USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1167 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 115 HIS : no HD1:sc= -15! C(o=-17!,f=-16!) USER MOD Set 1.2: A 118 MET CE :methyl 138:sc= -2.17! (180deg=-2.47!) USER MOD Set 2.1: A 71 ASN : amide:sc= -1.19! K(o=-4.3!,f=-4.9) USER MOD Set 2.2: A 74 GLN : amide:sc= -3.12! C(o=-4.3!,f=-5.6!) USER MOD Set 3.1: A 31 SER OG : rot 180:sc= -1.41! USER MOD Set 3.2: A 62 THR OG1 : rot -155:sc= -0.101 USER MOD Set 4.1: A 42 THR OG1 : rot 80:sc= -0.0155 USER MOD Set 4.2: A 55 ASN : amide:sc= -1.91! C(o=-1.9!,f=-8.5!) USER MOD Set 5.1: A 10 ASN : amide:sc= -5.24! K(o=-6!,f=-1.8) USER MOD Set 5.2: A 53 TYR OH : rot -30:sc= -0.8 USER MOD Single : A 1 THR N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 127:sc= 1.29 USER MOD Single : A 9 SER OG : rot -130:sc= 0 USER MOD Single : A 13 SER OG : rot -10:sc= 0.888 USER MOD Single : A 17 GLN : amide:sc= -9.46! C(o=-9.5!,f=-11!) USER MOD Single : A 19 ASN : amide:sc= -0.623 K(o=-0.62,f=-4!) USER MOD Single : A 23 LYS NZ :NH3+ -138:sc= -2.81! (180deg=-4.61!) USER MOD Single : A 32 HIS : no HD1:sc= -2.11! K(o=-2.1!,f=-3.9) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.635 USER MOD Single : A 37 SER OG : rot 180:sc= 0.559 USER MOD Single : A 38 SER OG : rot 120:sc= -1.6! USER MOD Single : A 40 TYR OH : rot -5:sc= -3.04! USER MOD Single : A 48 GLN : amide:sc= -4.41 K(o=-4.4,f=-17!) USER MOD Single : A 50 GLN : amide:sc= -3.1! K(o=-3.1!,f=-1.4) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.913 K(o=-0.91,f=-1.5) USER MOD Single : A 73 THR OG1 : rot -163:sc= -2.19! USER MOD Single : A 79 GLN : amide:sc= -1.14! K(o=-1.1!,f=0) USER MOD Single : A 80 GLN : amide:sc= -1.25 K(o=-1.3,f=-2.7!) USER MOD Single : A 93 THR OG1 : rot 28:sc= 0.0699 USER MOD Single : A 99 MET CE :methyl -105:sc= -2.06! (180deg=-5.07!) USER MOD Single : A 103 ASN : amide:sc= -13! C(o=-13!,f=-4.4!) USER MOD Single : A 107 ASN : amide:sc= -4.82! K(o=-4.8!,f=-2.2) USER MOD Single : A 108 THR OG1 : rot -54:sc= 0.591 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 166:sc= -1.86 (180deg=-2.31) USER MOD Single : A 120 ASN : amide:sc= -1.76! C(o=-1.8!,f=-1.7!) USER MOD Single : A 124 MET CE :methyl 171:sc= 0 (180deg=-0.0364) USER MOD Single : A 142 MET CE :methyl -161:sc= -1.36 (180deg=-2.15) USER MOD Single : A 145 GLN : amide:sc= -24.6! C(o=-25!,f=-18!) USER MOD Single : A 148 HIS : no HD1:sc= -1.95 K(o=-2,f=-0.77) USER MOD Single : A 149 THR OG1 : rot -86:sc= 0.752 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 ASN : amide:sc= -0.724 K(o=-0.72,f=-4.9!) USER MOD Single : A 157 LYS NZ :NH3+ 142:sc= 0.103 (180deg=-2.35!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 4.003 -9.634 -14.437 1.00 0.82 N ATOM 2 CA THR A 1 3.168 -10.045 -13.277 1.00 0.59 C ATOM 3 C THR A 1 2.565 -8.834 -12.576 1.00 0.52 C ATOM 4 O THR A 1 3.222 -8.195 -11.753 1.00 0.52 O ATOM 5 CB THR A 1 4.040 -10.833 -12.299 1.00 0.64 C ATOM 6 OG1 THR A 1 4.518 -12.023 -12.899 1.00 0.92 O ATOM 7 CG2 THR A 1 3.317 -11.216 -11.023 1.00 0.62 C ATOM 0 H1 THR A 1 4.401 -10.479 -14.895 1.00 0.82 H new ATOM 0 H2 THR A 1 3.416 -9.114 -15.120 1.00 0.82 H new ATOM 0 H3 THR A 1 4.777 -9.022 -14.108 1.00 0.82 H new ATOM 0 HA THR A 1 2.346 -10.666 -13.634 1.00 0.59 H new ATOM 0 HB THR A 1 4.862 -10.164 -12.042 1.00 0.64 H new ATOM 0 HG1 THR A 1 5.075 -12.512 -12.258 1.00 0.92 H new ATOM 0 HG21 THR A 1 3.994 -11.773 -10.375 1.00 0.62 H new ATOM 0 HG22 THR A 1 2.982 -10.314 -10.510 1.00 0.62 H new ATOM 0 HG23 THR A 1 2.455 -11.837 -11.266 1.00 0.62 H new ATOM 17 N VAL A 2 1.311 -8.527 -12.893 1.00 0.54 N ATOM 18 CA VAL A 2 0.640 -7.396 -12.271 1.00 0.54 C ATOM 19 C VAL A 2 0.418 -7.664 -10.785 1.00 0.44 C ATOM 20 O VAL A 2 -0.480 -8.412 -10.398 1.00 0.45 O ATOM 21 CB VAL A 2 -0.706 -7.083 -12.962 1.00 0.65 C ATOM 22 CG1 VAL A 2 -1.605 -8.310 -12.992 1.00 1.49 C ATOM 23 CG2 VAL A 2 -1.402 -5.918 -12.272 1.00 1.42 C ATOM 0 H VAL A 2 0.746 -9.040 -13.569 1.00 0.54 H new ATOM 0 HA VAL A 2 1.285 -6.525 -12.386 1.00 0.54 H new ATOM 0 HB VAL A 2 -0.499 -6.797 -13.993 1.00 0.65 H new ATOM 0 HG11 VAL A 2 -2.545 -8.060 -13.484 1.00 1.49 H new ATOM 0 HG12 VAL A 2 -1.110 -9.111 -13.541 1.00 1.49 H new ATOM 0 HG13 VAL A 2 -1.805 -8.639 -11.972 1.00 1.49 H new ATOM 0 HG21 VAL A 2 -2.348 -5.712 -12.772 1.00 1.42 H new ATOM 0 HG22 VAL A 2 -1.591 -6.173 -11.229 1.00 1.42 H new ATOM 0 HG23 VAL A 2 -0.766 -5.034 -12.320 1.00 1.42 H new ATOM 33 N ALA A 3 1.254 -7.051 -9.956 1.00 0.43 N ATOM 34 CA ALA A 3 1.166 -7.222 -8.513 1.00 0.40 C ATOM 35 C ALA A 3 0.480 -6.032 -7.859 1.00 0.33 C ATOM 36 O ALA A 3 0.659 -4.892 -8.286 1.00 0.37 O ATOM 37 CB ALA A 3 2.555 -7.420 -7.924 1.00 0.48 C ATOM 0 H ALA A 3 2.003 -6.429 -10.261 1.00 0.43 H new ATOM 0 HA ALA A 3 0.564 -8.108 -8.312 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.478 -7.547 -6.844 1.00 0.48 H new ATOM 0 HB2 ALA A 3 3.013 -8.307 -8.362 1.00 0.48 H new ATOM 0 HB3 ALA A 3 3.171 -6.548 -8.144 1.00 0.48 H new ATOM 43 N TYR A 4 -0.306 -6.298 -6.818 1.00 0.38 N ATOM 44 CA TYR A 4 -1.008 -5.230 -6.118 1.00 0.48 C ATOM 45 C TYR A 4 -0.180 -4.661 -4.978 1.00 0.46 C ATOM 46 O TYR A 4 -0.071 -5.274 -3.916 1.00 0.72 O ATOM 47 CB TYR A 4 -2.346 -5.701 -5.557 1.00 0.79 C ATOM 48 CG TYR A 4 -3.019 -4.637 -4.717 1.00 2.03 C ATOM 49 CD1 TYR A 4 -3.390 -3.419 -5.270 1.00 2.70 C ATOM 50 CD2 TYR A 4 -3.267 -4.845 -3.368 1.00 3.01 C ATOM 51 CE1 TYR A 4 -3.991 -2.439 -4.504 1.00 3.83 C ATOM 52 CE2 TYR A 4 -3.865 -3.871 -2.593 1.00 4.21 C ATOM 53 CZ TYR A 4 -4.225 -2.670 -3.165 1.00 4.50 C ATOM 54 OH TYR A 4 -4.818 -1.694 -2.398 1.00 5.73 O ATOM 0 H TYR A 4 -0.470 -7.233 -6.445 1.00 0.38 H new ATOM 0 HA TYR A 4 -1.182 -4.452 -6.861 1.00 0.48 H new ATOM 0 HB2 TYR A 4 -3.004 -5.983 -6.379 1.00 0.79 H new ATOM 0 HB3 TYR A 4 -2.190 -6.595 -4.952 1.00 0.79 H new ATOM 0 HD1 TYR A 4 -3.205 -3.234 -6.318 1.00 2.70 H new ATOM 0 HD2 TYR A 4 -2.987 -5.785 -2.916 1.00 3.01 H new ATOM 0 HE1 TYR A 4 -4.276 -1.498 -4.951 1.00 3.83 H new ATOM 0 HE2 TYR A 4 -4.050 -4.050 -1.544 1.00 4.21 H new ATOM 0 HH TYR A 4 -5.593 -2.071 -1.931 1.00 5.73 H new ATOM 64 N ILE A 5 0.377 -3.479 -5.210 1.00 0.40 N ATOM 65 CA ILE A 5 1.183 -2.775 -4.225 1.00 0.45 C ATOM 66 C ILE A 5 0.318 -1.807 -3.424 1.00 0.44 C ATOM 67 O ILE A 5 -0.531 -1.113 -3.986 1.00 0.57 O ATOM 68 CB ILE A 5 2.301 -1.971 -4.917 1.00 0.55 C ATOM 69 CG1 ILE A 5 2.735 -2.690 -6.193 1.00 0.52 C ATOM 70 CG2 ILE A 5 3.477 -1.775 -3.971 1.00 0.93 C ATOM 71 CD1 ILE A 5 3.759 -1.933 -7.001 1.00 0.79 C ATOM 0 H ILE A 5 0.280 -2.980 -6.094 1.00 0.40 H new ATOM 0 HA ILE A 5 1.621 -3.519 -3.560 1.00 0.45 H new ATOM 0 HB ILE A 5 1.923 -0.985 -5.186 1.00 0.55 H new ATOM 0 HG12 ILE A 5 3.144 -3.665 -5.928 1.00 0.52 H new ATOM 0 HG13 ILE A 5 1.857 -2.870 -6.814 1.00 0.52 H new ATOM 0 HG21 ILE A 5 4.258 -1.205 -4.475 1.00 0.93 H new ATOM 0 HG22 ILE A 5 3.145 -1.232 -3.086 1.00 0.93 H new ATOM 0 HG23 ILE A 5 3.871 -2.747 -3.674 1.00 0.93 H new ATOM 0 HD11 ILE A 5 4.017 -2.507 -7.891 1.00 0.79 H new ATOM 0 HD12 ILE A 5 3.347 -0.968 -7.298 1.00 0.79 H new ATOM 0 HD13 ILE A 5 4.654 -1.776 -6.399 1.00 0.79 H new ATOM 83 N ALA A 6 0.528 -1.763 -2.116 1.00 0.48 N ATOM 84 CA ALA A 6 -0.243 -0.877 -1.252 1.00 0.51 C ATOM 85 C ALA A 6 0.644 0.202 -0.640 1.00 0.46 C ATOM 86 O ALA A 6 1.549 -0.098 0.140 1.00 0.58 O ATOM 87 CB ALA A 6 -0.935 -1.678 -0.161 1.00 0.71 C ATOM 0 H ALA A 6 1.224 -2.328 -1.630 1.00 0.48 H new ATOM 0 HA ALA A 6 -1.001 -0.383 -1.861 1.00 0.51 H new ATOM 0 HB1 ALA A 6 -1.507 -1.005 0.477 1.00 0.71 H new ATOM 0 HB2 ALA A 6 -1.607 -2.406 -0.615 1.00 0.71 H new ATOM 0 HB3 ALA A 6 -0.188 -2.198 0.438 1.00 0.71 H new ATOM 93 N ILE A 7 0.378 1.459 -0.992 1.00 0.44 N ATOM 94 CA ILE A 7 1.160 2.573 -0.466 1.00 0.43 C ATOM 95 C ILE A 7 0.470 3.199 0.741 1.00 0.49 C ATOM 96 O ILE A 7 -0.720 3.513 0.693 1.00 0.58 O ATOM 97 CB ILE A 7 1.403 3.655 -1.540 1.00 0.47 C ATOM 98 CG1 ILE A 7 2.201 3.066 -2.707 1.00 1.19 C ATOM 99 CG2 ILE A 7 2.131 4.849 -0.936 1.00 1.41 C ATOM 100 CD1 ILE A 7 2.506 4.064 -3.804 1.00 1.42 C ATOM 0 H ILE A 7 -0.367 1.729 -1.634 1.00 0.44 H new ATOM 0 HA ILE A 7 2.125 2.169 -0.159 1.00 0.43 H new ATOM 0 HB ILE A 7 0.440 4.000 -1.918 1.00 0.47 H new ATOM 0 HG12 ILE A 7 3.139 2.661 -2.326 1.00 1.19 H new ATOM 0 HG13 ILE A 7 1.643 2.232 -3.132 1.00 1.19 H new ATOM 0 HG21 ILE A 7 2.295 5.603 -1.706 1.00 1.41 H new ATOM 0 HG22 ILE A 7 1.528 5.275 -0.134 1.00 1.41 H new ATOM 0 HG23 ILE A 7 3.092 4.525 -0.535 1.00 1.41 H new ATOM 0 HD11 ILE A 7 3.073 3.573 -4.595 1.00 1.42 H new ATOM 0 HD12 ILE A 7 1.573 4.451 -4.213 1.00 1.42 H new ATOM 0 HD13 ILE A 7 3.092 4.887 -3.395 1.00 1.42 H new ATOM 112 N GLY A 8 1.222 3.369 1.827 1.00 0.57 N ATOM 113 CA GLY A 8 0.655 3.947 3.029 1.00 0.69 C ATOM 114 C GLY A 8 1.530 5.019 3.654 1.00 0.68 C ATOM 115 O GLY A 8 2.671 4.757 4.035 1.00 0.77 O ATOM 0 H GLY A 8 2.208 3.117 1.893 1.00 0.57 H new ATOM 0 HA2 GLY A 8 -0.319 4.376 2.792 1.00 0.69 H new ATOM 0 HA3 GLY A 8 0.486 3.155 3.759 1.00 0.69 H new ATOM 119 N SER A 9 0.981 6.226 3.769 1.00 0.70 N ATOM 120 CA SER A 9 1.697 7.350 4.365 1.00 0.75 C ATOM 121 C SER A 9 0.822 8.028 5.419 1.00 0.87 C ATOM 122 O SER A 9 -0.369 7.733 5.524 1.00 0.92 O ATOM 123 CB SER A 9 2.099 8.358 3.285 1.00 0.76 C ATOM 124 OG SER A 9 2.913 7.750 2.296 1.00 1.67 O ATOM 0 H SER A 9 0.037 6.451 3.455 1.00 0.70 H new ATOM 0 HA SER A 9 2.601 6.975 4.844 1.00 0.75 H new ATOM 0 HB2 SER A 9 1.205 8.773 2.820 1.00 0.76 H new ATOM 0 HB3 SER A 9 2.636 9.190 3.741 1.00 0.76 H new ATOM 0 HG SER A 9 3.713 8.296 2.150 1.00 1.67 H new ATOM 130 N ASN A 10 1.408 8.931 6.204 1.00 1.03 N ATOM 131 CA ASN A 10 0.653 9.627 7.247 1.00 1.23 C ATOM 132 C ASN A 10 1.254 10.993 7.584 1.00 1.30 C ATOM 133 O ASN A 10 2.407 11.093 8.002 1.00 2.00 O ATOM 134 CB ASN A 10 0.565 8.763 8.510 1.00 1.55 C ATOM 135 CG ASN A 10 1.916 8.283 9.025 1.00 2.18 C ATOM 136 OD1 ASN A 10 1.988 7.603 10.049 1.00 2.66 O ATOM 137 ND2 ASN A 10 2.993 8.624 8.324 1.00 3.02 N ATOM 0 H ASN A 10 2.391 9.196 6.140 1.00 1.03 H new ATOM 0 HA ASN A 10 -0.350 9.799 6.856 1.00 1.23 H new ATOM 0 HB2 ASN A 10 0.070 9.334 9.295 1.00 1.55 H new ATOM 0 HB3 ASN A 10 -0.063 7.896 8.302 1.00 1.55 H new ATOM 0 HD21 ASN A 10 3.918 8.321 8.630 1.00 3.02 H new ATOM 0 HD22 ASN A 10 2.895 9.189 7.480 1.00 3.02 H new ATOM 144 N LEU A 11 0.442 12.038 7.406 1.00 1.21 N ATOM 145 CA LEU A 11 0.849 13.416 7.688 1.00 1.31 C ATOM 146 C LEU A 11 -0.210 14.399 7.199 1.00 1.49 C ATOM 147 O LEU A 11 -1.111 14.028 6.449 1.00 1.96 O ATOM 148 CB LEU A 11 2.183 13.748 7.015 1.00 1.36 C ATOM 149 CG LEU A 11 3.379 13.894 7.959 1.00 1.66 C ATOM 150 CD1 LEU A 11 4.633 14.249 7.173 1.00 2.11 C ATOM 151 CD2 LEU A 11 3.099 14.952 9.018 1.00 2.45 C ATOM 0 H LEU A 11 -0.515 11.953 7.063 1.00 1.21 H new ATOM 0 HA LEU A 11 0.963 13.506 8.768 1.00 1.31 H new ATOM 0 HB2 LEU A 11 2.408 12.966 6.289 1.00 1.36 H new ATOM 0 HB3 LEU A 11 2.067 14.677 6.457 1.00 1.36 H new ATOM 0 HG LEU A 11 3.541 12.940 8.461 1.00 1.66 H new ATOM 0 HD11 LEU A 11 5.475 14.350 7.858 1.00 2.11 H new ATOM 0 HD12 LEU A 11 4.845 13.461 6.450 1.00 2.11 H new ATOM 0 HD13 LEU A 11 4.478 15.191 6.647 1.00 2.11 H new ATOM 0 HD21 LEU A 11 3.961 15.041 9.680 1.00 2.45 H new ATOM 0 HD22 LEU A 11 2.912 15.911 8.534 1.00 2.45 H new ATOM 0 HD23 LEU A 11 2.224 14.662 9.599 1.00 2.45 H new ATOM 163 N ALA A 12 -0.080 15.658 7.607 1.00 1.57 N ATOM 164 CA ALA A 12 -1.014 16.692 7.180 1.00 1.79 C ATOM 165 C ALA A 12 -0.846 16.936 5.686 1.00 1.71 C ATOM 166 O ALA A 12 -1.745 17.436 5.010 1.00 2.29 O ATOM 167 CB ALA A 12 -0.785 17.976 7.962 1.00 2.08 C ATOM 0 H ALA A 12 0.659 15.985 8.229 1.00 1.57 H new ATOM 0 HA ALA A 12 -2.033 16.359 7.376 1.00 1.79 H new ATOM 0 HB1 ALA A 12 -1.492 18.736 7.629 1.00 2.08 H new ATOM 0 HB2 ALA A 12 -0.931 17.786 9.025 1.00 2.08 H new ATOM 0 HB3 ALA A 12 0.233 18.328 7.793 1.00 2.08 H new ATOM 173 N SER A 13 0.325 16.556 5.190 1.00 1.54 N ATOM 174 CA SER A 13 0.672 16.693 3.782 1.00 1.42 C ATOM 175 C SER A 13 1.834 15.757 3.455 1.00 1.10 C ATOM 176 O SER A 13 2.950 16.204 3.186 1.00 1.17 O ATOM 177 CB SER A 13 1.053 18.140 3.460 1.00 1.72 C ATOM 178 OG SER A 13 -0.035 19.019 3.688 1.00 2.45 O ATOM 0 H SER A 13 1.065 16.142 5.757 1.00 1.54 H new ATOM 0 HA SER A 13 -0.193 16.426 3.174 1.00 1.42 H new ATOM 0 HB2 SER A 13 1.902 18.441 4.074 1.00 1.72 H new ATOM 0 HB3 SER A 13 1.371 18.212 2.420 1.00 1.72 H new ATOM 0 HG SER A 13 -0.850 18.497 3.842 1.00 2.45 H new ATOM 184 N PRO A 14 1.590 14.433 3.500 1.00 0.96 N ATOM 185 CA PRO A 14 2.619 13.427 3.235 1.00 0.92 C ATOM 186 C PRO A 14 2.897 13.237 1.752 1.00 0.86 C ATOM 187 O PRO A 14 3.123 12.117 1.295 1.00 0.90 O ATOM 188 CB PRO A 14 2.022 12.156 3.833 1.00 1.18 C ATOM 189 CG PRO A 14 0.550 12.336 3.702 1.00 1.23 C ATOM 190 CD PRO A 14 0.292 13.813 3.836 1.00 1.14 C ATOM 0 HA PRO A 14 3.581 13.712 3.660 1.00 0.92 H new ATOM 0 HB2 PRO A 14 2.362 11.269 3.299 1.00 1.18 H new ATOM 0 HB3 PRO A 14 2.315 12.033 4.876 1.00 1.18 H new ATOM 0 HG2 PRO A 14 0.197 11.965 2.740 1.00 1.23 H new ATOM 0 HG3 PRO A 14 0.020 11.777 4.473 1.00 1.23 H new ATOM 0 HD2 PRO A 14 -0.496 14.144 3.159 1.00 1.14 H new ATOM 0 HD3 PRO A 14 -0.025 14.073 4.846 1.00 1.14 H new ATOM 198 N LEU A 15 2.894 14.332 1.004 1.00 0.89 N ATOM 199 CA LEU A 15 3.159 14.274 -0.424 1.00 0.90 C ATOM 200 C LEU A 15 4.605 13.873 -0.665 1.00 0.84 C ATOM 201 O LEU A 15 4.955 13.351 -1.723 1.00 0.84 O ATOM 202 CB LEU A 15 2.892 15.633 -1.073 1.00 1.07 C ATOM 203 CG LEU A 15 1.640 16.352 -0.575 1.00 1.33 C ATOM 204 CD1 LEU A 15 1.471 17.682 -1.294 1.00 1.67 C ATOM 205 CD2 LEU A 15 0.407 15.481 -0.760 1.00 1.72 C ATOM 0 H LEU A 15 2.711 15.269 1.363 1.00 0.89 H new ATOM 0 HA LEU A 15 2.496 13.533 -0.870 1.00 0.90 H new ATOM 0 HB2 LEU A 15 3.755 16.277 -0.901 1.00 1.07 H new ATOM 0 HB3 LEU A 15 2.808 15.494 -2.151 1.00 1.07 H new ATOM 0 HG LEU A 15 1.758 16.548 0.491 1.00 1.33 H new ATOM 0 HD11 LEU A 15 0.574 18.182 -0.928 1.00 1.67 H new ATOM 0 HD12 LEU A 15 2.341 18.311 -1.104 1.00 1.67 H new ATOM 0 HD13 LEU A 15 1.377 17.507 -2.366 1.00 1.67 H new ATOM 0 HD21 LEU A 15 -0.472 16.014 -0.398 1.00 1.72 H new ATOM 0 HD22 LEU A 15 0.281 15.249 -1.817 1.00 1.72 H new ATOM 0 HD23 LEU A 15 0.528 14.555 -0.197 1.00 1.72 H new ATOM 217 N GLU A 16 5.445 14.137 0.328 1.00 0.86 N ATOM 218 CA GLU A 16 6.863 13.825 0.234 1.00 0.88 C ATOM 219 C GLU A 16 7.109 12.316 0.244 1.00 0.76 C ATOM 220 O GLU A 16 7.889 11.806 -0.559 1.00 0.75 O ATOM 221 CB GLU A 16 7.627 14.486 1.382 1.00 1.05 C ATOM 222 CG GLU A 16 7.495 16.001 1.406 1.00 1.40 C ATOM 223 CD GLU A 16 8.029 16.654 0.148 1.00 1.82 C ATOM 224 OE1 GLU A 16 9.236 16.495 -0.138 1.00 2.49 O ATOM 225 OE2 GLU A 16 7.243 17.324 -0.554 1.00 2.16 O ATOM 0 H GLU A 16 5.166 14.568 1.210 1.00 0.86 H new ATOM 0 HA GLU A 16 7.226 14.218 -0.716 1.00 0.88 H new ATOM 0 HB2 GLU A 16 7.266 14.083 2.328 1.00 1.05 H new ATOM 0 HB3 GLU A 16 8.682 14.222 1.305 1.00 1.05 H new ATOM 0 HG2 GLU A 16 6.446 16.268 1.532 1.00 1.40 H new ATOM 0 HG3 GLU A 16 8.030 16.395 2.270 1.00 1.40 H new ATOM 232 N GLN A 17 6.449 11.611 1.161 1.00 0.73 N ATOM 233 CA GLN A 17 6.612 10.162 1.271 1.00 0.71 C ATOM 234 C GLN A 17 5.773 9.418 0.238 1.00 0.57 C ATOM 235 O GLN A 17 6.288 8.566 -0.482 1.00 0.51 O ATOM 236 CB GLN A 17 6.274 9.668 2.683 1.00 0.86 C ATOM 237 CG GLN A 17 5.257 10.525 3.423 1.00 1.20 C ATOM 238 CD GLN A 17 5.855 11.813 3.969 1.00 1.35 C ATOM 239 OE1 GLN A 17 5.161 12.614 4.593 1.00 2.20 O ATOM 240 NE2 GLN A 17 7.151 12.020 3.741 1.00 1.36 N ATOM 0 H GLN A 17 5.800 12.016 1.835 1.00 0.73 H new ATOM 0 HA GLN A 17 7.662 9.947 1.071 1.00 0.71 H new ATOM 0 HB2 GLN A 17 5.892 8.649 2.616 1.00 0.86 H new ATOM 0 HB3 GLN A 17 7.192 9.627 3.270 1.00 0.86 H new ATOM 0 HG2 GLN A 17 4.436 10.769 2.749 1.00 1.20 H new ATOM 0 HG3 GLN A 17 4.834 9.949 4.246 1.00 1.20 H new ATOM 0 HE21 GLN A 17 7.693 11.332 3.219 1.00 1.36 H new ATOM 0 HE22 GLN A 17 7.601 12.867 4.088 1.00 1.36 H new ATOM 249 N VAL A 18 4.482 9.728 0.166 1.00 0.57 N ATOM 250 CA VAL A 18 3.602 9.062 -0.793 1.00 0.53 C ATOM 251 C VAL A 18 4.254 8.998 -2.177 1.00 0.49 C ATOM 252 O VAL A 18 4.312 7.935 -2.797 1.00 0.51 O ATOM 253 CB VAL A 18 2.225 9.755 -0.897 1.00 0.62 C ATOM 254 CG1 VAL A 18 2.361 11.176 -1.417 1.00 1.10 C ATOM 255 CG2 VAL A 18 1.290 8.945 -1.781 1.00 1.25 C ATOM 0 H VAL A 18 4.025 10.427 0.752 1.00 0.57 H new ATOM 0 HA VAL A 18 3.442 8.049 -0.423 1.00 0.53 H new ATOM 0 HB VAL A 18 1.797 9.809 0.104 1.00 0.62 H new ATOM 0 HG11 VAL A 18 1.375 11.637 -1.479 1.00 