -1.256 -18.948 1.00 0.00 C ATOM 1847 CG2 ILE A 121 3.689 -2.373 -17.506 1.00 0.00 C ATOM 1848 CD1 ILE A 121 1.846 -2.491 -19.787 1.00 0.00 C ATOM 0 H ILE A 121 1.676 0.017 -16.197 1.00 0.00 H new ATOM 0 HA ILE A 121 4.427 0.288 -17.238 1.00 0.00 H new ATOM 0 HB ILE A 121 4.003 -1.036 -19.112 1.00 0.00 H new ATOM 0 HG12 ILE A 121 1.147 -1.283 -18.181 1.00 0.00 H new ATOM 0 HG13 ILE A 121 1.728 -0.378 -19.565 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.630 -3.250 -18.151 1.00 0.00 H new ATOM 0 HG22 ILE A 121 4.710 -2.258 -17.142 1.00 0.00 H new ATOM 0 HG23 ILE A 121 3.014 -2.499 -16.659 1.00 0.00 H new ATOM 0 HD11 ILE A 121 0.860 -2.560 -20.246 1.00 0.00 H new ATOM 0 HD12 ILE A 121 2.607 -2.448 -20.567 1.00 0.00 H new ATOM 0 HD13 ILE A 121 2.017 -3.367 -19.161 1.00 0.00 H new ATOM 1860 N ALA A 122 3.506 2.003 -18.910 1.00 0.00 N ATOM 1861 CA ALA A 122 3.024 3.155 -19.656 1.00 0.00 C ATOM 1862 C ALA A 122 4.067 3.586 -20.683 1.00 0.00 C ATOM 1863 O ALA A 122 5.262 3.331 -20.553 1.00 0.00 O ATOM 1864 CB ALA A 122 2.766 4.284 -18.692 1.00 0.00 C ATOM 0 H ALA A 122 4.479 1.770 -19.109 1.00 0.00 H new ATOM 0 HA ALA A 122 2.104 2.894 -20.179 1.00 0.00 H new ATOM 0 HB1 ALA A 122 2.404 5.154 -19.239 1.00 0.00 H new ATOM 0 HB2 ALA A 122 2.016 3.976 -17.963 1.00 0.00 H new ATOM 0 HB3 ALA A 122 3.691 4.540 -18.175 1.00 0.00 H new ATOM 2011 N LYS A 132 6.651 0.240 -21.347 1.00 0.00 N ATOM 2012 CA LYS A 132 7.703 -0.145 -20.402 1.00 0.00 C ATOM 2013 C LYS A 132 7.161 -0.190 -18.992 1.00 0.00 C ATOM 2014 O LYS A 132 6.016 0.199 -18.816 1.00 0.00 O ATOM 2015 CB LYS A 132 8.869 0.817 -20.532 1.00 0.00 C ATOM 2016 CG LYS A 132 8.413 2.283 -20.578 1.00 0.00 C ATOM 2017 CD LYS A 132 9.451 3.192 -19.935 1.00 0.00 C ATOM 2018 CE LYS A 132 10.593 3.468 -20.914 1.00 0.00 C ATOM 2019 NZ LYS A 132 11.610 4.337 -20.269 1.00 0.00 N ATOM 0 HA LYS A 132 8.059 -1.148 -20.636 1.00 0.00 H new ATOM 0 HB2 LYS A 132 9.549 0.676 -19.691 1.00 0.00 H new ATOM 0 HB3 LYS A 132 9.430 0.585 -21.437 1.00 0.00 H new ATOM 0 HG2 LYS A 132 8.249 2.585 -21.612 1.00 0.00 H new ATOM 0 HG3 LYS A 132 7.460 2.389 -20.060 1.00 0.00 H new ATOM 0 HD2 LYS A 132 8.986 4.131 -19.634 1.00 0.00 H new ATOM 0 HD3 LYS A 132 9.843 2.726 -19.031 1.00 0.00 H new ATOM 0 HE2 LYS A 132 11.050 2.529 -21.228 1.00 0.00 H new ATOM 0 HE3 LYS A 132 10.206 3.950 -21.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 12.384 4.522 -20.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 11.171 5.238 -19.