1.10 H new ATOM 0 HG12 VAL A 18 2.989 11.753 -0.739 1.00 1.10 H new ATOM 0 HG13 VAL A 18 2.816 11.159 -2.407 1.00 1.10 H new ATOM 0 HG21 VAL A 18 0.324 9.446 -1.844 1.00 1.25 H new ATOM 0 HG22 VAL A 18 1.719 8.856 -2.779 1.00 1.25 H new ATOM 0 HG23 VAL A 18 1.156 7.951 -1.354 1.00 1.25 H new ATOM 265 N ASN A 19 4.764 10.136 -2.646 1.00 0.52 N ATOM 266 CA ASN A 19 5.428 10.198 -3.940 1.00 0.57 C ATOM 267 C ASN A 19 6.819 9.579 -3.852 1.00 0.50 C ATOM 268 O ASN A 19 7.361 9.111 -4.852 1.00 0.52 O ATOM 269 CB ASN A 19 5.521 11.642 -4.436 1.00 0.72 C ATOM 270 CG ASN A 19 4.162 12.242 -4.742 1.00 1.26 C ATOM 271 OD1 ASN A 19 3.386 11.682 -5.515 1.00 1.96 O ATOM 272 ND2 ASN A 19 3.873 13.395 -4.149 1.00 1.71 N ATOM 0 H ASN A 19 4.728 11.025 -2.147 1.00 0.52 H new ATOM 0 HA ASN A 19 4.834 9.629 -4.655 1.00 0.57 H new ATOM 0 HB2 ASN A 19 6.021 12.250 -3.682 1.00 0.72 H new ATOM 0 HB3 ASN A 19 6.139 11.675 -5.333 1.00 0.72 H new ATOM 0 HD21 ASN A 19 2.978 13.850 -4.328 1.00 1.71 H new ATOM 0 HD22 ASN A 19 4.546 13.825 -3.515 1.00 1.71 H new ATOM 279 N ALA A 20 7.383 9.568 -2.644 1.00 0.49 N ATOM 280 CA ALA A 20 8.706 8.989 -2.424 1.00 0.49 C ATOM 281 C ALA A 20 8.741 7.558 -2.947 1.00 0.42 C ATOM 282 O ALA A 20 9.566 7.213 -3.795 1.00 0.48 O ATOM 283 CB ALA A 20 9.067 9.032 -0.945 1.00 0.57 C ATOM 0 H ALA A 20 6.945 9.952 -1.807 1.00 0.49 H new ATOM 0 HA ALA A 20 9.444 9.577 -2.970 1.00 0.49 H new ATOM 0 HB1 ALA A 20 10.056 8.597 -0.799 1.00 0.57 H new ATOM 0 HB2 ALA A 20 9.072 10.066 -0.602 1.00 0.57 H new ATOM 0 HB3 ALA A 20 8.332 8.464 -0.375 1.00 0.57 H new ATOM 289 N ALA A 21 7.815 6.737 -2.461 1.00 0.41 N ATOM 290 CA ALA A 21 7.722 5.356 -2.912 1.00 0.45 C ATOM 291 C ALA A 21 7.351 5.351 -4.382 1.00 0.36 C ATOM 292 O ALA A 21 7.758 4.472 -5.133 1.00 0.40 O ATOM 293 CB ALA A 21 6.688 4.586 -2.109 1.00 0.64 C ATOM 0 H ALA A 21 7.124 7.003 -1.760 1.00 0.41 H new ATOM 0 HA ALA A 21 8.685 4.866 -2.766 1.00 0.45 H new ATOM 0 HB1 ALA A 21 6.640 3.558 -2.468 1.00 0.64 H new ATOM 0 HB2 ALA A 21 6.969 4.590 -1.056 1.00 0.64 H new ATOM 0 HB3 ALA A 21 5.712 5.057 -2.226 1.00 0.64 H new ATOM 299 N LEU A 22 6.581 6.361 -4.781 1.00 0.40 N ATOM 300 CA LEU A 22 6.159 6.502 -6.167 1.00 0.47 C ATOM 301 C LEU A 22 7.369 6.718 -7.068 1.00 0.44 C ATOM 302 O LEU A 22 7.323 6.430 -8.263 1.00 0.53 O ATOM 303 CB LEU A 22 5.171 7.666 -6.305 1.00 0.64 C ATOM 304 CG LEU A 22 3.778 7.407 -5.727 1.00 1.16 C ATOM 305 CD1 LEU A 22 2.913 8.654 -5.842 1.00 1.74 C ATOM 306 CD2 LEU A 22 3.113 6.233 -6.433 1.00 1.73 C ATOM 0 H LEU A 22 6.238 7.094 -4.160 1.00 0.40 H new ATOM 0 HA LEU A 22 5.658 5.585 -6.476 1.00 0.47 H new ATOM 0 HB2 LEU A 22 5.594 8.542 -5.813 1.00 0.64 H new ATOM 0 HB3 LEU A 22 5.069 7.912 -7.362 1.00 0.64 H new ATOM 0 HG LEU A 22 3.887 7.157 -4.672 1.00 1.16 H new ATOM 0 HD11 LEU A 22 1.926 8.452 -5.426 1.00 1.74 H new ATOM 0 HD12 LEU A 22 3.378 9.472 -5.291 1.00 1.74 H new ATOM 0 HD13 LEU A 22 2.814 8.933 -6.891 1.00 1.74 H new ATOM 0 HD21 LEU A 22 2.124 6.065 -6.007 1.00 1.73 H new ATOM 0 HD22 LEU A 22 3.018 6.454 -7.496 1.00 1.73 H new ATOM 0 HD23 LEU A 22 3.721 5.338 -6.302 1.00 1.73 H new ATOM 318 N LYS A 23 8.459 7.209 -6.479 1.00 0.43 N ATOM 319 CA LYS A 23 9.690 7.441 -7.228 1.00 0.52 C ATOM 320 C LYS A 23 10.340 6.109 -7.574 1.00 0.47 C ATOM 321 O LYS A 23 10.595 5.811 -8.741 1.00 0.56 O ATOM 322 CB LYS A 23 10.676 8.291 -6.419 1.00 0.61 C ATOM 323 CG LYS A 23 10.121 9.623 -5.936 1.00 1.13 C ATOM 324 CD LYS A 23 9.503 10.425 -7.069 1.00 1.51 C ATOM 325 CE LYS A 23 9.258 11.868 -6.659 1.00 2.12 C ATOM 326 NZ LYS A 23 8.382 11.964 -5.459 1.00 2.74 N ATOM 0 H LYS A 23 8.513 7.452 -5.490 1.00 0.43 H new ATOM 0 HA LYS A 23 9.435 7.979 -8.141 1.00 0.52 H new ATOM 0 HB2 LYS A 23 11.006 7.715 -5.554 1.00 0.61 H new ATOM 0 HB3 LYS A 23 11.558 8.481 -7.031 1.00 0.61 H new ATOM 0 HG2 LYS A 23 9.370 9.445 -5.166 1.00 1.13 H new ATOM 0 HG3 LYS A 23 10.920 10.203 -5.475 1.00 1.13 H new ATOM 0 HD2 LYS A 23 10.162 10.399 -7.937 1.00 1.51 H new ATOM 0 HD3 LYS A 23 8.561 9.966 -7.370 1.00 1.51 H new ATOM 0 HE2 LYS A 23 10.212 12.353 -6.452 1.00 2.12 H new ATOM 0 HE3 LYS A 23 8.799 12.408 -7.487 1.00 2.12 H new ATOM 0 HZ1 LYS A 23 7.695 12.733 -5.591 1.00 2.74 H new ATOM 0 HZ2 LYS A 23 7.875 11.066 -5.327 1.00 2.74 H new ATOM 0 HZ3 LYS A 23 8.964 12.160 -4.619 1.00 2.74 H new ATOM 340 N ALA A 24 10.600 5.309 -6.544 1.00 0.40 N ATOM 341 CA ALA A 24 11.215 4.000 -6.724 1.00 0.43 C ATOM 342 C ALA A 24 10.256 3.039 -7.414 1.00 0.38 C ATOM 343 O ALA A 24 10.677 2.157 -8.163 1.00 0.46 O ATOM 344 CB ALA A 24 11.652 3.436 -5.382 1.00 0.51 C ATOM 0 H ALA A 24 10.393 5.546 -5.574 1.00 0.40 H new ATOM 0 HA ALA A 24 12.093 4.119 -7.359 1.00 0.43 H new ATOM 0 HB1 ALA A 24 12.110 2.458 -5.530 1.00 0.51 H new ATOM 0 HB2 ALA A 24 12.375 4.109 -4.922 1.00 0.51 H new ATOM 0 HB3 ALA A 24 10.785 3.336 -4.730 1.00 0.51 H new ATOM 350 N LEU A 25 8.964 3.220 -7.161 1.00 0.43 N ATOM 351 CA LEU A 25 7.945 2.372 -7.764 1.00 0.40 C ATOM 352 C LEU A 25 7.656 2.839 -9.182 1.00 0.37 C ATOM 353 O LEU A 25 7.060 2.116 -9.976 1.00 0.45 O ATOM 354 CB LEU A 25 6.660 2.371 -6.934 1.00 0.47 C ATOM 355 CG LEU A 25 5.746 1.171 -7.172 1.00 0.56 C ATOM 356 CD1 LEU A 25 6.479 -0.122 -6.842 1.00 0.96 C ATOM 357 CD2 LEU A 25 4.482 1.300 -6.335 1.00 1.04 C ATOM 0 H LEU A 25 8.599 3.945 -6.543 1.00 0.43 H new ATOM 0 HA LEU A 25 8.325 1.351 -7.792 1.00 0.40 H new ATOM 0 HB2 LEU A 25 6.926 2.403 -5.878 1.00 0.47 H new ATOM 0 HB3 LEU A 25 6.103 3.283 -7.151 1.00 0.47 H new ATOM 0 HG LEU A 25 5.462 1.147 -8.224 1.00 0.56 H new ATOM 0 HD11 LEU A 25 5.817 -0.970 -7.016 1.00 0.96 H new ATOM 0 HD12 LEU A 25 7.360 -0.213 -7.477 1.00 0.96 H new ATOM 0 HD13 LEU A 25 6.786 -0.110 -5.796 1.00 0.96 H new ATOM 0 HD21 LEU A 25 3.838 0.439 -6.513 1.00 1.04 H new ATOM 0 HD22 LEU A 25 4.748 1.342 -5.279 1.00 1.04 H new ATOM 0 HD23 LEU A 25 3.953 2.212 -6.613 1.00 1.04 H new ATOM 369 N GLY A 26 8.110 4.048 -9.501 1.00 0.43 N ATOM 370 CA GLY A 26 7.927 4.574 -10.836 1.00 0.53 C ATOM 371 C GLY A 26 8.962 3.982 -11.754 1.00 0.56 C ATOM 372 O GLY A 26 8.687 3.659 -12.910 1.00 0.82 O ATOM 0 H GLY A 26 8.600 4.669 -8.858 1.00 0.43 H new ATOM 0 HA2 GLY A 26 6.926 4.337 -11.198 1.00 0.53 H new ATOM 0 HA3 GLY A 26 8.013 5.661 -10.825 1.00 0.53 H new ATOM 376 N ASP A 27 10.158 3.803 -11.200 1.00 0.59 N ATOM 377 CA ASP A 27 11.262 3.202 -11.923 1.00 0.76 C ATOM 378 C ASP A 27 11.884 2.100 -11.074 1.00 0.56 C ATOM 379 O ASP A 27 12.653 2.364 -10.150 1.00 0.81 O ATOM 380 CB ASP A 27 12.313 4.252 -12.264 1.00 1.35 C ATOM 381 CG ASP A 27 11.782 5.330 -13.186 1.00 2.02 C ATOM 382 OD1 ASP A 27 11.342 4.991 -14.305 1.00 2.42 O ATOM 383 OD2 ASP A 27 11.805 6.514 -12.790 1.00 2.61 O ATOM 0 H ASP A 27 10.383 4.071 -10.242 1.00 0.59 H new ATOM 0 HA ASP A 27 10.886 2.777 -12.854 1.00 0.76 H new ATOM 0 HB2 ASP A 27 12.674 4.712 -11.344 1.00 1.35 H new ATOM 0 HB3 ASP A 27 13.168 3.766 -12.734 1.00 1.35 H new ATOM 388 N ILE A 28 11.535 0.867 -11.400 1.00 0.51 N ATOM 389 CA ILE A 28 12.034 -0.299 -10.688 1.00 0.51 C ATOM 390 C ILE A 28 12.929 -1.113 -11.611 1.00 0.49 C ATOM 391 O ILE A 28 12.699 -1.121 -12.821 1.00 0.48 O ATOM 392 CB ILE A 28 10.868 -1.196 -10.210 1.00 0.71 C ATOM 393 CG1 ILE A 28 9.662 -0.353 -9.792 1.00 0.82 C ATOM 394 CG2 ILE A 28 11.290 -2.090 -9.055 1.00 0.83 C ATOM 395 CD1 ILE A 28 8.907 0.247 -10.956 1.00 1.26 C ATOM 0 H ILE A 28 10.898 0.645 -12.165 1.00 0.51 H new ATOM 0 HA ILE A 28 12.595 0.046 -9.820 1.00 0.51 H new ATOM 0 HB ILE A 28 10.585 -1.828 -11.052 1.00 0.71 H new ATOM 0 HG12 ILE A 28 8.981 -0.973 -9.210 1.00 0.82 H new ATOM 0 HG13 ILE A 28 10.001 0.450 -9.137 1.00 0.82 H new ATOM 0 HG21 ILE A 28 10.446 -2.706 -8.745 1.00 0.83 H new ATOM 0 HG22 ILE A 28 12.111 -2.732 -9.373 1.00 0.83 H new ATOM 0 HG23 ILE A 28 11.616 -1.473 -8.218 1.00 0.83 H new ATOM 0 HD11 ILE A 28 8.066 0.831 -10.582 1.00 1.26 H new ATOM 0 HD12 ILE A 28 9.573 0.894 -11.527 1.00 1.26 H new ATOM 0 HD13 ILE A 28 8.537 -0.551 -11.600 1.00 1.26 H new ATOM 407 N PRO A 29 13.955 -1.806 -11.077 1.00 0.68 N ATOM 408 CA PRO A 29 14.854 -2.620 -11.889 1.00 0.83 C ATOM 409 C PRO A 29 14.165 -3.266 -13.096 1.00 0.70 C ATOM 410 O PRO A 29 14.774 -3.418 -14.154 1.00 0.88 O ATOM 411 CB PRO A 29 15.299 -3.680 -10.893 1.00 1.07 C ATOM 412 CG PRO A 29 15.370 -2.959 -9.589 1.00 1.14 C ATOM 413 CD PRO A 29 14.337 -1.858 -9.646 1.00 0.87 C ATOM 0 HA PRO A 29 15.661 -2.035 -12.331 1.00 0.83 H new ATOM 0 HB2 PRO A 29 14.591 -4.508 -10.851 1.00 1.07 H new ATOM 0 HB3 PRO A 29 16.266 -4.101 -11.167 1.00 1.07 H new ATOM 0 HG2 PRO A 29 15.168 -3.637 -8.760 1.00 1.14 H new ATOM 0 HG3 PRO A 29 16.366 -2.547 -9.428 1.00 1.14 H new ATOM 0 HD2 PRO A 29 13.480 -2.081 -9.011 1.00 0.87 H new ATOM 0 HD3 PRO A 29 14.747 -0.907 -9.306 1.00 0.87 H new ATOM 421 N GLU A 30 12.892 -3.647 -12.933 1.00 0.54 N ATOM 422 CA GLU A 30 12.138 -4.275 -14.019 1.00 0.58 C ATOM 423 C GLU A 30 10.647 -3.919 -13.965 1.00 0.60 C ATOM 424 O GLU A 30 9.983 -3.836 -14.998 1.00 1.01 O ATOM 425 CB GLU A 30 12.292 -5.798 -13.955 1.00 0.62 C ATOM 426 CG GLU A 30 13.736 -6.273 -13.970 1.00 0.63 C ATOM 427 CD GLU A 30 13.853 -7.784 -13.937 1.00 1.39 C ATOM 428 OE1 GLU A 30 13.316 -8.440 -14.854 1.00 1.66 O ATOM 429 OE2 GLU A 30 14.480 -8.310 -12.994 1.00 2.35 O ATOM 0 H GLU A 30 12.368 -3.532 -12.066 1.00 0.54 H new ATOM 0 HA GLU A 30 12.546 -3.894 -14.956 1.00 0.58 H new ATOM 0 HB2 GLU A 30 11.809 -6.164 -13.049 1.00 0.62 H new ATOM 0 HB3 GLU A 30 11.765 -6.242 -14.799 1.00 0.62 H new ATOM 0 HG2 GLU A 30 14.230 -5.893 -14.864 1.00 0.63 H new ATOM 0 HG3 GLU A 30 14.262 -5.853 -13.113 1.00 0.63 H new ATOM 436 N SER A 31 10.127 -3.741 -12.755 1.00 0.36 N ATOM 437 CA SER A 31 8.710 -3.428 -12.552 1.00 0.34 C ATOM 438 C SER A 31 8.299 -2.113 -13.221 1.00 0.36 C ATOM 439 O SER A 31 9.148 -1.325 -13.639 1.00 0.46 O ATOM 440 CB SER A 31 8.414 -3.343 -11.056 1.00 0.37 C ATOM 441 OG SER A 31 8.979 -4.441 -10.363 1.00 0.83 O ATOM 0 H SER A 31 10.667 -3.808 -11.892 1.00 0.36 H new ATOM 0 HA SER A 31 8.133 -4.229 -13.014 1.00 0.34 H new ATOM 0 HB2 SER A 31 8.813 -2.411 -10.655 1.00 0.37 H new ATOM 0 HB3 SER A 31 7.336 -3.323 -10.896 1.00 0.37 H new ATOM 0 HG SER A 31 8.777 -4.363 -9.407 1.00 0.83 H new ATOM 447 N HIS A 32 6.983 -1.877 -13.297 1.00 0.33 N ATOM 448 CA HIS A 32 6.451 -0.647 -13.887 1.00 0.39 C ATOM 449 C HIS A 32 5.006 -0.401 -13.455 1.00 0.34 C ATOM 450 O HIS A 32 4.158 -1.291 -13.522 1.00 0.36 O ATOM 451 CB HIS A 32 6.549 -0.671 -15.414 1.00 0.51 C ATOM 452 CG HIS A 32 5.980 -1.902 -16.047 1.00 0.94 C ATOM 453 ND1 HIS A 32 6.542 -3.152 -15.903 1.00 1.83 N ATOM 454 CD2 HIS A 32 4.896 -2.066 -16.840 1.00 1.60 C ATOM 455 CE1 HIS A 32 5.828 -4.034 -16.581 1.00 2.29 C ATOM 456 NE2 HIS A 32 4.823 -3.399 -17.157 1.00 2.07 N ATOM 0 H HIS A 32 6.270 -2.522 -12.957 1.00 0.33 H new ATOM 0 HA HIS A 32 7.064 0.175 -13.518 1.00 0.39 H new ATOM 0 HB2 HIS A 32 6.032 0.201 -15.814 1.00 0.51 H new ATOM 0 HB3 HIS A 32 7.597 -0.580 -15.701 1.00 0.51 H new ATOM 0 HD2 HIS A 32 4.215 -1.292 -17.163 1.00 1.60 H new ATOM 0 HE1 HIS A 32 6.031 -5.092 -16.652 1.00 2.29 H new ATOM 0 HE2 HIS A 32 4.108 -3.830 -17.743 1.00 2.07 H new ATOM 465 N ILE A 33 4.751 0.822 -12.993 1.00 0.36 N ATOM 466 CA ILE A 33 3.431 1.234 -12.517 1.00 0.36 C ATOM 467 C ILE A 33 2.350 1.147 -13.597 1.00 0.38 C ATOM 468 O ILE A 33 2.624 1.307 -14.786 1.00 0.50 O ATOM 469 CB ILE A 33 3.498 2.679 -11.977 1.00 0.53 C ATOM 470 CG1 ILE A 33 4.207 2.697 -10.624 1.00 0.58 C ATOM 471 CG2 ILE A 33 2.109 3.298 -11.868 1.00 0.93 C ATOM 472 CD1 ILE A 33 3.472 1.935 -9.545 1.00 1.05 C ATOM 0 H ILE A 33 5.456 1.557 -12.938 1.00 0.36 H new ATOM 0 HA ILE A 33 3.152 0.539 -11.725 1.00 0.36 H new ATOM 0 HB ILE A 33 4.068 3.282 -12.684 1.00 0.53 H new ATOM 0 HG12 ILE A 33 5.205 2.274 -10.740 1.00 0.58 H new ATOM 0 HG13 ILE A 33 4.335 3.731 -10.304 1.00 0.58 H new ATOM 0 HG21 ILE A 33 2.193 4.315 -11.485 1.00 0.93 H new ATOM 0 HG22 ILE A 33 1.642 3.319 -12.852 1.00 0.93 H new ATOM 0 HG23 ILE A 33 1.498 2.704 -11.189 1.00 0.93 H new ATOM 0 HD11 ILE A 33 4.034 1.991 -8.613 1.00 1.05 H new ATOM 0 HD12 ILE A 33 2.484 2.372 -9.400 1.00 1.05 H new ATOM 0 HD13 ILE A 33 3.367 0.892 -9.843 1.00 1.05 H new ATOM 484 N LEU A 34 1.108 0.916 -13.154 1.00 0.38 N ATOM 485 CA LEU A 34 -0.039 0.829 -14.055 1.00 0.50 C ATOM 486 C LEU A 34 -1.280 1.477 -13.433 1.00 0.46 C ATOM 487 O LEU A 34 -1.725 2.533 -13.882 1.00 0.60 O ATOM 488 CB LEU A 34 -0.342 -0.627 -14.421 1.00 0.65 C ATOM 489 CG LEU A 34 0.726 -1.329 -15.264 1.00 1.01 C ATOM 490 CD1 LEU A 34 0.300 -2.755 -15.571 1.00 1.69 C ATOM 491 CD2 LEU A 34 0.983 -0.564 -16.556 1.00 1.34 C ATOM 0 H LEU A 34 0.875 0.786 -12.170 1.00 0.38 H new ATOM 0 HA LEU A 34 0.220 1.372 -14.964 1.00 0.50 H new ATOM 0 HB2 LEU A 34 -0.484 -1.193 -13.500 1.00 0.65 H new ATOM 0 HB3 LEU A 34 -1.287 -0.658 -14.963 1.00 0.65 H new ATOM 0 HG LEU A 34 1.653 -1.355 -14.692 1.00 1.01 H new ATOM 0 HD11 LEU A 34 1.068 -3.243 -16.171 1.00 1.69 H new ATOM 0 HD12 LEU A 34 0.165 -3.303 -14.639 1.00 1.69 H new ATOM 0 HD13 LEU A 34 -0.639 -2.743 -16.124 1.00 1.69 H new ATOM 0 HD21 LEU A 34 1.745 -1.081 -17.139 1.00 1.34 H new ATOM 0 HD22 LEU A 34 0.061 -0.506 -17.134 1.00 1.34 H new ATOM 0 HD23 LEU A 34 1.327 0.443 -16.320 1.00 1.34 H new ATOM 503 N THR A 35 -1.839 0.841 -12.399 1.00 0.46 N ATOM 504 CA THR A 35 -3.031 1.369 -11.730 1.00 0.43 C ATOM 505 C THR A 35 -2.664 2.028 -10.404 1.00 0.43 C ATOM 506 O THR A 35 -2.166 1.370 -9.493 1.00 0.52 O ATOM 507 CB THR A 35 -4.058 0.256 -11.487 1.00 0.49 C ATOM 508 OG1 THR A 35 -3.844 -0.825 -12.378 1.00 0.68 O ATOM 509 CG2 THR A 35 -5.483 0.720 -11.679 1.00 0.72 C ATOM 0 H THR A 35 -1.488 -0.034 -12.009 1.00 0.46 H new ATOM 0 HA THR A 35 -3.472 2.120 -12.386 1.00 0.43 H new ATOM 0 HB THR A 35 -3.919 -0.050 -10.450 1.00 0.49 H new ATOM 0 HG1 THR A 35 -4.507 -1.526 -12.207 1.00 0.68 H new ATOM 0 HG21 THR A 35 -6.164 -0.110 -11.494 1.00 0.72 H new ATOM 0 HG22 THR A 35 -5.699 1.529 -10.982 1.00 0.72 H new ATOM 0 HG23 THR A 35 -5.615 1.076 -12.701 1.00 0.72 H new ATOM 517 N VAL A 36 -2.913 3.330 -10.301 1.00 0.40 N ATOM 518 CA VAL A 36 -2.605 4.074 -9.082 1.00 0.46 C ATOM 519 C VAL A 36 -3.617 5.192 -8.846 1.00 0.48 C ATOM 520 O VAL A 36 -3.659 6.170 -9.593 1.00 0.56 O ATOM 521 CB VAL A 36 -1.189 4.688 -9.131 1.00 0.58 C ATOM 522 CG1 VAL A 36 -0.915 5.517 -7.884 1.00 1.32 C ATOM 523 CG2 VAL A 36 -0.135 3.600 -9.288 1.00 1.45 C ATOM 0 H VAL A 36 -3.327 3.892 -11.045 1.00 0.40 H new ATOM 0 HA VAL A 36 -2.655 3.358 -8.262 1.00 0.46 H new ATOM 0 HB VAL A 36 -1.137 5.346 -9.998 1.00 0.58 H new ATOM 0 HG11 VAL A 36 0.088 5.939 -7.941 1.00 1.32 H new ATOM 0 HG12 VAL A 36 -1.645 6.324 -7.816 1.00 1.32 H new ATOM 0 HG13 VAL A 36 -0.992 4.882 -7.001 1.00 1.32 H new ATOM 0 HG21 VAL A 36 0.855 4.055 -9.320 1.00 1.45 H new ATOM 0 HG22 VAL A 36 -0.192 2.914 -8.443 1.00 1.45 H new ATOM 0 HG23 VAL A 36 -0.313 3.052 -10.213 1.00 1.45 H new ATOM 533 N SER A 37 -4.426 5.040 -7.801 1.00 0.45 N ATOM 534 CA SER A 37 -5.431 6.037 -7.462 1.00 0.54 C ATOM 535 C SER A 37 -6.037 5.716 -6.100 1.00 0.57 C ATOM 536 O SER A 37 -5.414 5.036 -5.285 1.00 1.08 O ATOM 537 CB SER A 37 -6.521 6.076 -8.539 1.00 0.65 C ATOM 538 OG SER A 37 -7.403 7.166 -8.341 1.00 1.28 O ATOM 0 H SER A 37 -4.403 4.235 -7.175 1.00 0.45 H new ATOM 0 HA SER A 37 -4.959 7.018 -7.414 1.00 0.54 H new ATOM 0 HB2 SER A 37 -6.060 6.153 -9.523 1.00 0.65 H new ATOM 0 HB3 SER A 37 -7.084 5.143 -8.523 1.00 0.65 H new ATOM 0 HG SER A 37 -8.086 7.166 -9.044 1.00 1.28 H new ATOM 544 N SER A 38 -7.252 6.197 -5.860 1.00 0.59 N ATOM 545 CA SER A 38 -7.938 5.948 -4.601 1.00 0.59 C ATOM 546 C SER A 38 -7.170 6.549 -3.424 1.00 0.52 C ATOM 547 O SER A 38 -6.684 5.826 -2.558 1.00 0.63 O ATOM 548 CB SER A 38 -8.133 4.438 -4.397 1.00 0.78 C ATOM 549 OG SER A 38 -8.747 3.852 -5.530 1.00 1.68 O ATOM 0 H SER A 38 -7.782 6.763 -6.523 1.00 0.59 H new ATOM 0 HA SER A 38 -8.914 6.431 -4.644 1.00 0.59 H new ATOM 0 HB2 SER A 38 -7.169 3.964 -4.215 1.00 0.78 H new ATOM 0 HB3 SER A 38 -8.747 4.262 -3.514 1.00 0.78 H new ATOM 0 HG SER A 38 -8.154 3.168 -5.906 1.00 1.68 H new ATOM 555 N PHE A 39 -7.077 7.875 -3.394 1.00 0.44 N ATOM 556 CA PHE A 39 -6.388 8.573 -2.308 1.00 0.50 C ATOM 557 C PHE A 39 -7.364 8.821 -1.160 1.00 0.57 C ATOM 558 O PHE A 39 -8.044 9.848 -1.109 1.00 0.75 O ATOM 559 CB PHE A 39 -5.795 9.900 -2.788 1.00 0.59 C ATOM 560 CG PHE A 39 -4.757 9.754 -3.867 1.00 0.59 C ATOM 561 CD1 PHE A 39 -5.090 9.192 -5.090 1.00 0.65 C ATOM 562 CD2 PHE A 39 -3.451 10.167 -3.660 1.00 0.83 C ATOM 563 CE1 PHE A 39 -4.142 9.048 -6.085 1.00 0.98 C ATOM 564 CE2 PHE A 39 -2.498 10.027 -4.652 1.00 1.19 C ATOM 565 CZ PHE A 39 -2.834 9.500 -5.860 1.00 1.26 C ATOM 0 H PHE A 39 -7.469 8.489 -4.108 1.00 0.44 H new ATOM 0 HA PHE A 39 -5.567 7.945 -1.962 1.00 0.50 H new ATOM 0 HB2 PHE A 39 -6.601 10.533 -3.158 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -5.349 10.415 -1.937 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -6.103 8.863 -5.267 1.00 0.65 H new ATOM 0 HD2 PHE A 39 -3.174 10.604 -2.712 1.00 0.83 H new ATOM 0 HE1 PHE A 39 -4.406 8.591 -7.027 1.00 0.98 H new ATOM 0 HE2 PHE A 39 -1.481 10.338 -4.466 1.00 1.19 H new ATOM 0 HZ PHE A 39 -2.095 9.430 -6.644 1.00 1.26 H new ATOM 575 N TYR A 40 -7.449 7.859 -0.259 1.00 0.65 N ATOM 576 CA TYR A 40 -8.364 7.940 0.874 1.00 0.81 C ATOM 577 C TYR A 40 -7.663 8.371 2.156 1.00 0.71 C ATOM 578 O TYR A 40 -6.436 8.364 2.251 1.00 0.71 O ATOM 579 CB TYR A 40 -9.018 6.579 1.085 1.00 1.01 C ATOM 580 CG TYR A 40 -8.004 5.471 1.075 1.00 1.49 C ATOM 581 CD1 TYR A 40 -7.402 5.071 2.252 1.00 2.39 C ATOM 582 CD2 TYR A 40 -7.691 4.787 -0.092 1.00 1.73 C ATOM 583 CE1 TYR A 40 -6.508 4.029 2.275 1.00 3.35 C ATOM 584 CE2 TYR A 40 -6.798 3.736 -0.076 1.00 2.61 C ATOM 585 CZ TYR A 40 -6.063 3.498 0.999 1.00 3.41 C ATOM 586 OH TYR A 40 -5.325 2.310 1.147 1.00 4.43 O ATOM 0 H TYR A 40 -6.892 7.005 -0.288 1.00 0.65 H new ATOM 0 HA TYR A 40 -9.113 8.697 0.643 1.00 0.81 H new ATOM 0 HB2 TYR A 40 -9.553 6.575 2.035 1.00 1.01 H new ATOM 0 HB3 TYR A 40 -9.756 6.404 0.303 1.00 1.01 H new ATOM 0 HD1 TYR A 40 -7.639 5.587 3.171 1.00 2.39 H new ATOM 0 HD2 TYR A 40 -8.152 5.081 -1.023 1.00 1.73 H new ATOM 0 HE1 TYR A 40 -6.149 3.620 3.208 1.00 3.35 H new ATOM 0 HE2 TYR A 40 -6.698 3.103 -0.946 1.00 2.61 H new ATOM 0 HH TYR A 40 -5.199 2.120 2.100 1.00 4.43 H new ATOM 596 N ARG A 41 -8.478 8.728 3.143 1.00 0.70 N ATOM 597 CA ARG A 41 -7.981 9.152 4.446 1.00 0.67 C ATOM 598 C ARG A 41 -8.017 7.981 5.425 1.00 0.64 C ATOM 599 O ARG A 41 -8.800 7.047 5.253 1.00 0.70 O ATOM 600 CB ARG A 41 -8.829 10.309 4.984 1.00 0.79 C ATOM 601 CG ARG A 41 -8.385 10.814 6.348 1.00 0.95 C ATOM 602 CD ARG A 41 -6.992 11.419 6.295 1.00 1.52 C ATOM 603 NE ARG A 41 -6.937 12.596 5.430 1.00 2.11 N ATOM 604 CZ ARG A 41 -7.611 13.720 5.664 1.00 2.49 C ATOM 605 NH1 ARG A 41 -8.379 13.829 6.740 1.00 2.37 N ATOM 606 NH2 ARG A 41 -7.511 14.740 4.822 1.00 3.51 N ATOM 0 H ARG A 41 -9.495 8.732 3.063 1.00 0.70 H new ATOM 0 HA ARG A 41 -6.951 9.492 4.336 1.00 0.67 H new ATOM 0 HB2 ARG A 41 -8.794 11.134 4.273 1.00 0.79 H new ATOM 0 HB3 ARG A 41 -9.868 9.987 5.047 1.00 0.79 H new ATOM 0 HG2 ARG A 41 -9.093 11.560 6.708 1.00 0.95 H new ATOM 0 HG3 ARG A 41 -8.398 9.991 7.063 1.00 0.95 H new ATOM 0 HD2 ARG A 41 -6.678 11.694 7.302 1.00 1.52 H new ATOM 0 HD3 ARG A 41 -6.286 10.671 5.934 1.00 1.52 H new ATOM 0 HE ARG A 41 -6.348 12.554 4.598 1.00 2.11 H new ATOM 0 HH11 ARG A 41 -8.455 13.049 7.393 1.00 2.37 H new ATOM 0 HH12 ARG A 41 -8.893 14.693 6.914 1.00 2.37 H new ATOM 0 HH21 ARG A 41 -6.918 14.663 3.996 1.00 3.51 H new ATOM 0 HH22 ARG A 41 -8.027 15.601 5.001 1.00 3.51 H new ATOM 620 N THR A 42 -7.168 8.028 6.446 1.00 0.80 N ATOM 621 CA THR A 42 -7.117 6.959 7.437 1.00 0.97 C ATOM 622 C THR A 42 -6.724 7.492 8.815 1.00 1.03 C ATOM 623 O THR A 42 -5.833 8.334 8.937 1.00 1.12 O ATOM 624 CB THR A 42 -6.130 5.877 6.988 1.00 1.17 C ATOM 625 OG1 THR A 42 -6.525 5.323 5.746 1.00 1.44 O ATOM 626 CG2 THR A 42 -5.992 4.738 7.974 1.00 1.32 C ATOM 0 H THR A 42 -6.510 8.790 6.609 1.00 0.80 H new ATOM 0 HA THR A 42 -8.114 6.527 7.519 1.00 0.97 H new ATOM 0 HB THR A 42 -5.168 6.383 6.910 1.00 1.17 H new ATOM 0 HG1 THR A 42 -6.254 5.922 5.020 1.00 1.44 H new ATOM 0 HG21 THR A 42 -5.277 4.010 7.591 1.00 1.32 H new ATOM 0 HG22 THR A 42 -5.638 5.125 8.930 1.00 1.32 H new ATOM 0 HG23 THR A 42 -6.961 4.258 8.113 1.00 1.32 H new ATOM 634 N PRO A 43 -7.386 7.000 9.881 1.00 1.12 N ATOM 635 CA PRO A 43 -7.100 7.422 11.254 1.00 1.31 C ATOM 636 C PRO A 43 -5.882 6.699 11.829 1.00 1.50 C ATOM 637 O PRO A 43 -5.513 5.627 11.352 1.00 1.71 O ATOM 638 CB PRO A 43 -8.369 7.015 11.999 1.00 1.48 C ATOM 639 CG PRO A 43 -8.840 5.798 11.282 1.00 1.38 C ATOM 640 CD PRO A 43 -8.466 5.992 9.834 1.00 1.15 C ATOM 0 HA PRO A 43 -6.863 8.483 11.330 1.00 1.31 H new ATOM 0 HB2 PRO A 43 -8.164 6.804 13.049 1.00 1.48 H new ATOM 0 HB3 PRO A 43 -9.117 7.807 11.973 1.00 1.48 H new ATOM 0 HG2 PRO A 43 -8.372 4.901 11.688 1.00 1.38 H new ATOM 0 HG3 PRO A 43 -9.917 5.673 11.393 1.00 1.38 H new ATOM 0 HD2 PRO A 43 -8.125 5.061 9.381 1.00 1.15 H new ATOM 0 HD3 PRO A 43 -9.314 6.341 9.245 1.00 1.15 H new ATOM 648 N PRO A 44 -5.231 7.274 12.858 1.00 1.55 N ATOM 649 CA PRO A 44 -4.057 6.680 13.474 1.00 1.80 C ATOM 650 C PRO A 44 -4.409 5.785 14.661 1.00 2.15 C ATOM 651 O PRO A 44 -4.218 4.570 14.611 1.00 2.77 O ATOM 652 CB PRO A 44 -3.269 7.903 13.941 1.00 1.80 C ATOM 653 CG PRO A 44 -4.281 8.987 14.156 1.00 1.81 C ATOM 654 CD PRO A 44 -5.572 8.550 13.500 1.00 1.54 C ATOM 0 HA PRO A 44 -3.513 6.031 12.788 1.00 1.80 H new ATOM 0 HB2 PRO A 44 -2.725 7.689 14.861 1.00 1.80 H new ATOM 0 HB3 PRO A 44 -2.531 8.200 13.196 1.00 1.80 H new ATOM 0 HG2 PRO A 44 -4.434 9.162 15.221 1.00 1.81 H new ATOM 0 HG3 PRO A 44 -3.932 9.926 13.726 1.00 1.81 H new ATOM 0 HD2 PRO A 44 -6.370 8.428 14.232 1.00 1.54 H new ATOM 0 HD3 PRO A 44 -5.918 9.283 12.771 1.00 1.54 H new ATOM 662 N LEU A 45 -4.921 6.399 15.728 1.00 2.16 N ATOM 663 CA LEU A 45 -5.299 5.669 16.934 1.00 2.52 C ATOM 664 C LEU A 45 -4.139 4.827 17.451 1.00 2.69 C ATOM 665 O LEU A 45 -4.219 3.599 17.496 1.00 3.09 O ATOM 666 CB LEU A 45 -6.519 4.778 16.671 1.00 2.75 C ATOM 667 CG LEU A 45 -7.861 5.512 16.548 1.00 3.05 C ATOM 668 CD1 LEU A 45 -8.172 6.280 17.823 1.00 3.66 C ATOM 669 CD2 LEU A 45 -7.857 6.447 15.350 1.00 3.32 C ATOM 0 H LEU A 45 -5.083 7.405 15.779 1.00 2.16 H new ATOM 0 HA LEU A 45 -5.559 6.403 17.697 1.00 2.52 H new ATOM 0 HB2 LEU A 45 -6.346 4.218 15.752 1.00 2.75 H new ATOM 0 HB3 LEU A 45 -6.596 4.050 17.479 1.00 2.75 H new ATOM 0 HG LEU A 45 -8.642 4.767 16.397 1.00 3.05 H new ATOM 0 HD11 LEU A 45 -9.128 6.793 17.715 1.00 3.66 H new ATOM 0 HD12 LEU A 45 -8.226 5.586 18.662 1.00 3.66 H new ATOM 0 HD13 LEU A 45 -7.386 7.012 18.008 1.00 3.66 H new ATOM 0 HD21 LEU A 45 -8.818 6.956 15.283 1.00 3.32 H new ATOM 0 HD22 LEU A 45 -7.063 7.184 15.467 1.00 3.32 H new ATOM 0 HD23 LEU A 45 -7.687 5.872 14.440 1.00 3.32 H new ATOM 681 N GLY A 46 -3.059 5.497 17.842 1.00 2.52 N ATOM 682 CA GLY A 46 -1.898 4.795 18.352 1.00 2.73 C ATOM 683 C GLY A 46 -0.675 5.686 18.410 1.00 2.68 C ATOM 684 O GLY A 46 -0.265 6.108 19.491 1.00 2.81 O ATOM 0 H GLY A 46 -2.968 6.513 17.814 1.00 2.52 H new ATOM 0 HA2 GLY A 46 -2.115 4.412 19.349 1.00 2.73 H new ATOM 0 HA3 GLY A 46 -1.689 3.933 17.719 1.00 2.73 H new ATOM 688 N PRO A 47 -0.069 6.000 17.251 1.00 2.59 N ATOM 689 CA PRO A 47 1.113 6.861 17.194 1.00 2.65 C ATOM 690 C PRO A 47 0.868 8.203 17.874 1.00 2.60 C ATOM 691 O PRO A 47 1.744 8.734 18.555 1.00 2.86 O ATOM 692 CB PRO A 47 1.349 7.054 15.693 1.00 2.59 C ATOM 693 CG PRO A 47 0.688 5.887 15.047 1.00 2.63 C ATOM 694 CD PRO A 47 -0.491 5.547 15.912 1.00 2.54 C ATOM 0 HA PRO A 47 1.966 6.423 17.712 1.00 2.65 H new ATOM 0 HB2 PRO A 47 0.921 7.994 15.344 1.00 2.59 H new ATOM 0 HB3 PRO A 47 2.414 7.083 15.461 1.00 2.59 H new ATOM 0 HG2 PRO A 47 0.371 6.131 14.033 1.00 2.63 H new ATOM 0 HG3 PRO A 47 1.373 5.043 14.972 1.00 2.63 H new ATOM 0 HD2 PRO A 47 -1.395 6.058 15.580 1.00 2.54 H new ATOM 0 HD3 PRO A 47 -0.706 4.479 15.898 1.00 2.54 H new ATOM 702 N GLN A 48 -0.334 8.746 17.680 1.00 2.39 N ATOM 703 CA GLN A 48 -0.701 10.026 18.272 1.00 2.50 C ATOM 704 C GLN A 48 -2.213 10.256 18.192 1.00 2.40 C ATOM 705 O GLN A 48 -2.993 9.485 18.751 1.00 2.57 O ATOM 706 CB GLN A 48 0.062 11.168 17.590 1.00 2.56 C ATOM 707 CG GLN A 48 0.510 10.866 16.163 1.00 2.73 C ATOM 708 CD GLN A 48 -0.637 10.538 15.224 1.00 2.73 C ATOM 709 OE1 GLN A 48 -1.412 9.615 15.470 1.00 3.26 O ATOM 710 NE2 GLN A 48 -0.743 11.285 14.132 1.00 2.45 N ATOM 0 H GLN A 48 -1.068 8.317 17.117 1.00 2.39 H new ATOM 0 HA GLN A 48 -0.423 10.007 19.326 1.00 2.50 H new ATOM 0 HB2 GLN A 48 -0.571 12.055 17.578 1.00 2.56 H new ATOM 0 HB3 GLN A 48 0.940 11.411 18.189 1.00 2.56 H new ATOM 0 HG2 GLN A 48 1.054 11.726 15.772 1.00 2.73 H new ATOM 0 HG3 GLN A 48 1.207 10.028 16.179 1.00 2.73 H new ATOM 0 HE21 GLN A 48 -0.079 12.041 13.965 1.00 2.45 H new ATOM 0 HE22 GLN A 48 -1.488 11.103 13.460 1.00 2.45 H new ATOM 719 N ASP A 49 -2.623 11.315 17.496 1.00 2.45 N ATOM 720 CA ASP A 49 -4.037 11.638 17.350 1.00 2.47 C ATOM 721 C ASP A 49 -4.226 12.578 16.165 1.00 2.38 C ATOM 722 O ASP A 49 -5.221 13.292 16.063 1.00 2.57 O ATOM 723 CB ASP A 49 -4.568 12.278 18.639 1.00 2.79 C ATOM 724 CG ASP A 49 -6.084 12.241 18.741 1.00 2.83 C ATOM 725 OD1 ASP A 49 -6.747 12.868 17.888 1.00 3.02 O ATOM 726 OD2 ASP A 49 -6.608 11.590 19.666 1.00 3.28 O ATOM 0 H ASP A 49 -1.993 11.964 17.024 1.00 2.45 H new ATOM 0 HA ASP A 49 -4.600 10.723 17.166 1.00 2.47 H new ATOM 0 HB2 ASP A 49 -4.139 11.761 19.498 1.00 2.79 H new ATOM 0 HB3 ASP A 49 -4.231 13.314 18.689 1.00 2.79 H new ATOM 731 N GLN A 50 -3.251 12.560 15.261 1.00 2.26 N ATOM 732 CA GLN A 50 -3.284 13.391 14.070 1.00 2.39 C ATOM 733 C GLN A 50 -3.296 12.493 12.842 1.00 2.01 C ATOM 734 O GLN A 50 -2.271 12.320 12.182 1.00 2.19 O ATOM 735 CB GLN A 50 -2.066 14.318 14.026 1.00 3.08 C ATOM 736 CG GLN A 50 -1.615 14.809 15.393 1.00 3.45 C ATOM 737 CD GLN A 50 -2.729 15.463 16.185 1.00 3.73 C ATOM 738 OE1 GLN A 50 -3.296 16.473 15.768 1.00 4.34 O ATOM 739 NE2 GLN A 50 -3.048 14.885 17.337 1.00 3.74 N ATOM 0 H GLN A 50 -2.422 11.971 15.336 1.00 2.26 H new ATOM 0 HA GLN A 50 -4.182 14.008 14.088 1.00 2.39 H new ATOM 0 HB2 GLN A 50 -1.239 13.793 13.549 1.00 3.08 H new ATOM 0 HB3 GLN A 50 -2.300 15.179 13.400 1.00 3.08 H new ATOM 0 HG2 GLN A 50 -1.218 13.968 15.962 1.00 3.45 H new ATOM 0 HG3 GLN A 50 -0.800 15.522 15.266 1.00 3.45 H new ATOM 0 HE21 GLN A 50 -2.551 14.049 17.643 1.00 3.74 H new ATOM 0 HE22 GLN A 50 -3.790 15.277 17.916 1.00 3.74 H new ATOM 748 N PRO A 51 -4.455 11.889 12.533 1.00 1.98 N ATOM 749 CA PRO A 51 -4.604 10.983 11.396 1.00 2.00 C ATOM 750 C PRO A 51 -3.986 11.535 10.121 1.00 1.82 C ATOM 751 O PRO A 51 -2.782 11.418 9.894 1.00 2.47 O ATOM 752 CB PRO A 51 -6.133 10.833 11.241 1.00 2.71 C ATOM 753 CG PRO A 51 -6.736 11.816 12.191 1.00 2.89 C ATOM 754 CD PRO A 51 -5.717 12.027 13.269 1.00 2.51 C ATOM 0 HA PRO A 51 -4.090 10.037 11.568 1.00 2.00 H new ATOM 0 HB2 PRO A 51 -6.444 11.038 10.217 1.00 2.71 H new ATOM 0 HB3 PRO A 51 -6.452 9.817 11.474 1.00 2.71 H new ATOM 0 HG2 PRO A 51 -6.970 12.753 11.686 1.00 2.89 H new ATOM 0 HG3 PRO A 51 -7.670 11.436 12.606 1.00 2.89 H new ATOM 0 HD2 PRO A 51 -5.812 13.009 13.733 1.00 2.51 H new ATOM 0 HD3 PRO A 51 -5.807 11.288 14.065 1.00 2.51 H new ATOM 762 N ASP A 52 -4.822 12.135 9.297 1.00 1.32 N ATOM 763 CA ASP A 52 -4.380 12.712 8.037 1.00 1.52 C ATOM 764 C ASP A 52 -3.667 11.675 7.165 1.00 1.28 C ATOM 765 O ASP A 52 -3.014 12.034 6.184 1.00 2.07 O ATOM 766 CB ASP A 52 -3.455 13.903 8.294 1.00 2.12 C ATOM 767 CG ASP A 52 -4.137 15.007 9.078 1.00 2.77 C ATOM 768 OD1 ASP A 52 -4.574 14.743 10.217 1.00 3.33 O ATOM 769 OD2 ASP A 52 -4.231 16.136 8.554 1.00 3.26 O ATOM 0 H ASP A 52 -5.821 12.238 9.477 1.00 1.32 H new ATOM 0 HA ASP A 52 -5.265 13.053 7.500 1.00 1.52 H new ATOM 0 HB2 ASP A 52 -2.574 13.564 8.840 1.00 2.12 H new ATOM 0 HB3 ASP A 52 -3.106 14.300 7.341 1.00 2.12 H new ATOM 774 N TYR A 53 -3.789 10.390 7.516 1.00 0.84 N ATOM 775 CA TYR A 53 -3.144 9.332 6.738 1.00 1.19 C ATOM 776 C TYR A 53 -3.591 9.373 5.283 1.00 0.96 C ATOM 777 O TYR A 53 -4.781 9.269 4.984 1.00 1.43 O ATOM 778 CB TYR A 53 -3.445 7.946 7.317 1.00 2.08 C ATOM 779 CG TYR A 53 -2.719 7.627 8.605 1.00 3.12 C ATOM 780 CD1 TYR A 53 -2.705 8.536 9.657 1.00 3.88 C ATOM 781 CD2 TYR A 53 -2.045 6.426 8.771 1.00 3.74 C ATOM 782 CE1 TYR A 53 -2.041 8.256 10.835 1.00 5.03 C ATOM 783 CE2 TYR A 53 -1.379 6.138 9.945 1.00 4.86 C ATOM 784 CZ TYR A 53 -1.387 7.026 10.971 1.00 5.45 C ATOM 785 OH TYR A 53 -0.716 6.770 12.146 1.00 6.66 O ATOM 0 H TYR A 53 -4.321 10.063 8.322 1.00 0.84 H new ATOM 0 HA TYR A 53 -2.070 9.510 6.791 1.00 1.19 H new ATOM 0 HB2 TYR A 53 -4.518 7.865 7.491 1.00 2.08 H new ATOM 0 HB3 TYR A 53 -3.185 7.193 6.573 1.00 2.08 H new ATOM 0 HD1 TYR A 53 -3.223 9.478 9.551 1.00 3.88 H new ATOM 0 HD2 TYR A 53 -2.041 5.704 7.968 1.00 3.74 H new ATOM 0 HE1 TYR A 53 -2.027 8.976 11.640 1.00 5.03 H new ATOM 0 HE2 TYR A 53 -0.849 5.202 10.047 1.00 4.86 H new ATOM 0 HH TYR A 53 -0.387 7.612 12.525 1.00 6.66 H new ATOM 795 N LEU A 54 -2.625 9.502 4.382 1.00 0.84 N ATOM 796 CA LEU A 54 -2.904 9.533 2.952 1.00 0.76 C ATOM 797 C LEU A 54 -2.383 8.257 2.305 1.00 0.76 C ATOM 798 O LEU A 54 -1.191 7.961 2.378 1.00 0.98 O ATOM 799 CB LEU A 54 -2.251 10.757 2.305 1.00 0.97 C ATOM 800 CG LEU A 54 -2.405 10.855 0.785 1.00 1.15 C ATOM 801 CD1 LEU A 54 -3.868 11.015 0.403 1.00 1.60 C ATOM 802 CD2 LEU A 54 -1.584 12.013 0.241 1.00 1.60 C ATOM 0 H LEU A 54 -1.636 9.587 4.618 1.00 0.84 H new ATOM 0 HA LEU A 54 -3.982 9.600 2.802 1.00 0.76 H new ATOM 0 HB2 LEU A 54 -2.675 11.655 2.755 1.00 0.97 H new ATOM 0 HB3 LEU A 54 -1.188 10.751 2.546 1.00 0.97 H new ATOM 0 HG LEU A 54 -2.035 9.930 0.343 1.00 1.15 H new ATOM 0 HD11 LEU A 54 -3.956 11.083 -0.681 1.00 1.60 H new ATOM 0 HD12 LEU A 54 -4.433 10.154 0.760 1.00 1.60 H new ATOM 0 HD13 LEU A 54 -4.265 11.923 0.857 1.00 1.60 H new ATOM 0 HD21 LEU A 54 -1.705 12.068 -0.841 1.00 1.60 H new ATOM 0 HD22 LEU A 54 -1.925 12.945 0.692 1.00 1.60 H new ATOM 0 HD23 LEU A 54 -0.532 11.858 0.481 1.00 1.60 H new ATOM 814 N ASN A 55 -3.276 7.490 1.683 1.00 0.60 N ATOM 815 CA ASN A 55 -2.867 6.242 1.051 1.00 0.66 C ATOM 816 C ASN A 55 -3.542 6.060 -0.304 1.00 0.50 C ATOM 817 O ASN A 55 -4.498 6.766 -0.632 1.00 0.56 O ATOM 818 CB ASN A 55 -3.201 5.059 1.957 1.00 0.87 C ATOM 819 CG ASN A 55 -2.849 5.317 3.409 1.00 1.51 C ATOM 820 OD1 ASN A 55 -1.698 5.589 3.744 1.00 2.21 O ATOM 821 ND2 ASN A 55 -3.846 5.234 4.283 1.00 2.21 N ATOM 0 H ASN A 55 -4.270 7.707 1.604 1.00 0.60 H new ATOM 0 HA ASN A 55 -1.789 6.285 0.893 1.00 0.66 H new ATOM 0 HB2 ASN A 55 -4.265 4.836 1.879 1.00 0.87 H new ATOM 0 HB3 ASN A 55 -2.664 4.177 1.608 1.00 0.87 H new ATOM 0 HD21 ASN A 55 -3.670 5.399 5.274 1.00 2.21 H new ATOM 0 HD22 ASN A 55 -4.787 5.006 3.963 1.00 2.21 H new ATOM 828 N ALA A 56 -3.038 5.109 -1.087 1.00 0.50 N ATOM 829 CA ALA A 56 -3.591 4.835 -2.406 1.00 0.45 C ATOM 830 C ALA A 56 -3.212 3.440 -2.898 1.00 0.45 C ATOM 831 O ALA A 56 -2.185 2.884 -2.506 1.00 0.61 O ATOM 832 CB ALA A 56 -3.121 5.890 -3.398 1.00 0.58 C ATOM 0 H ALA A 56 -2.248 4.517 -0.829 1.00 0.50 H new ATOM 0 HA ALA A 56 -4.677 4.873 -2.327 1.00 0.45 H new ATOM 0 HB1 ALA A 56 -3.540 5.677 -4.382 1.00 0.58 H new ATOM 0 HB2 ALA A 56 -3.454 6.874 -3.068 1.00 0.58 H new ATOM 0 HB3 ALA A 56 -2.033 5.876 -3.456 1.00 0.58 H new ATOM 838 N ALA A 57 -4.055 2.890 -3.770 1.00 0.43 N ATOM 839 CA ALA A 57 -3.829 1.566 -4.337 1.00 0.47 C ATOM 840 C ALA A 57 -2.867 1.633 -5.502 1.00 0.40 C ATOM 841 O ALA A 57 -2.848 2.606 -6.257 1.00 0.44 O ATOM 842 CB ALA A 57 -5.140 0.945 -4.789 1.00 0.59 C ATOM 0 H ALA A 57 -4.906 3.346 -4.100 1.00 0.43 H new ATOM 0 HA ALA A 57 -3.391 0.942 -3.558 1.00 0.47 H new ATOM 0 HB1 ALA A 57 -4.949 -0.043 -5.209 1.00 0.59 H new ATOM 0 HB2 ALA A 57 -5.812 0.853 -3.936 1.00 0.59 H new ATOM 0 HB3 ALA A 57 -5.601 1.579 -5.547 1.00 0.59 H new ATOM 848 N VAL A 58 -2.072 0.583 -5.646 1.00 0.39 N ATOM 849 CA VAL A 58 -1.112 0.505 -6.717 1.00 0.39 C ATOM 850 C VAL A 58 -1.106 -0.884 -7.322 1.00 0.40 C ATOM 851 O VAL A 58 -1.127 -1.886 -6.614 1.00 0.60 O ATOM 852 CB VAL A 58 0.307 0.851 -6.233 1.00 0.49 C ATOM 853 CG1 VAL A 58 1.305 0.709 -7.370 1.00 1.11 C ATOM 854 CG2 VAL A 58 0.343 2.258 -5.656 1.00 1.22 C ATOM 0 H VAL A 58 -2.080 -0.227 -5.026 1.00 0.39 H new ATOM 0 HA VAL A 58 -1.409 1.234 -7.470 1.00 0.39 H new ATOM 0 HB VAL A 58 0.586 0.152 -5.445 1.00 0.49 H new ATOM 0 HG11 VAL A 58 2.304 0.957 -7.011 1.00 1.11 H new ATOM 0 HG12 VAL A 58 1.296 -0.318 -7.736 1.00 1.11 H new ATOM 0 HG13 VAL A 58 1.032 1.385 -8.180 1.00 1.11 H new ATOM 0 HG21 VAL A 58 1.354 2.487 -5.318 1.00 1.22 H new ATOM 0 HG22 VAL A 58 0.046 2.973 -6.423 1.00 1.22 H new ATOM 0 HG23 VAL A 58 -0.345 2.323 -4.813 1.00 1.22 H new ATOM 864 N ALA A 59 -1.056 -0.925 -8.636 1.00 0.34 N ATOM 865 CA ALA A 59 -1.019 -2.176 -9.365 1.00 0.36 C ATOM 866 C ALA A 59 