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 11.988 3.861 -19.425 1.00 0.00 H new ATOM 2033 N LEU A 133 7.945 -0.638 -18.027 1.00 0.00 N ATOM 2034 CA LEU A 133 7.514 -0.746 -16.643 1.00 0.00 C ATOM 2035 C LEU A 133 7.655 0.626 -15.983 1.00 0.00 C ATOM 2036 O LEU A 133 8.573 1.381 -16.307 1.00 0.00 O ATOM 2037 CB LEU A 133 8.342 -1.830 -15.952 1.00 0.00 C ATOM 2038 CG LEU A 133 7.647 -2.444 -14.735 1.00 0.00 C ATOM 2039 CD1 LEU A 133 6.410 -3.231 -15.123 1.00 0.00 C ATOM 2040 CD2 LEU A 133 8.606 -3.373 -13.993 1.00 0.00 C ATOM 0 H LEU A 133 8.907 -0.940 -18.183 1.00 0.00 H new ATOM 0 HA LEU A 133 6.468 -1.041 -16.566 1.00 0.00 H new ATOM 0 HB2 LEU A 133 8.565 -2.619 -16.670 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.296 -1.404 -15.640 1.00 0.00 H new ATOM 0 HG LEU A 133 7.344 -1.618 -14.092 1.00 0.00 H new ATOM 0 HD11 LEU A 133 5.949 -3.649 -14.228 1.00 0.00 H new ATOM 0 HD12 LEU A 133 5.701 -2.571 -15.622 1.00 0.00 H new ATOM 0 HD13 LEU A 133 6.690 -4.040 -15.798 1.00 0.00 H new ATOM 0 HD21 LEU A 133 8.100 -3.804 -13.129 1.00 0.00 H new ATOM 0 HD22 LEU A 133 8.928 -4.172 -14.661 1.00 0.00 H new ATOM 0 HD23 LEU A 133 9.476 -2.807 -13.659 1.00 0.00 H new ATOM 2052 N CYS A 134 6.686 0.991 -15.161 1.00 0.00 N ATOM 2053 CA CYS A 134 6.688 2.216 -14.406 1.00 0.00 C ATOM 2054 C CYS A 134 7.791 2.164 -13.366 1.00 0.00 C ATOM 2055 O CYS A 134 8.516 1.170 -13.254 1.00 0.00 O ATOM 2056 CB CYS A 134 5.321 2.450 -13.792 1.00 0.00 C ATOM 2057 SG CYS A 134 4.032 2.664 -14.996 1.00 0.00 S ATOM 0 H CYS A 134 5.855 0.421 -15.001 1.00 0.00 H new ATOM 0 HA CYS A 134 6.891 3.063 -15.061 1.00 0.00 H new ATOM 0 HB2 CYS A 134 5.071 1.606 -13.149 1.00 0.00 H new ATOM 0 HB3 CYS A 134 5.364 3.334 -13.156 1.00 0.00 H new ATOM 2062 N SER A 135 7.817 3.161 -12.502 1.00 0.00 N ATOM 2063 CA SER A 135 8.831 3.236 -11.456 1.00 0.00 C ATOM 2064 C SER A 135 8.340 4.196 -10.406 1.00 0.00 C ATOM 2065 O SER A 135 8.025 5.322 -10.782 1.00 0.00 O ATOM 2066 CB SER A 135 10.167 3.739 -12.010 1.00 0.00 C ATOM 2067 OG SER A 135 10.697 2.897 -13.004 1.00 0.00 O ATOM 0 H SER A 135 7.150 3.932 -12.500 1.00 0.00 H new ATOM 0 HA SER A 135 8.993 2.241 -11.041 1.00 0.00 H new ATOM 0 HB2 SER A 135 10.031 4.739 -12.422 1.00 0.00 H new ATOM 0 HB3 SER A 135 10.884 3.826 -11.194 1.00 0.00 H new ATOM 0 HG SER A 135 11.547 3.264 -13.324 1.00 0.00 H new ATOM 2073 N HIS A 136 8.074 3.671 -9.196 1.00 0.00 N ATOM 2074 CA HIS A 136 7.667 4.490 -8.051 1.00 0.00 C ATOM 2075 C HIS A 136 8.376 5.878 -8.005 1.00 0.00 C ATOM 2076 O HIS A 136 9.602 5.836 -8.359 1.00 0.00 O ATOM 2077 CB HIS A 136 7.837 3.691 -6.757 1.00 0.00 C ATOM 2078 CG HIS A 136 7.606 2.206 -6.890 1.00 0.00 C ATOM 2079 ND1 HIS A 136 8.608 1.255 -6.885 1.00 0.00 N ATOM 2080 CD2 HIS A 136 6.404 1.565 -7.064 1.00 0.00 C ATOM 2081 CE1 HIS A 136 8.022 0.039 -6.979 1.00 0.00 C ATOM 2082 NE2 HIS A 136 6.679 0.197 -7.015 1.00 0.00 N ATOM 2083 OXT HIS A 136 7.640 6.810 -7.587 1.00 0.00 O ATOM 0 H HIS A 136 8.136 2.674 -8.990 1.00 0.00 H new ATOM 0 HA HIS A 136 6.610 4.729 -8.168 1.00 0.00 H new ATOM 0 HB2 HIS A 136 8.845 3.854 -6.377 1.00 0.00 H new ATOM 0 HB3 HIS A 136 7.147 4.085 -6.011 1.00 0.00 H new ATOM 0 HD2 HIS A 136 5.439 2.027 -7.210 1.00 0.00 H new ATOM 0 HE1 HIS A 136 8.543 -0.906 -7.019 1.00 0.00 H new ATOM 0 HE2 HIS A 136 5.988 -0.553 -7.008 1.00 0.00 H new