0.046 -2.093 -10.440 1.00 0.37 C ATOM 867 O ALA A 59 -0.210 -1.653 -11.560 1.00 0.43 O ATOM 868 CB ALA A 59 -2.380 -2.486 -9.972 1.00 0.44 C ATOM 0 H ALA A 59 -1.040 -0.095 -9.228 1.00 0.34 H new ATOM 0 HA ALA A 59 -0.773 -2.987 -8.679 1.00 0.36 H new ATOM 0 HB1 ALA A 59 -2.330 -3.430 -10.515 1.00 0.44 H new ATOM 0 HB2 ALA A 59 -3.123 -2.563 -9.178 1.00 0.44 H new ATOM 0 HB3 ALA A 59 -2.663 -1.687 -10.658 1.00 0.44 H new ATOM 874 N LEU A 60 1.247 -2.504 -10.076 1.00 0.37 N ATOM 875 CA LEU A 60 2.379 -2.469 -10.985 1.00 0.45 C ATOM 876 C LEU A 60 2.870 -3.872 -11.308 1.00 0.39 C ATOM 877 O LEU A 60 2.863 -4.757 -10.453 1.00 0.38 O ATOM 878 CB LEU A 60 3.495 -1.613 -10.364 1.00 0.56 C ATOM 879 CG LEU A 60 4.938 -2.065 -10.622 1.00 0.48 C ATOM 880 CD1 LEU A 60 5.894 -0.914 -10.365 1.00 0.44 C ATOM 881 CD2 LEU A 60 5.304 -3.245 -9.733 1.00 0.98 C ATOM 0 H LEU A 60 1.465 -2.869 -9.149 1.00 0.37 H new ATOM 0 HA LEU A 60 2.068 -2.019 -11.928 1.00 0.45 H new ATOM 0 HB2 LEU A 60 3.387 -0.593 -10.734 1.00 0.56 H new ATOM 0 HB3 LEU A 60 3.337 -1.579 -9.286 1.00 0.56 H new ATOM 0 HG LEU A 60 5.018 -2.378 -11.663 1.00 0.48 H new ATOM 0 HD11 LEU A 60 6.917 -1.242 -10.550 1.00 0.44 H new ATOM 0 HD12 LEU A 60 5.653 -0.085 -11.031 1.00 0.44 H new ATOM 0 HD13 LEU A 60 5.800 -0.587 -9.329 1.00 0.44 H new ATOM 0 HD21 LEU A 60 6.332 -3.547 -9.934 1.00 0.98 H new ATOM 0 HD22 LEU A 60 5.209 -2.955 -8.686 1.00 0.98 H new ATOM 0 HD23 LEU A 60 4.633 -4.079 -9.941 1.00 0.98 H new ATOM 893 N GLU A 61 3.306 -4.064 -12.547 1.00 0.39 N ATOM 894 CA GLU A 61 3.815 -5.355 -12.978 1.00 0.38 C ATOM 895 C GLU A 61 5.282 -5.487 -12.609 1.00 0.36 C ATOM 896 O GLU A 61 6.154 -4.936 -13.283 1.00 0.38 O ATOM 897 CB GLU A 61 3.635 -5.530 -14.485 1.00 0.44 C ATOM 898 CG GLU A 61 2.190 -5.446 -14.930 1.00 1.08 C ATOM 899 CD GLU A 61 2.001 -5.814 -16.389 1.00 1.06 C ATOM 900 OE1 GLU A 61 2.598 -5.139 -17.254 1.00 1.24 O ATOM 901 OE2 GLU A 61 1.257 -6.778 -16.665 1.00 1.39 O ATOM 0 H GLU A 61 3.316 -3.342 -13.268 1.00 0.39 H new ATOM 0 HA GLU A 61 3.249 -6.136 -12.470 1.00 0.38 H new ATOM 0 HB2 GLU A 61 4.213 -4.765 -15.004 1.00 0.44 H new ATOM 0 HB3 GLU A 61 4.044 -6.495 -14.783 1.00 0.44 H new ATOM 0 HG2 GLU A 61 1.585 -6.109 -14.312 1.00 1.08 H new ATOM 0 HG3 GLU A 61 1.822 -4.433 -14.765 1.00 1.08 H new ATOM 908 N THR A 62 5.547 -6.213 -11.533 1.00 0.39 N ATOM 909 CA THR A 62 6.898 -6.413 -11.068 1.00 0.43 C ATOM 910 C THR A 62 7.460 -7.720 -11.586 1.00 0.39 C ATOM 911 O THR A 62 6.738 -8.576 -12.096 1.00 0.43 O ATOM 912 CB THR A 62 6.947 -6.403 -9.535 1.00 0.54 C ATOM 913 OG1 THR A 62 8.225 -6.798 -9.070 1.00 1.47 O ATOM 914 CG2 THR A 62 5.921 -7.311 -8.894 1.00 1.02 C ATOM 0 H THR A 62 4.834 -6.673 -10.967 1.00 0.39 H new ATOM 0 HA THR A 62 7.507 -5.594 -11.450 1.00 0.43 H new ATOM 0 HB THR A 62 6.724 -5.375 -9.248 1.00 0.54 H new ATOM 0 HG1 THR A 62 8.144 -7.168 -8.166 1.00 1.47 H new ATOM 0 HG21 THR A 62 6.012 -7.255 -7.809 1.00 1.02 H new ATOM 0 HG22 THR A 62 4.921 -6.996 -9.191 1.00 1.02 H new ATOM 0 HG23 THR A 62 6.090 -8.338 -9.219 1.00 1.02 H new ATOM 922 N SER A 63 8.754 -7.863 -11.413 1.00 0.40 N ATOM 923 CA SER A 63 9.469 -9.059 -11.811 1.00 0.44 C ATOM 924 C SER A 63 10.241 -9.532 -10.601 1.00 0.44 C ATOM 925 O SER A 63 10.753 -10.651 -10.541 1.00 0.64 O ATOM 926 CB SER A 63 10.404 -8.753 -12.977 1.00 0.56 C ATOM 927 OG SER A 63 9.672 -8.439 -14.150 1.00 1.23 O ATOM 0 H SER A 63 9.346 -7.149 -10.989 1.00 0.40 H new ATOM 0 HA SER A 63 8.783 -9.835 -12.150 1.00 0.44 H new ATOM 0 HB2 SER A 63 11.054 -7.918 -12.716 1.00 0.56 H new ATOM 0 HB3 SER A 63 11.048 -9.612 -13.166 1.00 0.56 H new ATOM 0 HG SER A 63 10.294 -8.245 -14.882 1.00 1.23 H new ATOM 933 N LEU A 64 10.274 -8.636 -9.628 1.00 0.39 N ATOM 934 CA LEU A 64 10.917 -8.849 -8.360 1.00 0.38 C ATOM 935 C LEU A 64 9.856 -8.936 -7.279 1.00 0.35 C ATOM 936 O LEU A 64 9.323 -7.910 -6.852 1.00 0.39 O ATOM 937 CB LEU A 64 11.864 -7.687 -8.067 1.00 0.42 C ATOM 938 CG LEU A 64 11.421 -6.329 -8.624 1.00 0.50 C ATOM 939 CD1 LEU A 64 12.075 -5.203 -7.845 1.00 0.78 C ATOM 940 CD2 LEU A 64 11.779 -6.216 -10.100 1.00 0.84 C ATOM 0 H LEU A 64 9.839 -7.717 -9.710 1.00 0.39 H new ATOM 0 HA LEU A 64 11.490 -9.776 -8.384 1.00 0.38 H new ATOM 0 HB2 LEU A 64 11.981 -7.598 -6.987 1.00 0.42 H new ATOM 0 HB3 LEU A 64 12.846 -7.927 -8.476 1.00 0.42 H new ATOM 0 HG LEU A 64 10.339 -6.250 -8.519 1.00 0.50 H new ATOM 0 HD11 LEU A 64 11.752 -4.244 -8.251 1.00 0.78 H new ATOM 0 HD12 LEU A 64 11.785 -5.270 -6.796 1.00 0.78 H new ATOM 0 HD13 LEU A 64 13.159 -5.285 -7.927 1.00 0.78 H new ATOM 0 HD21 LEU A 64 11.457 -5.246 -10.479 1.00 0.84 H new ATOM 0 HD22 LEU A 64 12.858 -6.313 -10.221 1.00 0.84 H new ATOM 0 HD23 LEU A 64 11.278 -7.008 -10.657 1.00 0.84 H new ATOM 952 N ALA A 65 9.537 -10.158 -6.856 1.00 0.38 N ATOM 953 CA ALA A 65 8.523 -10.377 -5.832 1.00 0.42 C ATOM 954 C ALA A 65 8.549 -9.257 -4.798 1.00 0.39 C ATOM 955 O ALA A 65 9.617 -8.735 -4.482 1.00 0.38 O ATOM 956 CB ALA A 65 8.735 -11.725 -5.157 1.00 0.52 C ATOM 0 H ALA A 65 9.969 -11.012 -7.209 1.00 0.38 H new ATOM 0 HA ALA A 65 7.545 -10.376 -6.313 1.00 0.42 H new ATOM 0 HB1 ALA A 65 7.970 -11.874 -4.395 1.00 0.52 H new ATOM 0 HB2 ALA A 65 8.666 -12.519 -5.901 1.00 0.52 H new ATOM 0 HB3 ALA A 65 9.720 -11.748 -4.692 1.00 0.52 H new ATOM 962 N PRO A 66 7.375 -8.863 -4.266 1.00 0.44 N ATOM 963 CA PRO A 66 7.266 -7.797 -3.271 1.00 0.47 C ATOM 964 C PRO A 66 8.438 -7.763 -2.311 1.00 0.45 C ATOM 965 O PRO A 66 8.810 -6.712 -1.813 1.00 0.49 O ATOM 966 CB PRO A 66 5.988 -8.167 -2.544 1.00 0.55 C ATOM 967 CG PRO A 66 5.127 -8.724 -3.617 1.00 0.57 C ATOM 968 CD PRO A 66 6.050 -9.419 -4.593 1.00 0.50 C ATOM 0 HA PRO A 66 7.261 -6.805 -3.722 1.00 0.47 H new ATOM 0 HB2 PRO A 66 6.172 -8.898 -1.757 1.00 0.55 H new ATOM 0 HB3 PRO A 66 5.529 -7.298 -2.072 1.00 0.55 H new ATOM 0 HG2 PRO A 66 4.399 -9.424 -3.206 1.00 0.57 H new ATOM 0 HG3 PRO A 66 4.564 -7.933 -4.112 1.00 0.57 H new ATOM 0 HD2 PRO A 66 6.026 -10.501 -4.467 1.00 0.50 H new ATOM 0 HD3 PRO A 66 5.771 -9.212 -5.626 1.00 0.50 H new ATOM 976 N GLU A 67 9.034 -8.915 -2.071 1.00 0.45 N ATOM 977 CA GLU A 67 10.178 -8.982 -1.195 1.00 0.49 C ATOM 978 C GLU A 67 11.209 -7.955 -1.658 1.00 0.44 C ATOM 979 O GLU A 67 11.604 -7.062 -0.906 1.00 0.47 O ATOM 980 CB GLU A 67 10.769 -10.391 -1.213 1.00 0.52 C ATOM 981 CG GLU A 67 9.740 -11.472 -0.926 1.00 0.71 C ATOM 982 CD GLU A 67 10.310 -12.870 -1.048 1.00 0.77 C ATOM 983 OE1 GLU A 67 11.261 -13.191 -0.307 1.00 1.06 O ATOM 984 OE2 GLU A 67 9.803 -13.645 -1.888 1.00 1.20 O ATOM 0 H GLU A 67 8.745 -9.809 -2.469 1.00 0.45 H new ATOM 0 HA GLU A 67 9.880 -8.756 -0.171 1.00 0.49 H new ATOM 0 HB2 GLU A 67 11.221 -10.577 -2.188 1.00 0.52 H new ATOM 0 HB3 GLU A 67 11.568 -10.453 -0.474 1.00 0.52 H new ATOM 0 HG2 GLU A 67 9.344 -11.332 0.080 1.00 0.71 H new ATOM 0 HG3 GLU A 67 8.903 -11.364 -1.616 1.00 0.71 H new ATOM 991 N GLU A 68 11.603 -8.080 -2.923 1.00 0.40 N ATOM 992 CA GLU A 68 12.559 -7.171 -3.544 1.00 0.39 C ATOM 993 C GLU A 68 11.936 -5.795 -3.755 1.00 0.35 C ATOM 994 O GLU A 68 12.452 -4.785 -3.275 1.00 0.40 O ATOM 995 CB GLU A 68 12.992 -7.725 -4.901 1.00 0.41 C ATOM 996 CG GLU A 68 13.313 -9.206 -4.882 1.00 0.97 C ATOM 997 CD GLU A 68 14.377 -9.563 -3.864 1.00 1.52 C ATOM 998 OE1 GLU A 68 15.501 -9.029 -3.967 1.00 1.90 O ATOM 999 OE2 GLU A 68 14.087 -10.379 -2.961 1.00 2.06 O ATOM 0 H GLU A 68 11.267 -8.815 -3.545 1.00 0.40 H new ATOM 0 HA GLU A 68 13.420 -7.079 -2.882 1.00 0.39 H new ATOM 0 HB2 GLU A 68 12.199 -7.544 -5.627 1.00 0.41 H new ATOM 0 HB3 GLU A 68 13.870 -7.177 -5.244 1.00 0.41 H new ATOM 0 HG2 GLU A 68 12.405 -9.767 -4.663 1.00 0.97 H new ATOM 0 HG3 GLU A 68 13.647 -9.514 -5.873 1.00 0.97 H new ATOM 1006 N LEU A 69 10.830 -5.775 -4.496 1.00 0.32 N ATOM 1007 CA LEU A 69 10.121 -4.538 -4.802 1.00 0.33 C ATOM 1008 C LEU A 69 9.943 -3.665 -3.558 1.00 0.34 C ATOM 1009 O LEU A 69 10.317 -2.493 -3.567 1.00 0.44 O ATOM 1010 CB LEU A 69 8.780 -4.858 -5.481 1.00 0.38 C ATOM 1011 CG LEU A 69 7.717 -3.752 -5.414 1.00 0.44 C ATOM 1012 CD1 LEU A 69 6.840 -3.789 -6.655 1.00 0.66 C ATOM 1013 CD2 LEU A 69 6.856 -3.899 -4.160 1.00 0.67 C ATOM 0 H LEU A 69 10.404 -6.610 -4.898 1.00 0.32 H new ATOM 0 HA LEU A 69 10.724 -3.955 -5.499 1.00 0.33 H new ATOM 0 HB2 LEU A 69 8.971 -5.090 -6.529 1.00 0.38 H new ATOM 0 HB3 LEU A 69 8.369 -5.759 -5.025 1.00 0.38 H new ATOM 0 HG LEU A 69 8.229 -2.791 -5.369 1.00 0.44 H new ATOM 0 HD11 LEU A 69 6.091 -3.000 -6.595 1.00 0.66 H new ATOM 0 HD12 LEU A 69 7.457 -3.637 -7.541 1.00 0.66 H new ATOM 0 HD13 LEU A 69 6.343 -4.757 -6.721 1.00 0.66 H new ATOM 0 HD21 LEU A 69 6.111 -3.104 -4.135 1.00 0.67 H new ATOM 0 HD22 LEU A 69 6.354 -4.867 -4.174 1.00 0.67 H new ATOM 0 HD23 LEU A 69 7.488 -3.831 -3.275 1.00 0.67 H new ATOM 1025 N LEU A 70 9.399 -4.240 -2.486 1.00 0.39 N ATOM 1026 CA LEU A 70 9.215 -3.500 -1.241 1.00 0.47 C ATOM 1027 C LEU A 70 10.507 -2.793 -0.867 1.00 0.44 C ATOM 1028 O LEU A 70 10.510 -1.598 -0.575 1.00 0.47 O ATOM 1029 CB LEU A 70 8.809 -4.435 -0.094 1.00 0.62 C ATOM 1030 CG LEU A 70 7.305 -4.572 0.166 1.00 0.99 C ATOM 1031 CD1 LEU A 70 6.594 -5.163 -1.036 1.00 1.48 C ATOM 1032 CD2 LEU A 70 7.062 -5.427 1.400 1.00 1.65 C ATOM 0 H LEU A 70 9.081 -5.209 -2.455 1.00 0.39 H new ATOM 0 HA LEU A 70 8.419 -2.772 -1.399 1.00 0.47 H new ATOM 0 HB2 LEU A 70 9.213 -5.426 -0.300 1.00 0.62 H new ATOM 0 HB3 LEU A 70 9.284 -4.081 0.821 1.00 0.62 H new ATOM 0 HG LEU A 70 6.898 -3.576 0.340 1.00 0.99 H new ATOM 0 HD11 LEU A 70 5.528 -5.249 -0.823 1.00 1.48 H new ATOM 0 HD12 LEU A 70 6.740 -4.515 -1.900 1.00 1.48 H new ATOM 0 HD13 LEU A 70 7.002 -6.151 -1.250 1.00 1.48 H new ATOM 0 HD21 LEU A 70 5.990 -5.517 1.575 1.00 1.65 H new ATOM 0 HD22 LEU A 70 7.489 -6.418 1.246 1.00 1.65 H new ATOM 0 HD23 LEU A 70 7.532 -4.960 2.265 1.00 1.65 H new ATOM 1044 N ASN A 71 11.604 -3.548 -0.878 1.00 0.46 N ATOM 1045 CA ASN A 71 12.917 -3.003 -0.537 1.00 0.50 C ATOM 1046 C ASN A 71 13.222 -1.705 -1.290 1.00 0.41 C ATOM 1047 O ASN A 71 13.771 -0.768 -0.712 1.00 0.44 O ATOM 1048 CB ASN A 71 14.012 -4.038 -0.801 1.00 0.59 C ATOM 1049 CG ASN A 71 14.133 -5.047 0.325 1.00 0.79 C ATOM 1050 OD1 ASN A 71 14.521 -4.701 1.441 1.00 1.59 O ATOM 1051 ND2 ASN A 71 13.783 -6.298 0.049 1.00 0.72 N ATOM 0 H ASN A 71 11.610 -4.539 -1.119 1.00 0.46 H new ATOM 0 HA ASN A 71 12.897 -2.764 0.526 1.00 0.50 H new ATOM 0 HB2 ASN A 71 13.798 -4.561 -1.733 1.00 0.59 H new ATOM 0 HB3 ASN A 71 14.966 -3.528 -0.934 1.00 0.59 H new ATOM 0 HD21 ASN A 71 13.830 -7.013 0.775 1.00 0.72 H new ATOM 0 HD22 ASN A 71 13.467 -6.544 -0.889 1.00 0.72 H new ATOM 1058 N HIS A 72 12.876 -1.647 -2.576 1.00 0.37 N ATOM 1059 CA HIS A 72 13.134 -0.451 -3.374 1.00 0.35 C ATOM 1060 C HIS A 72 12.303 0.735 -2.897 1.00 0.32 C ATOM 1061 O HIS A 72 12.844 1.735 -2.440 1.00 0.35 O ATOM 1062 CB HIS A 72 12.863 -0.731 -4.851 1.00 0.39 C ATOM 1063 CG HIS A 72 13.812 -1.725 -5.440 1.00 0.57 C ATOM 1064 ND1 HIS A 72 15.164 -1.486 -5.573 1.00 1.07 N ATOM 1065 CD2 HIS A 72 13.605 -2.973 -5.919 1.00 0.61 C ATOM 1066 CE1 HIS A 72 15.746 -2.545 -6.109 1.00 1.40 C ATOM 1067 NE2 HIS A 72 14.821 -3.461 -6.327 1.00 1.11 N ATOM 0 H HIS A 72 12.421 -2.407 -3.082 1.00 0.37 H new ATOM 0 HA HIS A 72 14.185 -0.189 -3.248 1.00 0.35 H new ATOM 0 HB2 HIS A 72 11.843 -1.099 -4.964 1.00 0.39 H new ATOM 0 HB3 HIS A 72 12.929 0.202 -5.410 1.00 0.39 H new ATOM 0 HD2 HIS A 72 12.658 -3.490 -5.971 1.00 0.61 H new ATOM 0 HE1 HIS A 72 16.798 -2.644 -6.331 1.00 1.40 H new ATOM 0 HE2 HIS A 72 14.984 -4.382 -6.733 1.00 1.11 H new ATOM 1076 N THR A 73 10.987 0.627 -3.008 1.00 0.34 N ATOM 1077 CA THR A 73 10.100 1.707 -2.587 1.00 0.38 C ATOM 1078 C THR A 73 10.430 2.180 -1.167 1.00 0.36 C ATOM 1079 O THR A 73 10.496 3.384 -0.897 1.00 0.36 O ATOM 1080 CB THR A 73 8.649 1.240 -2.667 1.00 0.47 C ATOM 1081 OG1 THR A 73 8.479 0.020 -1.968 1.00 0.77 O ATOM 1082 CG2 THR A 73 8.167 1.028 -4.085 1.00 0.61 C ATOM 0 H THR A 73 10.510 -0.192 -3.384 1.00 0.34 H new ATOM 0 HA THR A 73 10.246 2.553 -3.259 1.00 0.38 H new ATOM 0 HB THR A 73 8.061 2.040 -2.217 1.00 0.47 H new ATOM 0 HG1 THR A 73 7.638 -0.401 -2.244 1.00 0.77 H new ATOM 0 HG21 THR A 73 7.129 0.697 -4.071 1.00 0.61 H new ATOM 0 HG22 THR A 73 8.242 1.964 -4.638 1.00 0.61 H new ATOM 0 HG23 THR A 73 8.783 0.270 -4.569 1.00 0.61 H new ATOM 1090 N GLN A 74 10.632 1.227 -0.265 1.00 0.39 N ATOM 1091 CA GLN A 74 10.947 1.533 1.119 1.00 0.42 C ATOM 1092 C GLN A 74 12.335 2.146 1.251 1.00 0.41 C ATOM 1093 O GLN A 74 12.594 2.901 2.184 1.00 0.50 O ATOM 1094 CB GLN A 74 10.856 0.275 1.988 1.00 0.49 C ATOM 1095 CG GLN A 74 11.994 -0.708 1.776 1.00 1.45 C ATOM 1096 CD GLN A 74 11.939 -1.899 2.719 1.00 1.87 C ATOM 1097 OE1 GLN A 74 12.790 -2.786 2.661 1.00 2.25 O ATOM 1098 NE2 GLN A 74 10.938 -1.928 3.594 1.00 2.54 N ATOM 0 H GLN A 74 10.582 0.230 -0.473 1.00 0.39 H new ATOM 0 HA GLN A 74 10.213 2.261 1.465 1.00 0.42 H new ATOM 0 HB2 GLN A 74 10.837 0.571 3.037 1.00 0.49 H new ATOM 0 HB3 GLN A 74 9.912 -0.229 1.782 1.00 0.49 H new ATOM 0 HG2 GLN A 74 11.969 -1.066 0.747 1.00 1.45 H new ATOM 0 HG3 GLN A 74 12.943 -0.190 1.911 1.00 1.45 H new ATOM 0 HE21 GLN A 74 10.253 -1.173 3.610 1.00 2.54 H new ATOM 0 HE22 GLN A 74 10.856 -2.705 4.249 1.00 2.54 H new ATOM 1107 N ARG A 75 13.232 1.833 0.315 1.00 0.37 N ATOM 1108 CA ARG A 75 14.579 2.393 0.374 1.00 0.41 C ATOM 1109 C ARG A 75 14.463 3.904 0.311 1.00 0.39 C ATOM 1110 O ARG A 75 15.205 4.644 0.966 1.00 0.43 O ATOM 1111 CB ARG A 75 15.465 1.860 -0.765 1.00 0.48 C ATOM 1112 CG ARG A 75 15.425 2.691 -2.041 1.00 0.89 C ATOM 1113 CD ARG A 75 16.169 2.006 -3.178 1.00 0.88 C ATOM 1114 NE ARG A 75 17.571 1.754 -2.850 1.00 1.59 N ATOM 1115 CZ ARG A 75 18.460 2.714 -2.604 1.00 2.26 C ATOM 1116 NH1 ARG A 75 18.100 3.990 -2.659 1.00 2.72 N ATOM 1117 NH2 ARG A 75 19.713 2.398 -2.304 1.00 3.06 N ATOM 0 H ARG A 75 13.056 1.211 -0.474 1.00 0.37 H new ATOM 0 HA ARG A 75 15.058 2.092 1.305 1.00 0.41 H new ATOM 0 HB2 ARG A 75 16.495 1.809 -0.413 1.00 0.48 H new ATOM 0 HB3 ARG A 75 15.157 0.841 -1.001 1.00 0.48 H new ATOM 0 HG2 ARG A 75 14.389 2.861 -2.333 1.00 0.89 H new ATOM 0 HG3 ARG A 75 15.867 3.669 -1.853 1.00 0.89 H new ATOM 0 HD2 ARG A 75 15.678 1.062 -3.414 1.00 0.88 H new ATOM 0 HD3 ARG A 75 16.113 2.627 -4.072 1.00 0.88 H new ATOM 0 HE ARG A 75 17.887 0.785 -2.807 1.00 1.59 H new ATOM 0 HH11 ARG A 75 17.138 4.239 -2.891 1.00 2.72 H new ATOM 0 HH12 ARG A 75 18.785 4.722 -2.470 1.00 2.72 H new ATOM 0 HH21 ARG A 75 19.996 1.419 -2.262 1.00 3.06 H new ATOM 0 HH22 ARG A 75 20.394 3.134 -2.116 1.00 3.06 H new ATOM 1131 N ILE A 76 13.481 4.350 -0.463 1.00 0.38 N ATOM 1132 CA ILE A 76 13.210 5.760 -0.605 1.00 0.41 C ATOM 1133 C ILE A 76 12.806 6.343 0.734 1.00 0.42 C ATOM 1134 O ILE A 76 13.457 7.252 1.230 1.00 0.44 O ATOM 1135 CB ILE A 76 12.103 6.024 -1.639 1.00 0.45 C ATOM 1136 CG1 ILE A 76 12.499 5.444 -2.997 1.00 0.55 C ATOM 1137 CG2 ILE A 76 11.830 7.515 -1.755 1.00 0.50 C ATOM 1138 CD1 ILE A 76 13.766 6.041 -3.576 1.00 0.83 C ATOM 0 H ILE A 76 12.861 3.745 -1.001 1.00 0.38 H new ATOM 0 HA ILE A 76 14.122 6.241 -0.959 1.00 0.41 H new ATOM 0 HB ILE A 76 11.189 5.533 -1.305 1.00 0.45 H new ATOM 0 HG12 ILE A 76 12.630 4.367 -2.896 1.00 0.55 H new ATOM 0 HG13 ILE A 76 11.681 5.601 -3.700 1.00 0.55 H new ATOM 0 HG21 ILE A 76 11.044 7.685 -2.491 1.00 0.50 H new ATOM 0 HG22 ILE A 76 11.511 7.903 -0.788 1.00 0.50 H new ATOM 0 HG23 ILE A 76 12.739 8.028 -2.070 1.00 0.50 H new ATOM 0 HD11 ILE A 76 13.979 5.578 -4.539 1.00 0.83 H new ATOM 0 HD12 ILE A 76 13.634 7.114 -3.711 1.00 0.83 H new ATOM 0 HD13 ILE A 76 14.597 5.861 -2.895 1.00 0.83 H new ATOM 1150 N GLU A 77 11.738 5.808 1.326 1.00 0.44 N ATOM 1151 CA GLU A 77 11.272 6.296 2.622 1.00 0.47 C ATOM 1152 C GLU A 77 12.358 6.179 3.687 1.00 0.48 C ATOM 1153 O GLU A 77 12.336 6.899 4.682 1.00 0.54 O ATOM 1154 CB GLU A 77 9.998 5.569 3.065 1.00 0.50 C ATOM 1155 CG GLU A 77 10.108 4.055 3.117 1.00 0.66 C ATOM 1156 CD GLU A 77 10.834 3.540 4.347 1.00 0.97 C ATOM 1157 OE1 GLU A 77 11.137 4.359 5.240 1.00 1.43 O ATOM 1158 OE2 GLU A 77 11.114 2.326 4.412 1.00 1.32 O ATOM 0 H GLU A 77 11.185 5.046 0.934 1.00 0.44 H new ATOM 0 HA GLU A 77 11.034 7.353 2.502 1.00 0.47 H new ATOM 0 HB2 GLU A 77 9.716 5.932 4.053 1.00 0.50 H new ATOM 0 HB3 GLU A 77 9.190 5.836 2.384 1.00 0.50 H new ATOM 0 HG2 GLU A 77 9.107 3.625 3.090 1.00 0.66 H new ATOM 0 HG3 GLU A 77 10.629 3.706 2.225 1.00 0.66 H new ATOM 1165 N LEU A 78 13.322 5.289 3.472 1.00 0.45 N ATOM 1166 CA LEU A 78 14.412 5.135 4.425 1.00 0.49 C ATOM 1167 C LEU A 78 15.209 6.429 4.485 1.00 0.49 C ATOM 1168 O LEU A 78 15.720 6.814 5.537 1.00 0.59 O ATOM 1169 CB LEU A 78 15.329 3.967 4.039 1.00 0.53 C ATOM 1170 CG LEU A 78 14.721 2.571 4.211 1.00 0.88 C ATOM 1171 CD1 LEU A 78 15.708 1.503 3.766 1.00 1.66 C ATOM 1172 CD2 LEU A 78 14.307 2.341 5.658 1.00 1.52 C ATOM 0 H LEU A 78 13.370 4.674 2.660 1.00 0.45 H new ATOM 0 HA LEU A 78 13.990 4.914 5.405 1.00 0.49 H new ATOM 0 HB2 LEU A 78 15.627 4.090 2.998 1.00 0.53 H new ATOM 0 HB3 LEU A 78 16.237 4.026 4.639 1.00 0.53 H new ATOM 0 HG LEU A 78 13.832 2.505 3.584 1.00 0.88 H new ATOM 0 HD11 LEU A 78 15.260 0.518 3.895 1.00 1.66 H new ATOM 0 HD12 LEU A 78 15.958 1.654 2.716 1.00 1.66 H new ATOM 0 HD13 LEU A 78 16.614 1.571 4.368 1.00 1.66 H new ATOM 0 HD21 LEU A 78 13.878 1.344 5.760 1.00 1.52 H new ATOM 0 HD22 LEU A 78 15.180 2.427 6.304 1.00 1.52 H new ATOM 0 HD23 LEU A 78 13.566 3.086 5.947 1.00 1.52 H new ATOM 1184 N GLN A 79 15.297 7.098 3.340 1.00 0.47 N ATOM 1185 CA GLN A 79 16.020 8.360 3.239 1.00 0.52 C ATOM 1186 C GLN A 79 15.105 9.492 2.756 1.00 0.53 C ATOM 1187 O GLN A 79 15.564 10.609 2.512 1.00 0.72 O ATOM 1188 CB GLN A 79 17.204 8.202 2.283 1.00 0.63 C ATOM 1189 CG GLN A 79 16.797 7.718 0.897 1.00 1.12 C ATOM 1190 CD GLN A 79 17.982 7.482 -0.028 1.00 1.67 C ATOM 1191 OE1 GLN A 79 17.806 7.121 -1.191 1.00 2.24 O ATOM 1192 NE2 GLN A 79 19.195 7.676 0.482 1.00 2.32 N ATOM 0 H GLN A 79 14.875 6.785 2.466 1.00 0.47 H new ATOM 0 HA GLN A 79 16.384 8.623 4.232 1.00 0.52 H new ATOM 0 HB2 GLN A 79 17.718 9.159 2.190 1.00 0.63 H new ATOM 0 HB3 GLN A 79 17.917 7.498 2.712 1.00 0.63 H new ATOM 0 HG2 GLN A 79 16.231 6.792 0.995 1.00 1.12 H new ATOM 0 HG3 GLN A 79 16.131 8.453 0.444 1.00 1.12 H new ATOM 0 HE21 GLN A 79 19.299 7.976 1.451 1.00 2.32 H new ATOM 0 HE22 GLN A 79 20.022 7.525 -0.096 1.00 2.32 H new ATOM 1201 N GLN A 80 13.816 9.193 2.606 1.00 0.61 N ATOM 1202 CA GLN A 80 12.843 10.184 2.137 1.00 0.72 C ATOM 1203 C GLN A 80 11.648 10.305 3.078 1.00 0.88 C ATOM 1204 O GLN A 80 10.966 11.332 3.093 1.00 1.15 O ATOM 1205 CB GLN A 80 12.359 9.831 0.728 1.00 0.74 C ATOM 1206 CG GLN A 80 13.420 10.023 -0.345 1.00 1.27 C ATOM 1207 CD GLN A 80 13.855 11.469 -0.490 1.00 1.51 C ATOM 1208 OE1 GLN A 80 14.396 12.066 0.440 1.00 2.00 O ATOM 1209 NE2 GLN A 80 13.619 12.041 -1.665 1.00 2.07 N ATOM 0 H GLN A 80 13.419 8.274 2.802 1.00 0.61 H new ATOM 0 HA GLN A 80 13.351 11.148 2.118 1.00 0.72 H new ATOM 0 HB2 GLN A 80 12.026 8.793 0.716 1.00 0.74 H new ATOM 0 HB3 GLN A 80 11.493 10.447 0.485 1.00 0.74 H new ATOM 0 HG2 GLN A 80 14.288 9.410 -0.105 1.00 1.27 H new ATOM 0 HG3 GLN A 80 13.033 9.667 -1.300 1.00 1.27 H new ATOM 0 HE21 GLN A 80 13.168 11.509 -2.410 1.00 2.07 H new ATOM 0 HE22 GLN A 80 13.889 13.012 -1.823 1.00 2.07 H new ATOM 1218 N GLY A 81 11.388 9.254 3.851 1.00 0.99 N ATOM 1219 CA GLY A 81 10.264 9.266 4.774 1.00 1.25 C ATOM 1220 C GLY A 81 10.320 10.418 5.762 1.00 1.79 C ATOM 1221 O GLY A 81 9.387 10.618 6.540 1.00 2.18 O ATOM 0 H GLY A 81 11.935 8.393 3.855 1.00 0.99 H new ATOM 0 HA2 GLY A 81 9.335 9.326 4.206 1.00 1.25 H new ATOM 0 HA3 GLY A 81 10.242 8.325 5.323 1.00 1.25 H new ATOM 1429 N THR A 93 7.234 8.262 7.814 1.00 1.14 N ATOM 1430 CA THR A 93 7.614 6.928 7.363 1.00 1.33 C ATOM 1431 C THR A 93 6.614 6.397 6.348 1.00 1.11 C ATOM 1432 O THR A 93 5.454 6.808 6.323 1.00 1.61 O ATOM 1433 CB THR A 93 7.752 5.955 8.542 1.00 1.94 C ATOM 1434 OG1 THR A 93 8.695 6.439 9.482 1.00 2.57 O ATOM 1435 CG2 THR A 93 8.191 4.566 8.130 1.00 2.58 C ATOM 0 HA THR A 93 8.588 7.009 6.881 1.00 1.33 H new ATOM 0 HB THR A 93 6.754 5.888 8.976 1.00 1.94 H new ATOM 0 HG1 THR A 93 8.719 7.418 9.447 1.00 2.57 H new ATOM 0 HG21 THR A 93 8.268 3.932 9.013 1.00 2.58 H new ATOM 0 HG22 THR A 93 7.460 4.143 7.442 1.00 2.58 H new ATOM 0 HG23 THR A 93 9.162 4.622 7.638 1.00 2.58 H new ATOM 1443 N LEU A 94 7.086 5.499 5.496 1.00 0.80 N ATOM 1444 CA LEU A 94 6.259 4.920 4.453 1.00 0.54 C ATOM 1445 C LEU A 94 6.166 3.404 4.625 1.00 0.52 C ATOM 1446 O LEU A 94 7.100 2.770 5.116 1.00 0.65 O ATOM 1447 CB LEU A 94 6.867 5.277 3.100 1.00 0.48 C ATOM 1448 CG LEU A 94 5.885 5.529 1.961 1.00 0.52 C ATOM 1449 CD1 LEU A 94 6.643 5.996 0.732 1.00 1.39 C ATOM 1450 CD2 LEU A 94 5.075 4.281 1.648 1.00 1.37 C ATOM 0 H LEU A 94 8.046 5.155 5.509 1.00 0.80 H new ATOM 0 HA LEU A 94 5.247 5.320 4.515 1.00 0.54 H new ATOM 0 HB2 LEU A 94 7.481 6.169 3.226 1.00 0.48 H new ATOM 0 HB3 LEU A 94 7.536 4.469 2.802 1.00 0.48 H new ATOM 0 HG LEU A 94 5.185 6.306 2.269 1.00 0.52 H new ATOM 0 HD11 LEU A 94 5.941 6.176 -0.082 1.00 1.39 H new ATOM 0 HD12 LEU A 94 7.176 6.918 0.962 1.00 1.39 H new ATOM 0 HD13 LEU A 94 7.357 5.229 0.432 1.00 1.39 H new ATOM 0 HD21 LEU A 94 4.384 4.491 0.832 1.00 1.37 H new ATOM 0 HD22 LEU A 94 5.748 3.475 1.355 1.00 1.37 H new ATOM 0 HD23 LEU A 94 4.512 3.981 2.532 1.00 1.37 H new ATOM 1462 N ASP A 95 5.036 2.832 4.229 1.00 0.49 N ATOM 1463 CA ASP A 95 4.821 1.395 4.352 1.00 0.56 C ATOM 1464 C ASP A 95 4.375 0.789 3.025 1.00 0.48 C ATOM 1465 O ASP A 95 3.286 1.082 2.532 1.00 0.65 O ATOM 1466 CB ASP A 95 3.775 1.112 5.432 1.00 0.87 C ATOM 1467 CG ASP A 95 4.209 1.604 6.798 1.00 1.51 C ATOM 1468 OD1 ASP A 95 5.251 1.128 7.297 1.00 1.92 O ATOM 1469 OD2 ASP A 95 3.509 2.466 7.368 1.00 2.19 O ATOM 0 H ASP A 95 4.253 3.342 3.819 1.00 0.49 H new ATOM 0 HA ASP A 95 5.767 0.934 4.636 1.00 0.56 H new ATOM 0 HB2 ASP A 95 2.835 1.591 5.158 1.00 0.87 H new ATOM 0 HB3 ASP A 95 3.585 0.040 5.478 1.00 0.87 H new ATOM 1474 N LEU A 96 5.231 -0.051 2.450 1.00 0.48 N ATOM 1475 CA LEU A 96 4.931 -0.696 1.176 1.00 0.63 C ATOM 1476 C LEU A 96 4.712 -2.191 1.357 1.00 0.60 C ATOM 1477 O LEU A 96 5.580 -2.893 1.871 1.00 0.76 O ATOM 1478 CB LEU A 96 6.071 -0.472 0.180 1.00 0.97 C ATOM 1479 CG LEU A 96 6.402 0.988 -0.137 1.00 0.98 C ATOM 1480 CD1 LEU A 96 5.156 1.744 -0.572 1.00 1.91 C ATOM 1481 CD2 LEU A 96 7.066 1.666 1.053 1.00 2.04 C ATOM 0 H LEU A 96 6.137 -0.301 2.846 1.00 0.48 H new ATOM 0 HA LEU A 96 4.015 -0.249 0.789 1.00 0.63 H new ATOM 0 HB2 LEU A 96 6.969 -0.952 0.570 1.00 0.97 H new ATOM 0 HB3 LEU A 96 5.819 -0.978 -0.752 1.00 0.97 H new ATOM 0 HG LEU A 96 7.109 1.002 -0.966 1.00 0.98 H new ATOM 0 HD11 LEU A 96 5.417 2.779 -0.792 1.00 1.91 H new ATOM 0 HD12 LEU A 96 4.740 1.277 -1.465 1.00 1.91 H new ATOM 0 HD13 LEU A 96 4.417 1.718 0.229 1.00 1.91 H new ATOM 0 HD21 LEU A 96 7.291 2.703 0.802 1.00 2.04 H new ATOM 0 HD22 LEU A 96 6.393 1.638 1.910 1.00 2.04 H new ATOM 0 HD23 LEU A 96 7.990 1.144 1.300 1.00 2.04 H new ATOM 1493 N ASP A 97 3.550 -2.676 0.930 1.00 0.55 N ATOM 1494 CA ASP A 97 3.225 -4.095 1.041 1.00 0.62 C ATOM 1495 C ASP A 97 2.327 -4.545 -0.104 1.00 0.56 C ATOM 1496 O ASP A 97 1.152 -4.175 -0.161 1.00 0.70 O ATOM 1497 CB ASP A 97 2.534 -4.390 2.377 1.00 0.79 C ATOM 1498 CG ASP A 97 3.394 -4.052 3.579 1.00 1.45 C ATOM 1499 OD1 ASP A 97 3.670 -2.854 3.797 1.00 1.98 O ATOM 1500 OD2 ASP A 97 3.791 -4.987 4.305 1.00 2.17 O ATOM 0 H ASP A 97 2.818 -2.108 0.504 1.00 0.55 H new ATOM 0 HA ASP A 97 4.162 -4.650 0.991 1.00 0.62 H new ATOM 0 HB2 ASP A 97 1.605 -3.823 2.432 1.00 0.79 H new ATOM 0 HB3 ASP A 97 2.266 -5.446 2.415 1.00 0.79 H new ATOM 1505 N ILE A 98 2.870 -5.359 -1.005 1.00 0.69 N ATOM 1506 CA ILE A 98 2.088 -5.865 -2.125 1.00 0.63 C ATOM 1507 C ILE A 98 1.210 -7.028 -1.683 1.00 0.67 C ATOM 1508 O ILE A 98 1.708 -8.066 -1.250 1.00 0.93 O ATOM 1509 CB ILE A 98 2.967 -6.337 -3.297 1.00 0.74 C ATOM 1510 CG1 ILE A 98 3.606 -5.158 -4.023 1.00 1.91 C ATOM 1511 CG2 ILE A 98 2.155 -7.179 -4.265 1.00 1.40 C ATOM 1512 CD1 ILE A 98 4.367 -5.567 -5.268 1.00 2.73 C ATOM 0 H ILE A 98 3.838 -5.679 -0.981 1.00 0.69 H new ATOM 0 HA ILE A 98 1.475 -5.031 -2.468 1.00 0.63 H new ATOM 0 HB ILE A 98 3.769 -6.950 -2.886 1.00 0.74 H new ATOM 0 HG12 ILE A 98 2.829 -4.444 -4.297 1.00 1.91 H new ATOM 0 HG13 ILE A 98 4.285 -4.645 -3.342 1.00 1.91 H new ATOM 0 HG21 ILE A 98 2.792 -7.504 -5.087 1.00 1.40 H new ATOM 0 HG22 ILE A 98 1.760 -8.052 -3.745 1.00 1.40 H new ATOM 0 HG23 ILE A 98 1.329 -6.586 -4.658 1.00 1.40 H new ATOM 0 HD11 ILE A 98 4.797 -4.683 -5.738 1.00 2.73 H new ATOM 0 HD12 ILE A 98 5.165 -6.258 -4.996 1.00 2.73 H new ATOM 0 HD13 ILE A 98 3.687 -6.055 -5.966 1.00 2.73 H new ATOM 1524 N MET A 99 -0.094 -6.838 -1.786 1.00 0.53 N ATOM 1525 CA MET A 99 -1.047 -7.864 -1.390 1.00 0.63 C ATOM 1526 C MET A 99 -1.183 -8.979 -2.433 1.00 0.63 C ATOM 1527 O MET A 99 -1.494 -10.114 -2.077 1.00 0.87 O ATOM 1528 CB MET A 99 -2.410 -7.236 -1.123 1.00 0.70 C ATOM 1529 CG MET A 99 -2.427 -6.240 0.032 1.00 0.93 C ATOM 1530 SD MET A 99 -2.202 -7.012 1.651 1.00 1.77 S ATOM 1531 CE MET A 99 -0.430 -7.275 1.692 1.00 2.48 C ATOM 0 H MET A 99 -0.519 -5.981 -2.141 1.00 0.53 H new ATOM 0 HA MET A 99 -0.662 -8.321 -0.478 1.00 0.63 H new ATOM 0 HB2 MET A 99 -2.748 -6.731 -2.028 1.00 0.70 H new ATOM 0 HB3 MET A 99 -3.128 -8.029 -0.914 1.00 0.70 H new ATOM 0 HG2 MET A 99 -1.640 -5.502 -0.123 1.00 0.93 H new ATOM 0 HG3 MET A 99 -3.375 -5.701 0.023 1.00 0.93 H new ATOM 0 HE1 MET A 99 -0.215 -8.332 1.533 1.00 2.48 H new ATOM 0 HE2 MET A 99 0.044 -6.686 0.907 1.00 2.48 H new ATOM 0 HE3 MET A 99 -0.039 -6.968 2.662 1.00 2.48 H new ATOM 1541 N LEU A 100 -0.966 -8.668 -3.714 1.00 0.51 N ATOM 1542 CA LEU A 100 -1.094 -9.697 -4.758 1.00 0.55 C ATOM 1543 C LEU A 100 0.107 -9.737 -5.700 1.00 0.54 C ATOM 1544 O LEU A 100 0.717 -8.716 -5.989 1.00 0.76 O ATOM 1545 CB LEU A 100 -2.372 -9.498 -5.575 1.00 0.75 C ATOM 1546 CG LEU A 100 -3.674 -9.829 -4.844 1.00 1.12 C ATOM 1547 CD1 LEU A 100 -4.111 -8.671 -3.960 1.00 1.87 C ATOM 1548 CD2 LEU A 100 -4.760 -10.194 -5.842 1.00 1.69 C ATOM 0 H LEU A 100 -0.708 -7.740 -4.050 1.00 0.51 H new ATOM 0 HA LEU A 100 -1.139 -10.651 -4.233 1.00 0.55 H new ATOM 0 HB2 LEU A 100 -2.414 -8.460 -5.906 1.00 0.75 H new ATOM 0 HB3 LEU A 100 -2.311 -10.116 -6.471 1.00 0.75 H new ATOM 0 HG LEU A 100 -3.498 -10.689 -4.198 1.00 1.12 H new ATOM 0 HD11 LEU A 100 -5.039 -8.932 -3.451 1.00 1.87 H new ATOM 0 HD12 LEU A 100 -3.337 -8.466 -3.220 1.00 1.87 H new ATOM 0 HD13 LEU A 100 -4.270 -7.785 -4.574 1.00 1.87 H new ATOM 0 HD21 LEU A 100 -5.681 -10.427 -5.308 1.00 1.69 H new ATOM 0 HD22 LEU A 100 -4.933 -9.354 -6.515 1.00 1.69 H new ATOM 0 HD23 LEU A 100 -4.446 -11.063 -6.420 1.00 1.69 H new ATOM 1560 N PHE A 101 0.422 -10.934 -6.190 1.00 0.46 N ATOM 1561 CA PHE A 101 1.538 -11.128 -7.113 1.00 0.46 C ATOM 1562 C PHE A 101 1.051 -11.767 -8.413 1.00 0.51 C ATOM 1563 O PHE A 101 1.161 -12.978 -8.603 1.00 0.58 O ATOM 1564 CB PHE A 101 2.608 -12.010 -6.464 1.00 0.45 C ATOM 1565 CG PHE A 101 3.842 -12.190 -7.303 1.00 0.51 C ATOM 1566 CD1 PHE A 101 4.560 -11.092 -7.747 1.00 0.56 C ATOM 1567 CD2 PHE A 101 4.284 -13.459 -7.648 1.00 0.58 C ATOM 1568 CE1 PHE A 101 5.694 -11.254 -8.520 1.00 0.65 C ATOM 1569 CE2 PHE A 101 5.416 -13.627 -8.422 1.00 0.68 C ATOM 1570 CZ PHE A 101 6.127 -12.530 -8.852 1.00 0.71 C ATOM 0 H PHE A 101 -0.084 -11.790 -5.961 1.00 0.46 H new ATOM 0 HA PHE A 101 1.971 -10.155 -7.344 1.00 0.46 H new ATOM 0 HB2 PHE A 101 2.892 -11.574 -5.506 1.00 0.45 H new ATOM 0 HB3 PHE A 101 2.178 -12.989 -6.253 1.00 0.45 H new ATOM 0 HD1 PHE A 101 4.230 -10.097 -7.486 1.00 0.56 H new ATOM 0 HD2 PHE A 101 3.737 -14.326 -7.308 1.00 0.58 H new ATOM 0 HE1 PHE A 101 6.242 -10.390 -8.865 1.00 0.65 H new ATOM 0 HE2 PHE A 101 5.743 -14.621 -8.690 1.00 0.68 H new ATOM 0 HZ PHE A 101 7.019 -12.662 -9.446 1.00 0.71 H new ATOM 1580 N GLY A 102 0.494 -10.942 -9.296 1.00 0.54 N ATOM 1581 CA GLY A 102 -0.022 -11.432 -10.560 1.00 0.65 C ATOM 1582 C GLY A 102 -1.463 -11.872 -10.434 1.00 0.67 C ATOM 1583 O GLY A 102 -2.245 -11.721 -11.371 1.00 0.99 O ATOM 0 H GLY A 102 0.391 -9.937 -9.156 1.00 0.54 H new ATOM 0 HA2 GLY A 102 0.056 -10.649 -11.315 1.00 0.65 H new ATOM 0 HA3 GLY A 102 0.587 -12.268 -10.904 1.00 0.65 H new ATOM 1587 N ASN A 103 -1.774 -12.431 -9.258 1.00 0.58 N ATOM 1588 CA ASN A 103 -3.099 -12.950 -8.899 1.00 0.64 C ATOM 1589 C ASN A 103 -2.981 -14.452 -8.744 1.00 0.71 C ATOM 1590 O ASN A 103 -3.966 -15.185 -8.731 1.00 1.08 O ATOM 1591 CB ASN A 103 -4.189 -12.599 -9.924 1.00 0.78 C ATOM 1592 CG ASN A 103 -5.588 -12.853 -9.393 1.00 1.18 C ATOM 1593 OD1 ASN A 103 -6.567 -12.771 -10.135 1.00 2.12 O ATOM 1594 ND2 ASN A 103 -5.691 -13.143 -8.099 1.00 1.38 N ATOM 0 H ASN A 103 -1.091 -12.538 -8.508 1.00 0.58 H new ATOM 0 HA ASN A 103 -3.412 -12.478 -7.967 1.00 0.64 H new ATOM 0 HB2 ASN A 103 -4.095 -11.550 -10.205 1.00 0.78 H new ATOM 0 HB3 ASN A 103 -4.035 -13.186 -10.829 1.00 0.78 H new ATOM 0 HD21 ASN A 103 -6.608 -13.308 -7.685 1.00 1.38 H new ATOM 0 HD22 ASN A 103 -4.853 -13.201 -7.521 1.00 1.38 H new ATOM 1601 N GLU A 104 -1.734 -14.884 -8.619 1.00 0.53 N ATOM 1602 CA GLU A 104 -1.397 -16.281 -8.452 1.00 0.61 C ATOM 1603 C GLU A 104 -1.526 -16.652 -6.981 1.00 0.64 C ATOM 1604 O GLU A 104 -1.867 -15.804 -6.168 1.00 0.84 O ATOM 1605 CB GLU A 104 0.040 -16.476 -8.935 1.00 0.70 C ATOM 1606 CG GLU A 104 0.481 -17.922 -9.017 1.00 1.16 C ATOM 1607 CD GLU A 104 -0.300 -18.727 -10.040 1.00 1.28 C ATOM 1608 OE1 GLU A 104 -1.160 -18.137 -10.725 1.00 1.87 O ATOM 1609 OE2 GLU A 104 -0.056 -19.948 -10.150 1.00 1.79 O ATOM 0 H GLU A 104 -0.924 -14.264 -8.631 1.00 0.53 H new ATOM 0 HA GLU A 104 -2.067 -16.920 -9.027 1.00 0.61 H new ATOM 0 HB2 GLU A 104 0.144 -16.021 -9.920 1.00 0.70 H new ATOM 0 HB3 GLU A 104 0.712 -15.941 -8.264 1.00 0.70 H new ATOM 0 HG2 GLU A 104 1.541 -17.958 -9.268 1.00 1.16 H new ATOM 0 HG3 GLU A 104 0.369 -18.386 -8.037 1.00 1.16 H new ATOM 1616 N VAL A 105 -1.239 -17.894 -6.616 1.00 0.62 N ATOM 1617 CA VAL A 105 -1.321 -18.273 -5.214 1.00 0.66 C ATOM 1618 C VAL A 105 0.081 -18.516 -4.665 1.00 0.70 C ATOM 1619 O VAL A 105 0.587 -19.637 -4.631 1.00 0.83 O ATOM 1620 CB VAL A 105 -2.232 -19.501 -4.975 1.00 0.75 C ATOM 1621 CG1 VAL A 105 -3.611 -19.264 -5.571 1.00 1.18 C ATOM 1622 CG2 VAL A 105 -1.616 -20.773 -5.531 1.00 0.95 C ATOM 0 H VAL A 105 -0.955 -18.638 -7.253 1.00 0.62 H new ATOM 0 HA VAL A 105 -1.784 -17.445 -4.677 1.00 0.66 H new ATOM 0 HB VAL A 105 -2.335 -19.633 -3.898 1.00 0.75 H new ATOM 0 HG11 VAL A 105 -4.239 -20.137 -5.394 1.00 1.18 H new ATOM 0 HG12 VAL A 105 -4.064 -18.390 -5.103 1.00 1.18 H new ATOM 0 HG13 VAL A 105 -3.519 -19.094 -6.644 1.00 1.18 H new ATOM 0 HG21 VAL A 105 -2.285 -21.613 -5.344 1.00 0.95 H new ATOM 0 HG22 VAL A 105 -1.462 -20.664 -6.605 1.00 0.95 H new ATOM 0 HG23 VAL A 105 -0.658 -20.956 -5.044 1.00 0.95 H new ATOM 1632 N ILE A 106 0.710 -17.433 -4.251 1.00 0.65 N ATOM 1633 CA ILE A 106 2.056 -17.489 -3.719 1.00 0.72 C ATOM 1634 C ILE A 106 2.065 -17.017 -2.272 1.00 0.77 C ATOM 1635 O ILE A 106 1.958 -15.824 -1.985 1.00 0.84 O ATOM 1636 CB ILE A 106 2.999 -16.641 -4.594 1.00 0.81 C ATOM 1637 CG1 ILE A 106 4.438 -16.723 -4.107 1.00 0.76 C ATOM 1638 CG2 ILE A 106 2.541 -15.192 -4.647 1.00 1.33 C ATOM 1639 CD1 ILE A 106 5.390 -16.021 -5.042 1.00 0.76 C ATOM 0 H ILE A 106 0.306 -16.497 -4.274 1.00 0.65 H new ATOM 0 HA ILE A 106 2.413 -18.519 -3.737 1.00 0.72 H new ATOM 0 HB ILE A 106 2.960 -17.053 -5.602 1.00 0.81 H new ATOM 0 HG12 ILE A 106 4.511 -16.279 -3.114 1.00 0.76 H new ATOM 0 HG13 ILE A 106 4.729 -17.769 -4.011 1.00 0.76 H new ATOM 0 HG21 ILE A 106 3.225 -14.617 -5.271 1.00 1.33 H new ATOM 0 HG22 ILE A 106 1.537 -15.143 -5.068 1.00 1.33 H new ATOM 0 HG23 ILE A 106 2.533 -14.776 -3.640 1.00 1.33 H new ATOM 0 HD11 ILE A 106 6.406 -16.104 -4.656 1.00 0.76 H new ATOM 0 HD12 ILE A 106 5.337 -16.482 -6.028 1.00 0.76 H new ATOM 0 HD13 ILE A 106 5.116 -14.969 -5.118 1.00 0.76 H new ATOM 1651 N ASN A 107 2.145 -17.972 -1.355 1.00 0.80 N ATOM 1652 CA ASN A 107 2.117 -17.661 0.065 1.00 0.91 C ATOM 1653 C ASN A 107 3.475 -17.880 0.715 1.00 0.92 C ATOM 1654 O ASN A 107 4.118 -18.909 0.513 1.00 1.03 O ATOM 1655 CB ASN A 107 1.060 -18.519 0.752 1.00 1.00 C ATOM 1656 CG ASN A 107 -0.121 -18.789 -0.155 1.00 1.11 C ATOM 1657 OD1 ASN A 107 -0.019 -19.551 -1.116 1.00 1.79 O ATOM 1658 ND2 ASN A 107 -1.241 -18.147 0.130 1.00 1.12 N ATOM 0 H ASN A 107 2.230 -18.966 -1.570 1.00 0.80 H new ATOM 0 HA ASN A 107 1.866 -16.606 0.178 1.00 0.91 H new ATOM 0 HB2 ASN A 107 1.505 -19.465 1.061 1.00 1.00 H new ATOM 0 HB3 ASN A 107 0.716 -18.017 1.657 1.00 1.00 H new ATOM 0 HD21 ASN A 107 -2.065 -18.274 -0.457 1.00 1.12 H new ATOM 0 HD22 ASN A 107 -1.281 -17.525 0.937 1.00 1.12 H new ATOM 1665 N THR A 108 3.894 -16.898 1.505 1.00 0.92 N ATOM 1666 CA THR A 108 5.174 -16.958 2.208 1.00 1.01 C ATOM 1667 C THR A 108 5.139 -16.109 3.481 1.00 1.15 C ATOM 1668 O THR A 108 4.805 -16.604 4.557 1.00 1.79 O ATOM 1669 CB THR A 108 6.314 -16.485 1.295 1.00 1.00 C ATOM 1670 OG1 THR A 108 6.010 -15.231 0.716 1.00 1.66 O ATOM 1671 CG2 THR A 108 6.631 -17.447 0.169 1.00 1.26 C ATOM 0 H THR A 108 3.363 -16.044 1.677 1.00 0.92 H new ATOM 0 HA THR A 108 5.353 -17.996 2.488 1.00 1.01 H new ATOM 0 HB THR A 108 7.186 -16.419 1.946 1.00 1.00 H new ATOM 0 HG1 THR A 108 5.147 -15.284 0.255 1.00 1.66 H new ATOM 0 HG21 THR A 108 7.446 -17.046 -0.434 1.00 1.26 H new ATOM 0 HG22 THR A 108 6.927 -18.410 0.586 1.00 1.26 H new ATOM 0 HG23 THR A 108 5.748 -17.579 -0.456 1.00 1.26 H new ATOM 1679 N GLU A 109 5.481 -14.829 3.345 1.00 0.95 N ATOM 1680 CA GLU A 109 5.488 -13.906 4.476 1.00 1.05 C ATOM 1681 C GLU A 109 5.562 -12.463 3.985 1.00 1.06 C ATOM 1682 O GLU A 109 4.790 -11.608 4.419 1.00 1.32 O ATOM 1683 CB GLU A 109 6.660 -14.214 5.412 1.00 1.20 C ATOM 1684 CG GLU A 109 8.016 -14.192 4.727 1.00 1.46 C ATOM 1685 CD GLU A 109 9.157 -14.522 5.670 1.00 2.13 C ATOM 1686 OE1 GLU A 109 8.888 -14.770 6.865 1.00 2.57 O ATOM 1687 OE2 GLU A 109 10.320 -14.535 5.215 1.00 2.74 O ATOM 0 H GLU A 109 5.758 -14.407 2.458 1.00 0.95 H new ATOM 0 HA GLU A 109 4.560 -14.035 5.033 1.00 1.05 H new ATOM 0 HB2 GLU A 109 6.663 -13.489 6.226 1.00 1.20 H new ATOM 0 HB3 GLU A 109 6.506 -15.195 5.860 1.00 1.20 H new ATOM 0 HG2 GLU A 109 8.013 -14.906 3.903 1.00 1.46 H new ATOM 0 HG3 GLU A 109 8.183 -13.206 4.293 1.00 1.46 H new ATOM 1694 N ARG A 110 6.484 -12.205 3.061 1.00 0.93 N ATOM 1695 CA ARG A 110 6.648 -10.874 2.489 1.00 0.97 C ATOM 1696 C ARG A 110 5.937 -10.825 1.144 1.00 0.79 C ATOM 1697 O ARG A 110 6.085 -9.874 0.376 1.00 0.87 O ATOM 1698 CB ARG A 110 8.137 -10.543 2.322 1.00 1.17 C ATOM 1699 CG ARG A 110 8.435 -9.067 2.092 1.00 1.05 C ATOM 1700 CD ARG A 110 9.910 -8.766 2.311 1.00 1.57 C ATOM 1701 NE ARG A 110 10.203 -7.340 2.202 1.00 2.14 N ATOM 1702 CZ ARG A 110 11.416 -6.820 2.377 1.00 2.68 C ATOM 1703 NH1 ARG A 110 12.445 -7.610 2.661 1.00 2.96 N ATOM 1704 NH2 ARG A 110 11.600 -5.513 2.269 1.00 3.52 N ATOM 0 H ARG A 110 7.130 -12.903 2.692 1.00 0.93 H new ATOM 0 HA ARG A 110 6.212 -10.132 3.158 1.00 0.97 H new ATOM 0 HB2 ARG A 110 8.672 -10.874 3.212 1.00 1.17 H new ATOM 0 HB3 ARG A 110 8.531 -11.115 1.482 1.00 1.17 H new ATOM 0 HG2 ARG A 110 8.151 -8.789 1.077 1.00 1.05 H new ATOM 0 HG3 ARG A 110 7.833 -8.461 2.769 1.00 1.05 H new ATOM 0 HD2 ARG A 110 10.210 -9.123 3.296 1.00 1.57 H new ATOM 0 HD3 ARG A 110 10.504 -9.314 1.580 1.00 1.57 H new ATOM 0 HE ARG A 110 9.435 -6.706 1.979 1.00 2.14 H new ATOM 0 HH11 ARG A 110 12.307 -8.617 2.745 1.00 2.96 H new ATOM 0 HH12 ARG A 110 13.374 -7.210 2.795 1.00 2.96 H new ATOM 0 HH21 ARG A 110 10.812 -4.903 2.051 1.00 3.52 H new ATOM 0 HH22 ARG A 110 12.530 -5.116 2.403 1.00 3.52 H new ATOM 1718 N LEU A 111 5.162 -11.876 0.868 1.00 0.72 N ATOM 1719 CA LEU A 111 4.423 -11.981 -0.383 1.00 0.75 C ATOM 1720 C LEU A 111 3.323 -13.039 -0.315 1.00 0.66 C ATOM 1721 O LEU A 111 3.572 -14.221 -0.553 1.00 0.70 O ATOM 1722 CB LEU A 111 5.376 -12.316 -1.532 1.00 0.95 C ATOM 1723 CG LEU A 111 4.695 -12.673 -2.855 1.00 0.69 C ATOM 1724 CD1 LEU A 111 3.742 -11.569 -3.271 1.00 0.95 C ATOM 1725 CD2 LEU A 111 5.732 -12.915 -3.939 1.00 1.36 C ATOM 0 H LEU A 111 5.032 -12.667 1.499 1.00 0.72 H new ATOM 0 HA LEU A 111 3.951 -11.014 -0.558 1.00 0.75 H new ATOM 0 HB2 LEU A 111 6.034 -11.463 -1.698 1.00 0.95 H new ATOM 0 HB3 LEU A 111 6.007 -13.151 -1.229 1.00 0.95 H new ATOM 0 HG LEU A 111 4.124 -13.591 -2.714 1.00 0.69 H new ATOM 0 HD11 LEU A 111 3.265 -11.836 -4.214 1.00 0.95 H new ATOM 0 HD12 LEU A 111 2.980 -11.438 -2.503 1.00 0.95 H new ATOM 0 HD13 LEU A 111 4.296 -10.638 -3.396 1.00 0.95 H new ATOM 0 HD21 LEU A 111 5.230 -13.168 -4.873 1.00 1.36 H new ATOM 0 HD22 LEU A 111 6.328 -12.013 -4.080 1.00 1.36 H new ATOM 0 HD23 LEU A 111 6.383 -13.738 -3.643 1.00 1.36 H new ATOM 1737 N THR A 112 2.104 -12.605 -0.017 1.00 0.71 N ATOM 1738 CA THR A 112 0.967 -13.508 0.048 1.00 0.67 C ATOM 1739 C THR A 112 -0.186 -12.947 -0.780 1.00 0.66 C ATOM 1740 O THR A 112 -0.821 -11.968 -0.386 1.00 0.82 O ATOM 1741 CB THR A 112 0.536 -13.719 1.502 1.00 0.74 C ATOM 1742 OG1 THR A 112 -0.652 -14.488 1.568 1.00 0.75 O ATOM 1743 CG2 THR A 112 0.294 -12.428 2.257 1.00 0.83 C ATOM 0 H THR A 112 1.880 -11.630 0.184 1.00 0.71 H new ATOM 0 HA THR A 112 1.256 -14.475 -0.364 1.00 0.67 H new ATOM 0 HB THR A 112 1.370 -14.239 1.973 1.00 0.74 H new ATOM 0 HG1 THR A 112 -0.909 -14.613 2.505 1.00 0.75 H new ATOM 0 HG21 THR A 112 -0.008 -12.656 3.279 1.00 0.83 H new ATOM 0 HG22 THR A 112 1.210 -11.838 2.272 1.00 0.83 H new ATOM 0 HG23 THR A 112 -0.495 -11.860 1.763 1.00 0.83 H new ATOM 1751 N VAL A 113 -0.460 -13.566 -1.930 1.00 0.60 N ATOM 1752 CA VAL A 113 -1.542 -13.105 -2.787 1.00 0.61 C ATOM 1753 C VAL A 113 -2.867 -13.252 -2.047 1.00 0.64 C ATOM 1754 O VAL A 113 -3.542 -12.254 -1.795 1.00 0.80 O ATOM 1755 CB VAL A 113 -1.568 -13.847 -4.133 1.00 0.64 C ATOM 1756 CG1 VAL A 113 -2.763 -13.409 -4.963 1.00 1.27 C ATOM 1757 CG2 VAL A 113 -0.276 -13.610 -4.889 1.00 1.38 C ATOM 0 H VAL A 113 0.048 -14.377 -2.282 1.00 0.60 H new ATOM 0 HA VAL A 113 -1.375 -12.053 -3.020 1.00 0.61 H new ATOM 0 HB VAL A 113 -1.664 -14.915 -3.938 1.00 0.64 H new ATOM 0 HG11 VAL A 113 -2.763 -13.946 -5.912 1.00 1.27 H new ATOM 0 HG12 VAL A 113 -3.683 -13.629 -4.421 1.00 1.27 H new ATOM 0 HG13 VAL A 113 -2.701 -12.337 -5.152 1.00 1.27 H new ATOM 0 HG21 VAL A 113 -0.308 -14.141 -5.840 1.00 1.38 H new ATOM 0 HG22 VAL A 113 -0.153 -12.543 -5.073 1.00 1.38 H new ATOM 0 HG23 VAL A 113 0.564 -13.975 -4.298 1.00 1.38 H new ATOM 1767 N PRO A 114 -3.248 -14.488 -1.640 1.00 0.61 N ATOM 1768 CA PRO A 114 -4.474 -14.723 -0.868 1.00 0.70 C ATOM 1769 C PRO A 114 -4.506 -13.838 0.372 1.00 0.76 C ATOM 1770 O PRO A 114 -5.504 -13.784 1.091 1.00 0.88 O ATOM 1771 CB PRO A 114 -4.366 -16.194 -0.474 1.00 0.68 C ATOM 1772 CG PRO A 114 -3.523 -16.793 -1.535 1.00 0.83 C ATOM 1773 CD PRO A 114 -2.510 -15.743 -1.868 1.00 0.63 C ATOM 0 HA PRO A 114 -5.381 -14.495 -1.428 1.00 0.70 H new ATOM 0 HB2 PRO A 114 -3.911 -16.311 0.510 1.00 0.68 H new ATOM 0 HB3 PRO A 114 -5.347 -16.668 -0.430 1.00 0.68 H new ATOM 0 HG2 PRO A 114 -3.043 -17.708 -1.187 1.00 0.83 H new ATOM 0 HG3 PRO A 114 -4.118 -17.058 -2.409 1.00 0.83 H new ATOM 0 HD2 PRO A 114 -1.629 -15.815 -1.230 1.00 0.63 H new ATOM 0 HD3 PRO A 114 -2.165 -15.827 -2.899 1.00 0.63 H new ATOM 1781 N HIS A 115 -3.385 -13.136 0.573 1.00 0.82 N ATOM 1782 CA HIS A 115 -3.165 -12.194 1.669 1.00 0.95 C ATOM 1783 C HIS A 115 -4.103 -12.356 2.854 1.00 0.86 C ATOM 1784 O HIS A 115 -5.292 -12.048 2.781 1.00 0.88 O ATOM 1785 CB HIS A 115 -3.219 -10.747 1.151 1.00 1.14 C ATOM 1786 CG HIS A 115 -4.451 -10.363 0.375 1.00 2.17 C ATOM 1787 ND1 HIS A 115 -4.642 -9.090 -0.116 1.00 3.14 N ATOM 1788 CD2 HIS A 115 -5.549 -11.066 0.003 1.00 2.95 C ATOM 1789 CE1 HIS A 115 -5.795 -9.028 -0.754 1.00 4.09 C ATOM 1790 NE2 HIS A 115 -6.365 -10.213 -0.696 1.00 3.97 N ATOM 0 H HIS A 115 -2.579 -13.213 -0.047 1.00 0.82 H new ATOM 0 HA HIS A 115 -2.171 -12.429 2.049 1.00 0.95 H new ATOM 0 HB2 HIS A 115 -3.128 -10.074 2.004 1.00 1.14 H new ATOM 0 HB3 HIS A 115 -2.349 -10.577 0.517 1.00 1.14 H new ATOM 0 HD2 HIS A 115 -5.745 -12.106 0.217 1.00 2.95 H new ATOM 0 HE1 HIS A 115 -6.202 -8.154 -1.241 1.00 4.09 H new ATOM 0 HE2 HIS A 115 -7.267 -10.457 -1.105 1.00 3.97 H new ATOM 1799 N TYR A 116 -3.531 -12.787 3.971 1.00 1.04 N ATOM 1800 CA TYR A 116 -4.295 -12.936 5.201 1.00 1.14 C ATOM 1801 C TYR A 116 -3.839 -11.896 6.217 1.00 1.04 C ATOM 1802 O TYR A 116 -2.829 -12.085 6.894 1.00 1.47 O ATOM 1803 CB TYR A 116 -4.128 -14.343 5.787 1.00 1.62 C ATOM 1804 CG TYR A 116 -4.759 -15.442 4.957 1.00 2.18 C ATOM 1805 CD1 TYR A 116 -4.402 -15.639 3.629 1.00 3.06 C ATOM 1806 CD2 TYR A 116 -5.717 -16.284 5.510 1.00 2.56 C ATOM 1807 CE1 TYR A 116 -4.980 -16.644 2.877 1.00 4.05 C ATOM 1808 CE2 TYR A 116 -6.298 -17.291 4.764 1.00 3.50 C ATOM 1809 CZ TYR A 116 -5.928 -17.466 3.448 1.00 4.18 C ATOM 1810 OH TYR A 116 -6.505 -18.467 2.702 1.00 5.29 O ATOM 0 H TYR A 116 -2.546 -13.038 4.050 1.00 1.04 H new ATOM 0 HA TYR A 116 -5.350 -12.786 4.970 1.00 1.14 H new ATOM 0 HB2 TYR A 116 -3.064 -14.553 5.899 1.00 1.62 H new ATOM 0 HB3 TYR A 116 -4.564 -14.362 6.786 1.00 1.62 H new ATOM 0 HD1 TYR A 116 -3.661 -14.996 3.177 1.00 3.06 H new ATOM 0 HD2 TYR A 116 -6.012 -16.149 6.540 1.00 2.56 H new ATOM 0 HE1 TYR A 116 -4.690 -16.785 1.846 1.00 4.05 H new ATOM 0 HE2 TYR A 116 -7.039 -17.938 5.210 1.00 3.50 H new ATOM 0 HH TYR A 116 -7.151 -18.955 3.254 1.00 5.29 H new ATOM 1820 N ASP A 117 -4.604 -10.804 6.305 1.00 0.77 N ATOM 1821 CA ASP A 117 -4.326 -9.688 7.222 1.00 0.80 C ATOM 1822 C ASP A 117 -4.962 -8.412 6.686 1.00 0.72 C ATOM 1823 O ASP A 117 -5.368 -7.533 7.446 1.00 0.82 O ATOM 1824 CB ASP A 117 -2.819 -9.456 7.398 1.00 1.03 C ATOM 1825 CG ASP A 117 -2.143 -9.035 6.108 1.00 1.77 C ATOM 1826 OD1 ASP A 117 -2.215 -9.800 5.123 1.00 2.46 O ATOM 1827 OD2 ASP A 117 -1.542 -7.940 6.081 1.00 2.22 O ATOM 0 H ASP A 117 -5.441 -10.666 5.739 1.00 0.77 H new ATOM 0 HA ASP A 117 -4.749 -9.948 8.192 1.00 0.80 H new ATOM 0 HB2 ASP A 117 -2.659 -8.689 8.156 1.00 1.03 H new ATOM 0 HB3 ASP A 117 -2.354 -10.370 7.767 1.00 1.03 H new ATOM 1832 N MET A 118 -5.034 -8.325 5.361 1.00 0.69 N ATOM 1833 CA MET A 118 -5.610 -7.169 4.683 1.00 0.72 C ATOM 1834 C MET A 118 -7.071 -6.965 5.080 1.00 0.71 C ATOM 1835 O MET A 118 -7.566 -5.839 5.095 1.00 0.73 O ATOM 1836 CB MET A 118 -5.487 -7.352 3.168 1.00 0.83 C ATOM 1837 CG MET A 118 -6.008 -8.698 2.683 1.00 1.15 C ATOM 1838 SD MET A 118 -7.806 -8.841 2.731 1.00 2.40 S ATOM 1839 CE MET A 118 -8.029 -10.551 2.250 1.00 3.10 C ATOM 0 H MET A 118 -4.696 -9.051 4.729 1.00 0.69 H new ATOM 0 HA MET A 118 -5.060 -6.278 4.986 1.00 0.72 H new ATOM 0 HB2 MET A 118 -6.036 -6.555 2.666 1.00 0.83 H new ATOM 0 HB3 MET A 118 -4.441 -7.249 2.880 1.00 0.83 H new ATOM 0 HG2 MET A 118 -5.667 -8.863 1.661 1.00 1.15 H new ATOM 0 HG3 MET A 118 -5.573 -9.488 3.296 1.00 1.15 H new ATOM 0 HE1 MET A 118 -8.798 -11.007 2.873 1.00 3.10 H new ATOM 0 HE2 MET A 118 -8.334 -10.598 1.205 1.00 3.10 H new ATOM 0 HE3 MET A 118 -7.091 -11.091 2.379 1.00 3.10 H new ATOM 1849 N LYS A 119 -7.751 -8.062 5.406 1.00 0.80 N ATOM 1850 CA LYS A 119 -9.156 -8.009 5.808 1.00 0.95 C ATOM 1851 C LYS A 119 -9.309 -7.227 7.101 1.00 0.99 C ATOM 1852 O LYS A 119 -10.420 -7.004 7.583 1.00 1.24 O ATOM 1853 CB LYS A 119 -9.714 -9.429 5.962 1.00 1.15 C ATOM 1854 CG LYS A 119 -8.833 -10.364 6.783 1.00 1.30 C ATOM 1855 CD LYS A 119 -8.870 -10.035 8.268 1.00 1.70 C ATOM 1856 CE LYS A 119 -10.257 -10.252 8.856 1.00 2.06 C ATOM 1857 NZ LYS A 119 -10.705 -11.666 8.711 1.00 2.67 N ATOM 0 H LYS A 119 -7.351 -9.000 5.400 1.00 0.80 H new ATOM 0 HA LYS A 119 -9.725 -7.496 5.032 1.00 0.95 H new ATOM 0 HB2 LYS A 119 -10.697 -9.372 6.429 1.00 1.15 H new ATOM 0 HB3 LYS A 119 -9.857 -9.860 4.971 1.00 1.15 H new ATOM 0 HG2 LYS A 119 -9.160 -11.393 6.633 1.00 1.30 H new ATOM 0 HG3 LYS A 119 -7.806 -10.300 6.424 1.00 1.30 H new ATOM 0 HD2 LYS A 119 -8.148 -10.658 8.797 1.00 1.70 H new ATOM 0 HD3 LYS A 119 -8.568 -8.999 8.419 1.00 1.70 H new ATOM 0 HE2 LYS A 119 -10.251 -9.979 9.911 1.00 2.06 H new ATOM 0 HE3 LYS A 119 -10.969 -9.592 8.360 1.00 2.06 H new ATOM 0 HZ1 LYS A 119 -11.531 -11.833 9.320 1.00 2.67 H new ATOM 0 HZ2 LYS A 119 -10.963 -11.849 7.720 1.00 2.67 H new ATOM 0 HZ3 LYS A 119 -9.934 -12.305 8.992 1.00 2.67 H new ATOM 1871 N ASN A 120 -8.180 -6.804 7.646 1.00 0.90 N ATOM 1872 CA ASN A 120 -8.165 -6.033 8.876 1.00 1.04 C ATOM 1873 C ASN A 120 -7.946 -4.556 8.576 1.00 1.08 C ATOM 1874 O ASN A 120 -7.556 -3.789 9.455 1.00 1.35 O ATOM 1875 CB ASN A 120 -7.061 -6.540 9.804 1.00 1.08 C ATOM 1876 CG ASN A 120 -7.285 -7.972 10.247 1.00 1.41 C ATOM 1877 OD1 ASN A 120 -8.293 -8.288 10.879 1.00 1.77 O ATOM 1878 ND2 ASN A 120 -6.342 -8.848 9.917 1.00 1.84 N ATOM 0 H ASN A 120 -7.257 -6.984 7.252 1.00 0.90 H new ATOM 0 HA ASN A 120 -9.130 -6.154 9.369 1.00 1.04 H new ATOM 0 HB2 ASN A 120 -6.101 -6.467 9.294 1.00 1.08 H new ATOM 0 HB3 ASN A 120 -7.005 -5.896 10.682 1.00 1.08 H new ATOM 0 HD21 ASN A 120 -6.437 -9.827 10.188 1.00 1.84 H new ATOM 0 HD22 ASN A 120 -5.523 -8.542 9.392 1.00 1.84 H new ATOM 1885 N ARG A 121 -8.183 -4.160 7.325 1.00 0.93 N ATOM 1886 CA ARG A 121 -7.988 -2.771 6.933 1.00 1.06 C ATOM 1887 C ARG A 121 -8.634 -2.437 5.587 1.00 0.84 C ATOM 1888 O ARG A 121 -8.155 -2.849 4.529 1.00 0.87 O ATOM 1889 CB ARG A 121 -6.491 -2.462 6.880 1.00 1.31 C ATOM 1890 CG ARG A 121 -5.698 -3.426 6.012 1.00 1.14 C ATOM 1891 CD ARG A 121 -4.215 -3.097 6.026 1.00 1.39 C ATOM 1892 NE ARG A 121 -3.653 -3.156 7.374 1.00 1.56 N ATOM 1893 CZ ARG A 121 -2.372 -2.934 7.650 1.00 1.73 C ATOM 1894 NH1 ARG A 121 -1.519 -2.646 6.675 1.00 2.29 N ATOM 1895 NH2 ARG A 121 -1.941 -2.998 8.902 1.00 2.04 N ATOM 0 H ARG A 121 -8.506 -4.774 6.578 1.00 0.93 H new ATOM 0 HA ARG A 121 -8.479 -2.151 7.683 1.00 1.06 H new ATOM 0 HB2 ARG A 121 -6.351 -1.449 6.503 1.00 1.31 H new ATOM 0 HB3 ARG A 121 -6.089 -2.484 7.893 1.00 1.31 H new ATOM 0 HG2 ARG A 121 -5.849 -4.445 6.367 1.00 1.14 H new ATOM 0 HG3 ARG A 121 -6.071 -3.387 4.989 1.00 1.14 H new ATOM 0 HD2 ARG A 121 -3.683 -3.796 5.381 1.00 1.39 H new ATOM 0 HD3 ARG A 121 -4.061 -2.100 5.612 1.00 1.39 H new ATOM 0 HE ARG A 121 -4.280 -3.380 8.147 1.00 1.56 H new ATOM 0 HH11 ARG A 121 -1.846 -2.594 5.710 1.00 2.29 H new ATOM 0 HH12 ARG A 121 -0.537 -2.476 6.890 1.00 2.29 H new ATOM 0 HH21 ARG A 121 -2.593 -3.218 9.655 1.00 2.04 H new ATOM 0 HH22 ARG A 121 -0.958 -2.827 9.112 1.00 2.04 H new ATOM 1909 N GLY A 122 -9.704 -1.648 5.638 1.00 0.73 N ATOM 1910 CA GLY A 122 -10.377 -1.222 4.424 1.00 0.60 C ATOM 1911 C GLY A 122 -9.564 -0.171 3.704 1.00 0.57 C ATOM 1912 O GLY A 122 -9.831 0.148 2.546 1.00 0.59 O ATOM 0 H GLY A 122 -10.118 -1.296 6.501 1.00 0.73 H new ATOM 0 HA2 GLY A 122 -10.534 -2.079 3.769 1.00 0.60 H new ATOM 0 HA3 GLY A 122 -11.361 -0.823 4.669 1.00 0.60 H new ATOM 1916 N PHE A 123 -8.550 0.355 4.391 1.00 0.65 N ATOM 1917 CA PHE A 123 -7.678 1.361 3.806 1.00 0.72 C ATOM 1918 C PHE A 123 -6.609 0.696 2.948 1.00 0.80 C ATOM 1919 O PHE A 123 -5.481 1.170 2.850 1.00 1.14 O ATOM 1920 CB PHE A 123 -7.057 2.255 4.892 1.00 0.84 C ATOM 1921 CG PHE A 123 -6.298 1.525 5.970 1.00 0.95 C ATOM 1922 CD1 PHE A 123 -5.064 0.949 5.713 1.00 1.47 C ATOM 1923 CD2 PHE A 123 -6.819 1.435 7.252 1.00 1.10 C ATOM 1924 CE1 PHE A 123 -4.363 0.300 6.711 1.00 2.04 C ATOM 1925 CE2 PHE A 123 -6.124 0.784 8.253 1.00 1.49 C ATOM 1926 CZ PHE A 123 -4.894 0.216 7.983 1.00 1.98 C ATOM 0 H PHE A 123 -8.316 0.099 5.350 1.00 0.65 H new ATOM 0 HA PHE A 123 -8.275 2.007 3.162 1.00 0.72 H new ATOM 0 HB2 PHE A 123 -6.383 2.965 4.413 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -7.852 2.836 5.360 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -4.645 1.008 4.719 1.00 1.47 H new ATOM 0 HD2 PHE A 123 -7.779 1.879 7.470 1.00 1.10 H new ATOM 0 HE1 PHE A 123 -3.401 -0.141 6.497 1.00 2.04 H new ATOM 0 HE2 PHE A 123 -6.542 0.719 9.247 1.00 1.49 H new ATOM 0 HZ PHE A 123 -4.349 -0.292 8.765 1.00 1.98 H new ATOM 1936 N MET A 124 -7.002 -0.411 2.320 1.00 0.62 N ATOM 1937 CA MET A 124 -6.135 -1.190 1.440 1.00 0.68 C ATOM 1938 C MET A 124 -7.005 -2.033 0.513 1.00 0.64 C ATOM 1939 O MET A 124 -6.714 -2.205 -0.675 1.00 0.68 O ATOM 1940 CB MET A 124 -5.210 -2.109 2.248 1.00 0.80 C ATOM 1941 CG MET A 124 -4.192 -1.376 3.107 1.00 1.00 C ATOM 1942 SD MET A 124 -3.047 -0.375 2.137 1.00 1.91 S ATOM 1943 CE MET A 124 -2.017 0.308 3.431 1.00 2.23 C ATOM 0 H MET A 124 -7.942 -0.796 2.410 1.00 0.62 H new ATOM 0 HA MET A 124 -5.514 -0.505 0.862 1.00 0.68 H new ATOM 0 HB2 MET A 124 -5.820 -2.744 2.891 1.00 0.80 H new ATOM 0 HB3 MET A 124 -4.680 -2.767 1.560 1.00 0.80 H new ATOM 0 HG2 MET A 124 -4.716 -0.735 3.816 1.00 1.00 H new ATOM 0 HG3 MET A 124 -3.627 -2.102 3.691 1.00 1.00 H new ATOM 0 HE1 MET A 124 -1.164 0.820 2.985 1.00 2.23 H new ATOM 0 HE2 MET A 124 -2.597 1.016 4.022 1.00 2.23 H new ATOM 0 HE3 MET A 124 -1.661 -0.496 4.075 1.00 2.23 H new ATOM 1953 N LEU A 125 -8.082 -2.555 1.085 1.00 0.61 N ATOM 1954 CA LEU A 125 -9.028 -3.392 0.368 1.00 0.62 C ATOM 1955 C LEU A 125 -9.985 -2.570 -0.485 1.00 0.56 C ATOM 1956 O LEU A 125 -10.384 -2.990 -1.572 1.00 0.63 O ATOM 1957 CB LEU A 125 -9.801 -4.246 1.374 1.00 0.67 C ATOM 1958 CG LEU A 125 -8.940 -5.057 2.338 1.00 0.77 C ATOM 1959 CD1 LEU A 125 -9.797 -6.057 3.095 1.00 1.24 C ATOM 1960 CD2 LEU A 125 -7.818 -5.761 1.593 1.00 1.16 C ATOM 0 H LEU A 125 -8.323 -2.407 2.065 1.00 0.61 H new ATOM 0 HA LEU A 125 -8.472 -4.035 -0.314 1.00 0.62 H new ATOM 0 HB2 LEU A 125 -10.452 -3.593 1.955 1.00 0.67 H new ATOM 0 HB3 LEU A 125 -10.446 -4.931 0.824 1.00 0.67 H new ATOM 0 HG LEU A 125 -8.489 -4.375 3.059 1.00 0.77 H new ATOM 0 HD11 LEU A 125 -9.170 -6.629 3.779 1.00 1.24 H new ATOM 0 HD12 LEU A 125 -10.562 -5.526 3.662 1.00 1.24 H new ATOM 0 HD13 LEU A 125 -10.275 -6.735 2.388 1.00 1.24 H new ATOM 0 HD21 LEU A 125 -7.216 -6.334 2.299 1.00 1.16 H new ATOM 0 HD22 LEU A 125 -8.242 -6.434 0.848 1.00 1.16 H new ATOM 0 HD23 LEU A 125 -7.190 -5.021 1.097 1.00 1.16 H new ATOM 1972 N TRP A 126 -10.336 -1.396 0.007 1.00 0.48 N ATOM 1973 CA TRP A 126 -11.234 -0.498 -0.704 1.00 0.48 C ATOM 1974 C TRP A 126 -10.520 0.109 -1.914 1.00 0.47 C ATOM 1975 O TRP A 126 -11.040 0.057 -3.027 1.00 0.48 O ATOM 1976 CB TRP A 126 -11.760 0.568 0.263 1.00 0.52 C ATOM 1977 CG TRP A 126 -12.160 1.864 -0.365 1.00 0.80 C ATOM 1978 CD1 TRP A 126 -11.797 3.095 0.076 1.00 1.33 C ATOM 1979 CD2 TRP A 126 -12.993 2.074 -1.514 1.00 1.45 C ATOM 1980 NE1 TRP A 126 -12.339 4.068 -0.730 1.00 1.82 N ATOM 1981 CE2 TRP A 126 -13.078 3.466 -1.713 1.00 1.88 C ATOM 1982 CE3 TRP A 126 -13.669 1.225 -2.397 1.00 2.11 C ATOM 1983 CZ2 TRP A 126 -13.812 4.025 -2.757 1.00 2.60 C ATOM 1984 CZ3 TRP A 126 -14.398 1.782 -3.430 1.00 2.88 C ATOM 1985 CH2 TRP A 126 -14.464 3.170 -3.603 1.00 3.03 C ATOM 0 H TRP A 126 -10.010 -1.038 0.905 1.00 0.48 H new ATOM 0 HA TRP A 126 -12.093 -1.050 -1.086 1.00 0.48 H new ATOM 0 HB2 TRP A 126 -12.621 0.160 0.793 1.00 0.52 H new ATOM 0 HB3 TRP A 126 -10.991 0.768 1.009 1.00 0.52 H new ATOM 0 HD1 TRP A 126 -11.172 3.283 0.937 1.00 1.33 H new ATOM 0 HE1 TRP A 126 -12.212 5.073 -0.615 1.00 1.82 H new ATOM 0 HE3 TRP A 126 -13.622 0.153 -2.273 1.00 2.11 H new ATOM 0 HZ2 TRP A 126 -13.864 5.095 -2.894 1.00 2.60 H new ATOM 0 HZ3 TRP A 126 -14.926 1.136 -4.116 1.00 2.88 H new ATOM 0 HH2 TRP A 126 -15.042 3.574 -4.421 1.00 3.03 H new ATOM 1996 N PRO A 127 -9.307 0.668 -1.731 1.00 0.50 N ATOM 1997 CA PRO A 127 -8.539 1.239 -2.838 1.00 0.54 C ATOM 1998 C PRO A 127 -8.456 0.269 -4.009 1.00 0.53 C ATOM 1999 O PRO A 127 -8.756 0.628 -5.148 1.00 0.56 O ATOM 2000 CB PRO A 127 -7.143 1.465 -2.246 1.00 0.61 C ATOM 2001 CG PRO A 127 -7.149 0.770 -0.928 1.00 0.61 C ATOM 2002 CD PRO A 127 -8.572 0.776 -0.465 1.00 0.55 C ATOM 0 HA PRO A 127 -8.995 2.150 -3.225 1.00 0.54 H new ATOM 0 HB2 PRO A 127 -6.370 1.060 -2.899 1.00 0.61 H new ATOM 0 HB3 PRO A 127 -6.935 2.528 -2.127 1.00 0.61 H new ATOM 0 HG2 PRO A 127 -6.774 -0.249 -1.023 1.00 0.61 H new ATOM 0 HG3 PRO A 127 -6.504 1.282 -0.214 1.00 0.61 H new ATOM 0 HD2 PRO A 127 -8.787 -0.058 0.204 1.00 0.55 H new ATOM 0 HD3 PRO A 127 -8.821 1.690 0.075 1.00 0.55 H new ATOM 2010 N LEU A 128 -8.054 -0.971 -3.719 1.00 0.53 N ATOM 2011 CA LEU A 128 -7.952 -1.994 -4.754 1.00 0.56 C ATOM 2012 C LEU A 128 -9.307 -2.231 -5.390 1.00 0.54 C ATOM 2013 O LEU A 128 -9.401 -2.618 -6.554 1.00 0.61 O ATOM 2014 CB LEU A 128 -7.442 -3.313 -4.171 1.00 0.63 C ATOM 2015 CG LEU A 128 -7.316 -4.457 -5.193 1.00 0.79 C ATOM 2016 CD1 LEU A 128 -6.204 -5.417 -4.809 1.00 1.42 C ATOM 2017 CD2 LEU A 128 -8.632 -5.215 -5.318 1.00 1.55 C ATOM 0 H LEU A 128 -7.797 -1.286 -2.784 1.00 0.53 H new ATOM 0 HA LEU A 128 -7.246 -1.639 -5.505 1.00 0.56 H new ATOM 0 HB2 LEU A 128 -6.467 -3.141 -3.715 1.00 0.63 H new ATOM 0 HB3 LEU A 128 -8.115 -3.628 -3.374 1.00 0.63 H new ATOM 0 HG LEU A 128 -7.070 -4.011 -6.157 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -6.139 -6.214 -5.550 1.00 1.42 H new ATOM 0 HD12 LEU A 128 -5.256 -4.880 -4.771 1.00 1.42 H new ATOM 0 HD13 LEU A 128 -6.417 -5.847 -3.830 1.00 1.42 H new ATOM 0 HD21 LEU A 128 -8.521 -6.019 -6.045 1.00 1.55 H new ATOM 0 HD22 LEU A 128 -8.903 -5.636 -4.350 1.00 1.55 H new ATOM 0 HD23 LEU A 128 -9.415 -4.533 -5.648 1.00 1.55 H new ATOM 2029 N PHE A 129 -10.357 -2.007 -4.615 1.00 0.50 N ATOM 2030 CA PHE A 129 -11.706 -2.212 -5.107 1.00 0.51 C ATOM 2031 C PHE A 129 -12.018 -1.182 -6.189 1.00 0.53 C ATOM 2032 O PHE A 129 -12.850 -1.412 -7.061 1.00 0.70 O ATOM 2033 CB PHE A 129 -12.714 -2.134 -3.954 1.00 0.49 C ATOM 2034 CG PHE A 129 -14.109 -2.550 -4.331 1.00 0.54 C ATOM 2035 CD1 PHE A 129 -14.930 -1.703 -5.060 1.00 0.62 C ATOM 2036 CD2 PHE A 129 -14.602 -3.792 -3.955 1.00 0.60 C ATOM 2037 CE1 PHE A 129 -16.210 -2.088 -5.412 1.00 0.73 C ATOM 2038 CE2 PHE A 129 -15.882 -4.179 -4.303 1.00 0.71 C ATOM 2039 CZ PHE A 129 -16.685 -3.326 -5.035 1.00 0.75 C ATOM 0 H PHE A 129 -10.300 -1.685 -3.649 1.00 0.50 H new ATOM 0 HA PHE A 129 -11.784 -3.207 -5.545 1.00 0.51 H new ATOM 0 HB2 PHE A 129 -12.366 -2.766 -3.137 1.00 0.49 H new ATOM 0 HB3 PHE A 129 -12.740 -1.112 -3.577 1.00 0.49 H new ATOM 0 HD1 PHE A 129 -14.565 -0.731 -5.356 1.00 0.62 H new ATOM 0 HD2 PHE A 129 -13.978 -4.463 -3.384 1.00 0.60 H new ATOM 0 HE1 PHE A 129 -16.838 -1.419 -5.982 1.00 0.73 H new ATOM 0 HE2 PHE A 129 -16.254 -5.147 -4.003 1.00 0.71 H new ATOM 0 HZ PHE A 129 -17.684 -3.629 -5.312 1.00 0.75 H new ATOM 2049 N GLU A 130 -11.323 -0.051 -6.139 1.00 0.43 N ATOM 2050 CA GLU A 130 -11.510 1.001 -7.129 1.00 0.49 C ATOM 2051 C GLU A 130 -10.695 0.687 -8.380 1.00 0.53 C ATOM 2052 O GLU A 130 -11.224 0.669 -9.491 1.00 0.68 O ATOM 2053 CB GLU A 130 -11.099 2.359 -6.545 1.00 0.54 C ATOM 2054 CG GLU A 130 -11.473 3.553 -7.414 1.00 0.99 C ATOM 2055 CD GLU A 130 -10.709 3.600 -8.724 1.00 1.63 C ATOM 2056 OE1 GLU A 130 -9.463 3.672 -8.681 1.00 2.40 O ATOM 2057 OE2 GLU A 130 -11.356 3.566 -9.792 1.00 2.04 O ATOM 0 H GLU A 130 -10.626 0.160 -5.424 1.00 0.43 H new ATOM 0 HA GLU A 130 -12.564 1.050 -7.401 1.00 0.49 H new ATOM 0 HB2 GLU A 130 -11.564 2.477 -5.566 1.00 0.54 H new ATOM 0 HB3 GLU A 130 -10.020 2.362 -6.388 1.00 0.54 H new ATOM 0 HG2 GLU A 130 -12.542 3.520 -7.625 1.00 0.99 H new ATOM 0 HG3 GLU A 130 -11.286 4.472 -6.858 1.00 0.99 H new ATOM 2064 N ILE A 131 -9.401 0.432 -8.187 1.00 0.48 N ATOM 2065 CA ILE A 131 -8.508 0.110 -9.294 1.00 0.56 C ATOM 2066 C ILE A 131 -8.952 -1.167 -10.005 1.00 0.52 C ATOM 2067 O ILE A 131 -8.741 -1.324 -11.207 1.00 0.64 O ATOM 2068 CB ILE A 131 -7.055 -0.067 -8.812 1.00 0.77 C ATOM 2069 CG1 ILE A 131 -6.943 -1.252 -7.848 1.00 0.77 C ATOM 2070 CG2 ILE A 131 -6.562 1.213 -8.151 1.00 1.55 C ATOM 2071 CD1 ILE A 131 -5.521 -1.564 -7.435 1.00 1.41 C ATOM 0 H ILE A 131 -8.950 0.443 -7.272 1.00 0.48 H new ATOM 0 HA ILE A 131 -8.554 0.948 -9.990 1.00 0.56 H new ATOM 0 HB ILE A 131 -6.426 -0.277 -9.677 1.00 0.77 H new ATOM 0 HG12 ILE A 131 -7.534 -1.041 -6.956 1.00 0.77 H new ATOM 0 HG13 ILE A 131 -7.378 -2.134 -8.318 1.00 0.77 H new ATOM 0 HG21 ILE A 131 -5.534 1.076 -7.814 1.00 1.55 H new ATOM 0 HG22 ILE A 131 -6.603 2.032 -8.869 1.00 1.55 H new ATOM 0 HG23 ILE A 131 -7.196 1.448 -7.296 1.00 1.55 H new ATOM 0 HD11 ILE A 131 -5.518 -2.414 -6.752 1.00 1.41 H new ATOM 0 HD12 ILE A 131 -4.930 -1.806 -8.318 1.00 1.41 H new ATOM 0 HD13 ILE A 131 -5.088 -0.697 -6.936 1.00 1.41 H new ATOM 2083 N ALA A 132 -9.563 -2.081 -9.249 1.00 0.53 N ATOM 2084 CA ALA A 132 -10.030 -3.345 -9.808 1.00 0.58 C ATOM 2085 C ALA A 132 -11.047 -4.030 -8.889 1.00 0.56 C ATOM 2086 O ALA A 132 -10.679 -4.822 -8.022 1.00 0.63 O ATOM 2087 CB ALA A 132 -8.852 -4.272 -10.066 1.00 0.73 C ATOM 0 H ALA A 132 -9.744 -1.968 -8.252 1.00 0.53 H new ATOM 0 HA ALA A 132 -10.530 -3.125 -10.751 1.00 0.58 H new ATOM 0 HB1 ALA A 132 -9.213 -5.212 -10.483 1.00 0.73 H new ATOM 0 HB2 ALA A 132 -8.167 -3.802 -10.771 1.00 0.73 H new ATOM 0 HB3 ALA A 132 -8.331 -4.467 -9.129 1.00 0.73 H new ATOM 2093 N PRO A 133 -12.349 -3.737 -9.078 1.00 0.63 N ATOM 2094 CA PRO A 133 -13.422 -4.326 -8.282 1.00 0.66 C ATOM 2095 C PRO A 133 -13.917 -5.641 -8.876 1.00 0.88 C ATOM 2096 O PRO A 133 -15.107 -5.947 -8.822 1.00 1.24 O ATOM 2097 CB PRO A 133 -14.518 -3.270 -8.369 1.00 0.79 C ATOM 2098 CG PRO A 133 -14.324 -2.612 -9.698 1.00 0.82 C ATOM 2099 CD PRO A 133 -12.877 -2.813 -10.094 1.00 0.81 C ATOM 0 HA PRO A 133 -13.106 -4.566 -7.267 1.00 0.66 H new ATOM 0 HB2 PRO A 133 -15.507 -3.722 -8.294 1.00 0.79 H new ATOM 0 HB3 PRO A 133 -14.435 -2.548 -7.556 1.00 0.79 H new ATOM 0 HG2 PRO A 133 -14.990 -3.047 -10.443 1.00 0.82 H new ATOM 0 HG3 PRO A 133 -14.562 -1.550 -9.639 1.00 0.82 H new ATOM 0 HD2 PRO A 133 -12.793 -3.233 -11.096 1.00 0.81 H new ATOM 0 HD3 PRO A 133 -12.330 -1.870 -10.097 1.00 0.81 H new ATOM 2107 N GLU A 134 -12.999 -6.411 -9.455 1.00 0.90 N ATOM 2108 CA GLU A 134 -13.354 -7.686 -10.069 1.00 1.12 C ATOM 2109 C GLU A 134 -12.329 -8.764 -9.736 1.00 1.08 C ATOM 2110 O GLU A 134 -12.325 -9.833 -10.344 1.00 1.25 O ATOM 2111 CB GLU A 134 -13.463 -7.530 -11.588 1.00 1.34 C ATOM 2112 CG GLU A 134 -14.567 -6.581 -12.031 1.00 1.87 C ATOM 2113 CD GLU A 134 -15.949 -7.075 -11.651 1.00 2.20 C ATOM 2114 OE1 GLU A 134 -16.322 -8.188 -12.077 1.00 2.50 O ATOM 2115 OE2 GLU A 134 -16.660 -6.349 -10.923 1.00 2.61 O ATOM 0 H GLU A 134 -12.008 -6.175 -9.511 1.00 0.90 H new ATOM 0 HA GLU A 134 -14.319 -7.993 -9.666 1.00 1.12 H new ATOM 0 HB2 GLU A 134 -12.510 -7.170 -11.976 1.00 1.34 H new ATOM 0 HB3 GLU A 134 -13.639 -8.510 -12.033 1.00 1.34 H new ATOM 0 HG2 GLU A 134 -14.400 -5.601 -11.583 1.00 1.87 H new ATOM 0 HG3 GLU A 134 -14.517 -6.450 -13.112 1.00 1.87 H new ATOM 2122 N LEU A 135 -11.459 -8.475 -8.770 1.00 0.99 N ATOM 2123 CA LEU A 135 -10.426 -9.419 -8.356 1.00 1.03 C ATOM 2124 C LEU A 135 -11.020 -10.799 -8.050 1.00 1.50 C ATOM 2125 O LEU A 135 -11.150 -11.634 -8.946 1.00 2.32 O ATOM 2126 CB LEU A 135 -9.688 -8.873 -7.134 1.00 1.00 C ATOM 2127 CG LEU A 135 -8.509 -9.715 -6.649 1.00 1.43 C ATOM 2128 CD1 LEU A 135 -7.496 -9.912 -7.769 1.00 2.07 C ATOM 2129 CD2 LEU A 135 -7.856 -9.052 -5.448 1.00 2.26 C ATOM 0 H LEU A 135 -11.450 -7.592 -8.259 1.00 0.99 H new ATOM 0 HA LEU A 135 -9.721 -9.539 -9.179 1.00 1.03 H new ATOM 0 HB2 LEU A 135 -9.326 -7.872 -7.367 1.00 1.00 H new ATOM 0 HB3 LEU A 135 -10.401 -8.772 -6.316 1.00 1.00 H new ATOM 0 HG LEU A 135 -8.878 -10.696 -6.349 1.00 1.43 H new ATOM 0 HD11 LEU A 135 -6.663 -10.514 -7.405 1.00 2.07 H new ATOM 0 HD12 LEU A 135 -7.973 -10.422 -8.606 1.00 2.07 H new ATOM 0 HD13 LEU A 135 -7.125 -8.942 -8.099 1.00 2.07 H new ATOM 0 HD21 LEU A 135 -7.017 -9.659 -5.109 1.00 2.26 H new ATOM 0 HD22 LEU A 135 -7.497 -8.062 -5.729 1.00 2.26 H new ATOM 0 HD23 LEU A 135 -8.585 -8.959 -4.643 1.00 2.26 H new ATOM 2141 N VAL A 136 -11.376 -11.034 -6.785 1.00 1.65 N ATOM 2142 CA VAL A 136 -11.954 -12.313 -6.368 1.00 2.11 C ATOM 2143 C VAL A 136 -11.134 -13.492 -6.881 1.00 1.98 C ATOM 2144 O VAL A 136 -11.517 -14.145 -7.853 1.00 2.82 O ATOM 2145 CB VAL A 136 -13.406 -12.475 -6.868 1.00 2.85 C ATOM 2146 CG1 VAL A 136 -14.010 -13.779 -6.364 1.00 3.55 C ATOM 2147 CG2 VAL A 136 -14.260 -11.295 -6.443 1.00 3.66 C ATOM 0 H VAL A 136 -11.274 -10.354 -6.031 1.00 1.65 H new ATOM 0 HA VAL A 136 -11.945 -12.308 -5.278 1.00 2.11 H new ATOM 0 HB VAL A 136 -13.384 -12.506 -7.957 1.00 2.85 H new ATOM 0 HG11 VAL A 136 -15.033 -13.871 -6.729 1.00 3.55 H new ATOM 0 HG12 VAL A 136 -13.418 -14.619 -6.728 1.00 3.55 H new ATOM 0 HG13 VAL A 136 -14.012 -13.782 -5.274 1.00 3.55 H new ATOM 0 HG21 VAL A 136 -15.278 -11.433 -6.807 1.00 3.66 H new ATOM 0 HG22 VAL A 136 -14.270 -11.226 -5.355 1.00 3.66 H new ATOM 0 HG23 VAL A 136 -13.846 -10.377 -6.861 1.00 3.66 H new ATOM 2157 N PHE A 137 -10.009 -13.774 -6.229 1.00 1.34 N ATOM 2158 CA PHE A 137 -9.172 -14.898 -6.655 1.00 1.66 C ATOM 2159 C PHE A 137 -8.102 -15.287 -5.629 1.00 1.18 C ATOM 2160 O PHE A 137 -7.987 -16.465 -5.287 1.00 1.57 O ATOM 2161 CB PHE A 137 -8.517 -14.598 -8.001 1.00 2.23 C ATOM 2162 CG PHE A 137 -8.070 -15.832 -8.735 1.00 3.15 C ATOM 2163 CD1 PHE A 137 -8.960 -16.861 -8.996 1.00 3.49 C ATOM 2164 CD2 PHE A 137 -6.759 -15.963 -9.167 1.00 3.88 C ATOM 2165 CE1 PHE A 137 -8.552 -17.996 -9.673 1.00 4.44 C ATOM 2166 CE2 PHE A 137 -6.345 -17.093 -9.842 1.00 4.85 C ATOM 2167 CZ PHE A 137 -7.245 -18.117 -10.089 1.00 5.09 C ATOM 0 H PHE A 137 -9.660 -13.256 -5.423 1.00 1.34 H new ATOM 0 HA PHE A 137 -9.841 -15.753 -6.750 1.00 1.66 H new ATOM 0 HB2 PHE A 137 -9.221 -14.048 -8.625 1.00 2.23 H new ATOM 0 HB3 PHE A 137 -7.657 -13.947 -7.841 1.00 2.23 H new ATOM 0 HD1 PHE A 137 -9.985 -16.776 -8.667 1.00 3.49 H new ATOM 0 HD2 PHE A 137 -6.052 -15.170 -8.973 1.00 3.88 H new ATOM 0 HE1 PHE A 137 -9.259 -18.787 -9.875 1.00 4.44 H new ATOM 0 HE2 PHE A 137 -5.322 -17.179 -10.177 1.00 4.85 H new ATOM 0 HZ PHE A 137 -6.922 -19.008 -10.607 1.00 5.09 H new ATOM 2177 N PRO A 138 -7.294 -14.331 -5.119 1.00 0.88 N ATOM 2178 CA PRO A 138 -6.246 -14.629 -4.138 1.00 0.92 C ATOM 2179 C PRO A 138 -6.768 -15.528 -3.031 1.00 1.20 C ATOM 2180 O PRO A 138 -6.238 -16.610 -2.782 1.00 1.94 O ATOM 2181 CB PRO A 138 -5.851 -13.242 -3.588 1.00 1.24 C ATOM 2182 CG PRO A 138 -6.856 -12.290 -4.149 1.00 1.68 C ATOM 2183 CD PRO A 138 -7.323 -12.901 -5.436 1.00 1.44 C ATOM 0 HA PRO A 138 -5.403 -15.164 -4.575 1.00 0.92 H new ATOM 0 HB2 PRO A 138 -5.867 -13.233 -2.498 1.00 1.24 H new ATOM 0 HB3 PRO A 138 -4.840 -12.972 -3.894 1.00 1.24 H new ATOM 0 HG2 PRO A 138 -7.688 -12.148 -3.459 1.00 1.68 H new ATOM 0 HG3 PRO A 138 -6.413 -11.309 -4.320 1.00 1.68 H new ATOM 0 HD2 PRO A 138 -8.323 -12.563 -5.709 1.00 1.44 H new ATOM 0 HD3 PRO A 138 -6.664 -12.654 -6.268 1.00 1.44 H new ATOM 2191 N ASP A 139 -7.831 -15.074 -2.393 1.00 1.07 N ATOM 2192 CA ASP A 139 -8.474 -15.823 -1.320 1.00 1.62 C ATOM 2193 C ASP A 139 -9.815 -16.380 -1.796 1.00 1.65 C ATOM 2194 O ASP A 139 -10.265 -17.429 -1.334 1.00 2.28 O ATOM 2195 CB ASP A 139 -8.677 -14.925 -0.096 1.00 2.26 C ATOM 2196 CG ASP A 139 -9.282 -15.667 1.082 1.00 2.93 C ATOM 2197 OD1 ASP A 139 -10.427 -16.148 0.952 1.00 3.20 O ATOM 2198 OD2 ASP A 139 -8.613 -15.767 2.132 1.00 3.67 O ATOM 0 H ASP A 139 -8.275 -14.179 -2.600 1.00 1.07 H new ATOM 0 HA ASP A 139 -7.830 -16.656 -1.039 1.00 1.62 H new ATOM 0 HB2 ASP A 139 -7.718 -14.501 0.201 1.00 2.26 H new ATOM 0 HB3 ASP A 139 -9.325 -14.091 -0.366 1.00 2.26 H new ATOM 2203 N GLY A 140 -10.441 -15.667 -2.730 1.00 1.25 N ATOM 2204 CA GLY A 140 -11.722 -16.089 -3.271 1.00 1.72 C ATOM 2205 C GLY A 140 -12.789 -15.048 -3.098 1.00 1.31 C ATOM 2206 O GLY A 140 -13.961 -15.362 -2.888 1.00 1.85 O ATOM 0 H GLY A 140 -10.080 -14.798 -3.124 1.00 1.25 H new ATOM 0 HA2 GLY A 140 -11.608 -16.316 -4.331 1.00 1.72 H new ATOM 0 HA3 GLY A 140 -12.035 -17.010 -2.780 1.00 1.72 H new ATOM 2210 N GLU A 141 -12.367 -13.804 -3.219 1.00 0.75 N ATOM 2211 CA GLU A 141 -13.251 -12.664 -3.114 1.00 0.94 C ATOM 2212 C GLU A 141 -12.441 -11.396 -3.128 1.00 0.82 C ATOM 2213 O GLU A 141 -11.274 -11.382 -2.735 1.00 1.19 O ATOM 2214 CB GLU A 141 -14.094 -12.702 -1.840 1.00 1.56 C ATOM 2215 CG GLU A 141 -13.287 -12.608 -0.555 1.00 1.38 C ATOM 2216 CD GLU A 141 -14.112 -12.925 0.679 1.00 2.16 C ATOM 2217 OE1 GLU A 141 -15.330 -13.162 0.533 1.00 2.47 O ATOM 2218 OE2 GLU A 141 -13.542 -12.938 1.790 1.00 2.97 O ATOM 0 H GLU A 141 -11.393 -13.556 -3.394 1.00 0.75 H new ATOM 0 HA GLU A 141 -13.929 -12.698 -3.967 1.00 0.94 H new ATOM 0 HB2 GLU A 141 -14.810 -11.881 -1.867 1.00 1.56 H new ATOM 0 HB3 GLU A 141 -14.671 -13.627 -1.827 1.00 1.56 H new ATOM 0 HG2 GLU A 141 -12.443 -13.296 -0.610 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -12.874 -11.604 -0.463 1.00 1.38 H new ATOM 2225 N MET A 142 -13.076 -10.332 -3.561 1.00 0.57 N ATOM 2226 CA MET A 142 -12.434 -9.039 -3.604 1.00 0.54 C ATOM 2227 C MET A 142 -11.928 -8.675 -2.236 1.00 0.58 C ATOM 2228 O MET A 142 -12.049 -9.446 -1.288 1.00 0.92 O ATOM 2229 CB MET A 142 -13.394 -7.971 -4.111 1.00 0.57 C ATOM 2230 CG MET A 142 -13.797 -8.184 -5.551 1.00 0.67 C ATOM 2231 SD MET A 142 -15.020 -6.989 -6.117 1.00 1.32 S ATOM 2232 CE MET A 142 -16.423 -7.431 -5.092 1.00 1.58 C ATOM 0 H MET A 142 -14.041 -10.337 -3.890 1.00 0.57 H new ATOM 0 HA MET A 142 -11.593 -9.094 -4.295 1.00 0.54 H new ATOM 0 HB2 MET A 142 -14.287 -7.965 -3.486 1.00 0.57 H new ATOM 0 HB3 MET A 142 -12.927 -6.991 -4.010 1.00 0.57 H new ATOM 0 HG2 MET A 142 -12.912 -8.120 -6.185 1.00 0.67 H new ATOM 0 HG3 MET A 142 -14.199 -9.191 -5.666 1.00 0.67 H new ATOM 0 HE1 MET A 142 -17.337 -7.035 -5.535 1.00 1.58 H new ATOM 0 HE2 MET A 142 -16.495 -8.516 -5.022 1.00 1.58 H new ATOM 0 HE3 MET A 142 -16.292 -7.011 -4.095 1.00 1.58 H new ATOM 2242 N LEU A 143 -11.354 -7.508 -2.140 1.00 0.55 N ATOM 2243 CA LEU A 143 -10.824 -7.039 -0.884 1.00 0.62 C ATOM 2244 C LEU A 143 -11.889 -6.347 -0.052 1.00 0.56 C ATOM 2245 O LEU A 143 -12.119 -6.687 1.108 1.00 0.60 O ATOM 2246 CB LEU A 143 -9.692 -6.059 -1.118 1.00 0.76 C ATOM 2247 CG LEU A 143 -8.678 -6.412 -2.196 1.00 0.81 C ATOM 2248 CD1 LEU A 143 -7.346 -5.757 -1.873 1.00 1.54 C ATOM 2249 CD2 LEU A 143 -8.510 -7.918 -2.351 1.00 1.70 C ATOM 0 H LEU A 143 -11.240 -6.859 -2.919 1.00 0.55 H new ATOM 0 HA LEU A 143 -10.461 -7.915 -0.346 1.00 0.62 H new ATOM 0 HB2 LEU A 143 -10.129 -5.092 -1.369 1.00 0.76 H new ATOM 0 HB3 LEU A 143 -9.155 -5.932 -0.178 1.00 0.76 H new ATOM 0 HG LEU A 143 -9.051 -6.034 -3.148 1.00 0.81 H new ATOM 0 HD11 LEU A 143 -6.619 -6.010 -2.645 1.00 1.54 H new ATOM 0 HD12 LEU A 143 -7.473 -4.675 -1.834 1.00 1.54 H new ATOM 0 HD13 LEU A 143 -6.989 -6.115 -0.908 1.00 1.54 H new ATOM 0 HD21 LEU A 143 -7.777 -8.124 -3.131 1.00 1.70 H new ATOM 0 HD22 LEU A 143 -8.167 -8.345 -1.409 1.00 1.70 H new ATOM 0 HD23 LEU A 143 -9.466 -8.365 -2.624 1.00 1.70 H new ATOM 2261 N ARG A 144 -12.481 -5.324 -0.651 1.00 0.53 N ATOM 2262 CA ARG A 144 -13.471 -4.502 0.017 1.00 0.52 C ATOM 2263 C ARG A 144 -14.610 -5.281 0.637 1.00 0.61 C ATOM 2264 O ARG A 144 -14.820 -5.166 1.823 1.00 0.69 O ATOM 2265 CB ARG A 144 -14.035 -3.438 -0.903 1.00 0.53 C ATOM 2266 CG ARG A 144 -14.980 -2.500 -0.167 1.00 0.58 C ATOM 2267 CD ARG A 144 -15.447 -1.350 -1.042 1.00 0.85 C ATOM 2268 NE ARG A 144 -16.471 -1.767 -1.998 1.00 1.18 N ATOM 2269 CZ ARG A 144 -17.674 -2.215 -1.644 1.00 1.39 C ATOM 2270 NH1 ARG A 144 -18.004 -2.310 -0.362 1.00 1.59 N ATOM 2271 NH2 ARG A 144 -18.552 -2.567 -2.573 1.00 2.16 N ATOM 0 H ARG A 144 -12.287 -5.043 -1.612 1.00 0.53 H new ATOM 0 HA ARG A 144 -12.923 -4.031 0.833 1.00 0.52 H new ATOM 0 HB2 ARG A 144 -13.218 -2.863 -1.338 1.00 0.53 H new ATOM 0 HB3 ARG A 144 -14.565 -3.914 -1.728 1.00 0.53 H new ATOM 0 HG2 ARG A 144 -15.846 -3.062 0.184 1.00 0.58 H new ATOM 0 HG3 ARG A 144 -14.479 -2.102 0.716 1.00 0.58 H new ATOM 0 HD2 ARG A 144 -15.843 -0.553 -0.412 1.00 0.85 H new ATOM 0 HD3 ARG A 144 -14.595 -0.936 -1.581 1.00 0.85 H new ATOM 0 HE ARG A 144 -16.252 -1.712 -2.993 1.00 1.18 H new ATOM 0 HH11 ARG A 144 -17.335 -2.039 0.358 1.00 1.59 H new ATOM 0 HH12 ARG A 144 -18.927 -2.654 -0.097 1.00 1.59 H new ATOM 0 HH21 ARG A 144 -18.306 -2.495 -3.560 1.00 2.16 H new ATOM 0 HH22 ARG A 144 -19.473 -2.910 -2.300 1.00 2.16 H new ATOM 2285 N GLN A 145 -15.369 -6.046 -0.137 1.00 0.76 N ATOM 2286 CA GLN A 145 -16.485 -6.783 0.458 1.00 0.92 C ATOM 2287 C GLN A 145 -16.033 -7.447 1.764 1.00 0.89 C ATOM 2288 O GLN A 145 -16.820 -7.582 2.701 1.00 0.97 O ATOM 2289 CB GLN A 145 -17.097 -7.793 -0.524 1.00 1.21 C ATOM 2290 CG GLN A 145 -16.091 -8.398 -1.472 1.00 0.96 C ATOM 2291 CD GLN A 145 -14.934 -8.975 -0.721 1.00 1.54 C ATOM 2292 OE1 GLN A 145 -14.964 -10.122 -0.276 1.00 2.27 O ATOM 2293 NE2 GLN A 145 -13.923 -8.151 -0.539 1.00 1.87 N ATOM 0 H GLN A 145 -15.244 -6.173 -1.141 1.00 0.76 H new ATOM 0 HA GLN A 145 -17.280 -6.075 0.692 1.00 0.92 H new ATOM 0 HB2 GLN A 145 -17.577 -8.592 0.041 1.00 1.21 H new ATOM 0 HB3 GLN A 145 -17.877 -7.298 -1.102 1.00 1.21 H new ATOM 0 HG2 GLN A 145 -16.568 -9.176 -2.068 1.00 0.96 H new ATOM 0 HG3 GLN A 145 -15.736 -7.637 -2.167 1.00 0.96 H new ATOM 0 HE21 GLN A 145 -13.954 -7.210 -0.932 1.00 1.87 H new ATOM 0 HE22 GLN A 145 -13.108 -8.453 -0.005 1.00 1.87 H new ATOM 2302 N ILE A 146 -14.743 -7.802 1.849 1.00 0.85 N ATOM 2303 CA ILE A 146 -14.201 -8.380 3.072 1.00 0.90 C ATOM 2304 C ILE A 146 -14.022 -7.294 4.122 1.00 0.85 C ATOM 2305 O ILE A 146 -14.312 -7.503 5.295 1.00 1.01 O ATOM 2306 CB ILE A 146 -12.820 -9.022 2.862 1.00 0.95 C ATOM 2307 CG1 ILE A 146 -12.819 -9.979 1.683 1.00 1.06 C ATOM 2308 CG2 ILE A 146 -12.389 -9.747 4.126 1.00 1.24 C ATOM 2309 CD1 ILE A 146 -11.427 -10.410 1.290 1.00 1.06 C ATOM 0 H ILE A 146 -14.068 -7.698 1.091 1.00 0.85 H new ATOM 0 HA ILE A 146 -14.911 -9.144 3.387 1.00 0.90 H new ATOM 0 HB ILE A 146 -12.110 -8.225 2.640 1.00 0.95 H new ATOM 0 HG12 ILE A 146 -13.411 -10.859 1.933 1.00 1.06 H new ATOM 0 HG13 ILE A 146 -13.302 -9.501 0.831 1.00 1.06 H new ATOM 0 HG21 ILE A 146 -11.410 -10.199 3.970 1.00 1.24 H new ATOM 0 HG22 ILE A 146 -12.333 -9.037 4.952 1.00 1.24 H new ATOM 0 HG23 ILE A 146 -13.114 -10.525 4.364 1.00 1.24 H new ATOM 0 HD11 ILE A 146 -11.483 -11.093 0.443 1.00 1.06 H new ATOM 0 HD12 ILE A 146 -10.840 -9.535 1.012 1.00 1.06 H new ATOM 0 HD13 ILE A 146 -10.951 -10.914 2.131 1.00 1.06 H new ATOM 2321 N LEU A 147 -13.527 -6.132 3.688 1.00 0.72 N ATOM 2322 CA LEU A 147 -13.295 -5.010 4.603 1.00 0.75 C ATOM 2323 C LEU A 147 -14.622 -4.391 5.015 1.00 0.71 C ATOM 2324 O LEU A 147 -14.778 -3.868 6.116 1.00 0.81 O ATOM 2325 CB LEU A 147 -12.407 -3.945 3.933 1.00 0.92 C ATOM 2326 CG LEU A 147 -13.130 -2.996 2.963 1.00 0.82 C ATOM 2327 CD1 LEU A 147 -13.921 -1.952 3.723 1.00 1.36 C ATOM 2328 CD2 LEU A 147 -12.160 -2.298 2.040 1.00 1.66 C ATOM 0 H LEU A 147 -13.281 -5.943 2.716 1.00 0.72 H new ATOM 0 HA LEU A 147 -12.784 -5.385 5.490 1.00 0.75 H new ATOM 0 HB2 LEU A 147 -11.934 -3.348 4.713 1.00 0.92 H new ATOM 0 HB3 LEU A 147 -11.608 -4.451 3.391 1.00 0.92 H new ATOM 0 HG LEU A 147 -13.806 -3.608 2.366 1.00 0.82 H new ATOM 0 HD11 LEU A 147 -14.424 -1.292 3.017 1.00 1.36 H new ATOM 0 HD12 LEU A 147 -14.663 -2.444 4.352 1.00 1.36 H new ATOM 0 HD13 LEU A 147 -13.246 -1.368 4.348 1.00 1.36 H new ATOM 0 HD21 LEU A 147 -12.708 -1.636 1.369 1.00 1.66 H new ATOM 0 HD22 LEU A 147 -11.453 -1.714 2.629 1.00 1.66 H new ATOM 0 HD23 LEU A 147 -11.617 -3.040 1.454 1.00 1.66 H new ATOM 2340 N HIS A 148 -15.562 -4.448 4.092 1.00 0.71 N ATOM 2341 CA HIS A 148 -16.887 -3.907 4.279 1.00 0.76 C ATOM 2342 C HIS A 148 -17.619 -4.718 5.329 1.00 0.83 C ATOM 2343 O HIS A 148 -18.531 -4.236 6.000 1.00 0.92 O ATOM 2344 CB HIS A 148 -17.617 -3.949 2.931 1.00 0.79 C ATOM 2345 CG HIS A 148 -19.028 -3.434 2.959 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -19.895 -3.569 1.895 1.00 1.04 N ATOM 2347 CD2 HIS A 148 -19.712 -2.760 3.914 1.00 1.02 C ATOM 2348 CE1 HIS A 148 -21.049 -3.002 2.197 1.00 1.20 C ATOM 2349 NE2 HIS A 148 -20.965 -2.504 3.416 1.00 1.19 N ATOM 0 H HIS A 148 -15.421 -4.879 3.178 1.00 0.71 H new ATOM 0 HA HIS A 148 -16.842 -2.875 4.627 1.00 0.76 H new ATOM 0 HB2 HIS A 148 -17.047 -3.366 2.208 1.00 0.79 H new ATOM 0 HB3 HIS A 148 -17.628 -4.978 2.573 1.00 0.79 H new ATOM 0 HD2 HIS A 148 -19.340 -2.476 4.888 1.00 1.02 H new ATOM 0 HE1 HIS A 148 -21.916 -2.954 1.554 1.00 1.20 H new ATOM 0 HE2 HIS A 148 -21.709 -2.010 3.908 1.00 1.19 H new ATOM 2358 N THR A 149 -17.201 -5.965 5.459 1.00 0.86 N ATOM 2359 CA THR A 149 -17.813 -6.873 6.424 1.00 0.97 C ATOM 2360 C THR A 149 -16.881 -7.199 7.595 1.00 1.00 C ATOM 2361 O THR A 149 -17.327 -7.751 8.602 1.00 1.13 O ATOM 2362 CB THR A 149 -18.226 -8.168 5.725 1.00 1.02 C ATOM 2363 OG1 THR A 149 -17.088 -8.870 5.257 1.00 1.35 O ATOM 2364 CG2 THR A 149 -19.142 -7.946 4.539 1.00 1.48 C ATOM 0 H THR A 149 -16.443 -6.375 4.912 1.00 0.86 H new ATOM 0 HA THR A 149 -18.688 -6.367 6.833 1.00 0.97 H new ATOM 0 HB THR A 149 -18.765 -8.741 6.479 1.00 1.02 H new ATOM 0 HG1 THR A 149 -16.839 -8.536 4.370 1.00 1.35 H new ATOM 0 HG21 THR A 149 -19.396 -8.906 4.090 1.00 1.48 H new ATOM 0 HG22 THR A 149 -20.053 -7.449 4.871 1.00 1.48 H new ATOM 0 HG23 THR A 149 -18.637 -7.323 3.801 1.00 1.48 H new ATOM 2372 N ARG A 150 -15.589 -6.890 7.466 1.00 0.91 N ATOM 2373 CA ARG A 150 -14.638 -7.207 8.537 1.00 0.97 C ATOM 2374 C ARG A 150 -14.010 -5.972 9.190 1.00 0.97 C ATOM 2375 O ARG A 150 -13.462 -6.074 10.288 1.00 1.16 O ATOM 2376 CB ARG A 150 -13.539 -8.130 8.012 1.00 1.01 C ATOM 2377 CG ARG A 150 -14.049 -9.500 7.586 1.00 1.12 C ATOM 2378 CD ARG A 150 -14.636 -10.266 8.763 1.00 1.43 C ATOM 2379 NE ARG A 150 -15.218 -11.546 8.358 1.00 1.84 N ATOM 2380 CZ ARG A 150 -14.519 -12.544 7.823 1.00 2.15 C ATOM 2381 NH1 ARG A 150 -13.211 -12.421 7.640 1.00 2.45 N ATOM 2382 NH2 ARG A 150 -15.129 -13.670 7.475 1.00 2.86 N ATOM 0 H ARG A 150 -15.182 -6.431 6.651 1.00 0.91 H new ATOM 0 HA ARG A 150 -15.215 -7.709 9.314 1.00 0.97 H new ATOM 0 HB2 ARG A 150 -13.050 -7.653 7.163 1.00 1.01 H new ATOM 0 HB3 ARG A 150 -12.782 -8.257 8.786 1.00 1.01 H new ATOM 0 HG2 ARG A 150 -14.807 -9.383 6.812 1.00 1.12 H new ATOM 0 HG3 ARG A 150 -13.232 -10.074 7.148 1.00 1.12 H new ATOM 0 HD2 ARG A 150 -13.856 -10.442 9.504 1.00 1.43 H new ATOM 0 HD3 ARG A 150 -15.402 -9.657 9.244 1.00 1.43 H new ATOM 0 HE ARG A 150 -16.220 -11.681 8.494 1.00 1.84 H new ATOM 0 HH11 ARG A 150 -12.737 -11.559 7.910 1.00 2.45 H new ATOM 0 HH12 ARG A 150 -12.679 -13.188 7.230 1.00 2.45 H new ATOM 0 HH21 ARG A 150 -16.134 -13.771 7.618 1.00 2.86 H new ATOM 0 HH22 ARG A 150 -14.593 -14.435 7.065 1.00 2.86 H new ATOM 2396 N ALA A 151 -14.063 -4.817 8.533 1.00 0.88 N ATOM 2397 CA ALA A 151 -13.467 -3.618 9.100 1.00 0.91 C ATOM 2398 C ALA A 151 -14.417 -2.435 9.022 1.00 0.92 C ATOM 2399 O ALA A 151 -15.130 -2.135 9.978 1.00 1.18 O ATOM 2400 CB ALA A 151 -12.157 -3.296 8.394 1.00 0.89 C ATOM 0 H ALA A 151 -14.505 -4.689 7.623 1.00 0.88 H new ATOM 0 HA ALA A 151 -13.264 -3.811 10.153 1.00 0.91 H new ATOM 0 HB1 ALA A 151 -11.721 -2.396 8.828 1.00 0.89 H new ATOM 0 HB2 ALA A 151 -11.464 -4.129 8.514 1.00 0.89 H new ATOM 0 HB3 ALA A 151 -12.346 -3.132 7.333 1.00 0.89 H new ATOM 2406 N PHE A 152 -14.413 -1.761 7.880 1.00 0.79 N ATOM 2407 CA PHE A 152 -15.268 -0.605 7.684 1.00 0.99 C ATOM 2408 C PHE A 152 -16.320 -0.873 6.613 1.00 0.88 C ATOM 2409 O PHE A 152 -16.834 -1.984 6.500 1.00 1.32 O ATOM 2410 CB PHE A 152 -14.420 0.602 7.300 1.00 1.26 C ATOM 2411 CG PHE A 152 -13.603 1.166 8.431 1.00 2.02 C ATOM 2412 CD1 PHE A 152 -12.690 0.376 9.114 1.00 2.81 C ATOM 2413 CD2 PHE A 152 -13.743 2.492 8.805 1.00 2.37 C ATOM 2414 CE1 PHE A 152 -11.937 0.897 10.149 1.00 3.76 C ATOM 2415 CE2 PHE A 152 -12.992 3.019 9.839 1.00 3.27 C ATOM 2416 CZ PHE A 152 -12.089 2.221 10.512 1.00 3.92 C ATOM 0 H PHE A 152 -13.828 -1.996 7.079 1.00 0.79 H new ATOM 0 HA PHE A 152 -15.788 -0.399 8.619 1.00 0.99 H new ATOM 0 HB2 PHE A 152 -13.750 0.318 6.489 1.00 1.26 H new ATOM 0 HB3 PHE A 152 -15.074 1.384 6.914 1.00 1.26 H new ATOM 0 HD1 PHE A 152 -12.566 -0.659 8.833 1.00 2.81 H new ATOM 0 HD2 PHE A 152 -14.448 3.122 8.282 1.00 2.37 H new ATOM 0 HE1 PHE A 152 -11.231 0.270 10.673 1.00 3.76 H new ATOM 0 HE2 PHE A 152 -13.112 4.055 10.120 1.00 3.27 H new ATOM 0 HZ PHE A 152 -11.502 2.631 11.321 1.00 3.92 H new ATOM 2426 N ASP A 153 -16.636 0.154 5.829 1.00 0.92 N ATOM 2427 CA ASP A 153 -17.623 0.034 4.767 1.00 1.10 C ATOM 2428 C ASP A 153 -17.112 0.695 3.494 1.00 1.14 C ATOM 2429 O ASP A 153 -17.162 0.111 2.412 1.00 1.88 O ATOM 2430 CB ASP A 153 -18.943 0.678 5.194 1.00 1.43 C ATOM 2431 CG ASP A 153 -19.489 0.084 6.477 1.00 2.10 C ATOM 2432 OD1 ASP A 153 -19.749 -1.138 6.502 1.00 2.58 O ATOM 2433 OD2 ASP A 153 -19.654 0.838 7.459 1.00 2.80 O ATOM 0 H ASP A 153 -16.219 1.081 5.912 1.00 0.92 H new ATOM 0 HA ASP A 153 -17.794 -1.025 4.571 1.00 1.10 H new ATOM 0 HB2 ASP A 153 -18.794 1.750 5.328 1.00 1.43 H new ATOM 0 HB3 ASP A 153 -19.678 0.555 4.399 1.00 1.43 H new ATOM 2438 N LYS A 154 -16.614 1.922 3.639 1.00 0.75 N ATOM 2439 CA LYS A 154 -16.083 2.680 2.513 1.00 0.78 C ATOM 2440 C LYS A 154 -15.524 4.018 2.994 1.00 0.91 C ATOM 2441 O LYS A 154 -16.272 4.971 3.217 1.00 1.80 O ATOM 2442 CB LYS A 154 -17.179 2.890 1.458 1.00 0.89 C ATOM 2443 CG LYS A 154 -16.703 3.568 0.180 1.00 0.86 C ATOM 2444 CD LYS A 154 -16.767 5.082 0.288 1.00 1.03 C ATOM 2445 CE LYS A 154 -16.267 5.757 -0.979 1.00 1.54 C ATOM 2446 NZ LYS A 154 -16.342 7.240 -0.882 1.00 2.17 N ATOM 0 H LYS A 154 -16.568 2.413 4.532 1.00 0.75 H new ATOM 0 HA LYS A 154 -15.269 2.117 2.055 1.00 0.78 H new ATOM 0 HB2 LYS A 154 -17.610 1.922 1.202 1.00 0.89 H new ATOM 0 HB3 LYS A 154 -17.978 3.488 1.896 1.00 0.89 H new ATOM 0 HG2 LYS A 154 -15.679 3.262 -0.034 1.00 0.86 H new ATOM 0 HG3 LYS A 154 -17.317 3.237 -0.658 1.00 0.86 H new ATOM 0 HD2 LYS A 154 -17.794 5.390 0.483 1.00 1.03 H new ATOM 0 HD3 LYS A 154 -16.168 5.412 1.137 1.00 1.03 H new ATOM 0 HE2 LYS A 154 -15.236 5.457 -1.168 1.00 1.54 H new ATOM 0 HE3 LYS A 154 -16.859 5.418 -1.829 1.00 1.54 H new ATOM 0 HZ1 LYS A 154 -15.992 7.664 -1.765 1.00 2.17 H new ATOM 0 HZ2 LYS A 154 -17.329 7.528 -0.727 1.00 2.17 H new ATOM 0 HZ3 LYS A 154 -15.757 7.566 -0.086 1.00 2.17 H new ATOM 2460 N LEU A 155 -14.203 4.077 3.160 1.00 0.61 N ATOM 2461 CA LEU A 155 -13.536 5.294 3.620 1.00 0.61 C ATOM 2462 C LEU A 155 -13.783 6.443 2.647 1.00 0.68 C ATOM 2463 O LEU A 155 -14.446 6.267 1.626 1.00 0.89 O ATOM 2464 CB LEU A 155 -12.030 5.052 3.771 1.00 0.60 C ATOM 2465 CG LEU A 155 -11.638 3.909 4.715 1.00 0.60 C ATOM 2466 CD1 LEU A 155 -10.125 3.792 4.806 1.00 1.18 C ATOM 2467 CD2 LEU A 155 -12.236 4.123 6.099 1.00 1.23 C ATOM 0 H LEU A 155 -13.573 3.295 2.982 1.00 0.61 H new ATOM 0 HA LEU A 155 -13.951 5.564 4.591 1.00 0.61 H new ATOM 0 HB2 LEU A 155 -11.612 4.846 2.786 1.00 0.60 H new ATOM 0 HB3 LEU A 155 -11.566 5.971 4.129 1.00 0.60 H new ATOM 0 HG LEU A 155 -12.037 2.979 4.309 1.00 0.60 H new ATOM 0 HD11 LEU A 155 -9.863 2.976 5.480 1.00 1.18 H new ATOM 0 HD12 LEU A 155 -9.715 3.591 3.816 1.00 1.18 H new ATOM 0 HD13 LEU A 155 -9.710 4.725 5.187 1.00 1.18 H new ATOM 0 HD21 LEU A 155 -11.945 3.300 6.752 1.00 1.23 H new ATOM 0 HD22 LEU A 155 -11.869 5.062 6.513 1.00 1.23 H new ATOM 0 HD23 LEU A 155 -13.323 4.160 6.024 1.00 1.23 H new ATOM 2479 N ASN A 156 -13.240 7.620 2.950 1.00 0.66 N ATOM 2480 CA ASN A 156 -13.413 8.770 2.077 1.00 0.77 C ATOM 2481 C ASN A 156 -12.132 9.031 1.309 1.00 0.65 C ATOM 2482 O ASN A 156 -11.044 8.701 1.778 1.00 0.69 O ATOM 2483 CB ASN A 156 -13.809 10.011 2.880 1.00 1.04 C ATOM 2484 CG ASN A 156 -12.724 10.454 3.838 1.00 1.66 C ATOM 2485 OD1 ASN A 156 -11.618 10.806 3.426 1.00 2.44 O ATOM 2486 ND2 ASN A 156 -13.033 10.440 5.127 1.00 2.12 N ATOM 0 H ASN A 156 -12.683 7.798 3.785 1.00 0.66 H new ATOM 0 HA ASN A 156 -14.216 8.551 1.373 1.00 0.77 H new ATOM 0 HB2 ASN A 156 -14.037 10.826 2.193 1.00 1.04 H new ATOM 0 HB3 ASN A 156 -14.720 9.801 3.440 1.00 1.04 H new ATOM 0 HD21 ASN A 156 -12.342 10.728 5.820 1.00 2.12 H new ATOM 0 HD22 ASN A 156 -13.961 10.141 5.426 1.00 2.12 H new ATOM 2493 N LYS A 157 -12.257 9.620 0.133 1.00 0.64 N ATOM 2494 CA LYS A 157 -11.094 9.912 -0.687 1.00 0.64 C ATOM 2495 C LYS A 157 -10.407 11.170 -0.188 1.00 0.68 C ATOM 2496 O LYS A 157 -10.692 12.277 -0.646 1.00 0.95 O ATOM 2497 CB LYS A 157 -11.492 10.064 -2.149 1.00 0.79 C ATOM 2498 CG LYS A 157 -10.394 9.671 -3.127 1.00 0.96 C ATOM 2499 CD LYS A 157 -10.105 8.178 -3.069 1.00 1.67 C ATOM 2500 CE LYS A 157 -11.317 7.356 -3.488 1.00 1.70 C ATOM 2501 NZ LYS A 157 -11.046 5.893 -3.432 1.00 2.51 N ATOM 0 H LYS A 157 -13.148 9.905 -0.275 1.00 0.64 H new ATOM 0 HA LYS A 157 -10.396 9.078 -0.610 1.00 0.64 H new ATOM 0 HB2 LYS A 157 -12.374 9.453 -2.342 1.00 0.79 H new ATOM 0 HB3 LYS A 157 -11.776 11.100 -2.333 1.00 0.79 H new ATOM 0 HG2 LYS A 157 -10.691 9.946 -4.139 1.00 0.96 H new ATOM 0 HG3 LYS A 157 -9.485 10.228 -2.899 1.00 0.96 H new ATOM 0 HD2 LYS A 157 -9.263 7.944 -3.721 1.00 1.67 H new ATOM 0 HD3 LYS A 157 -9.810 7.903 -2.056 1.00 1.67 H new ATOM 0 HE2 LYS A 157 -12.159 7.594 -2.837 1.00 1.70 H new ATOM 0 HE3 LYS A 157 -11.609 7.632 -4.501 1.00 1.70 H new ATOM 0 HZ1 LYS A 157 -11.892 5.396 -3.087 1.00 2.51 H new ATOM 0 HZ2 LYS A 157 -10.806 5.548 -4.383 1.00 2.51 H new ATOM 0 HZ3 LYS A 157 -10.251 5.712 -2.787 1.00 2.51 H new ATOM 2515 N TRP A 158 -9.501 10.977 0.757 1.00 0.73 N ATOM 2516 CA TRP A 158 -8.749 12.068 1.351 1.00 0.83 C ATOM 2517 C TRP A 158 -9.671 13.208 1.780 1.00 1.08 C ATOM 2518 O TRP A 158 -10.267 13.107 2.872 1.00 1.47 O ATOM 2519 CB TRP A 158 -7.704 12.577 0.357 1.00 0.85 C ATOM 2520 CG TRP A 158 -6.698 13.507 0.963 1.00 1.04 C ATOM 2521 CD1 TRP A 158 -6.022 13.333 2.137 1.00 1.51 C ATOM 2522 CD2 TRP A 158 -6.253 14.757 0.425 1.00 1.55 C ATOM 2523 NE1 TRP A 158 -5.184 14.399 2.361 1.00 1.52 N ATOM 2524 CE2 TRP A 158 -5.308 15.285 1.324 1.00 1.52 C ATOM 2525 CE3 TRP A 158 -6.561 15.481 -0.731 1.00 2.50 C ATOM 2526 CZ2 TRP A 158 -4.670 16.504 1.103 1.00 2.07 C ATOM 2527 CZ3 TRP A 158 -5.928 16.689 -0.949 1.00 3.24 C ATOM 2528 CH2 TRP A 158 -4.991 17.190 -0.036 1.00 2.95 C ATOM 2529 OXT TRP A 158 -9.790 14.192 1.018 1.00 1.75 O ATOM 0 H TRP A 158 -9.267 10.058 1.133 1.00 0.73 H new ATOM 0 HA TRP A 158 -8.247 11.692 2.243 1.00 0.83 H new ATOM 0 HB2 TRP A 158 -7.182 11.724 -0.076 1.00 0.85 H new ATOM 0 HB3 TRP A 158 -8.212 13.089 -0.460 1.00 0.85 H new ATOM 0 HD1 TRP A 158 -6.130 12.482 2.793 1.00 1.51 H new ATOM 0 HE1 TRP A 158 -4.570 14.512 3.168 1.00 1.52 H new ATOM 0 HE3 TRP A 158 -7.281 15.102 -1.441 1.00 2.50 H new ATOM 0 HZ2 TRP A 158 -3.948 16.893 1.806 1.00 2.07 H new ATOM 0 HZ3 TRP A 158 -6.159 17.257 -1.838 1.00 3.24 H new ATOM 0 HH2 TRP A 158 -4.512 18.137 -0.236 1.00 2.95 H new