USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 957 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 84 SER OG : rot -97:sc= 0.206 USER MOD Set 1.2: A 123 TYR OH : rot -151:sc= 1.14 USER MOD Set 2.1: A 75 ASN : amide:sc= 1.3 K(o=2.6,f=-5.3) USER MOD Set 2.2: A 104 ASN : amide:sc= 1.34 K(o=2.6,f=-4.5!) USER MOD Set 3.1: A 59 GLN :FLIP amide:sc= 0 F(o=-0.77,f=0) USER MOD Set 3.2: A 61 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Set 4.1: A 39 SER OG : rot 176:sc= 1.84 USER MOD Set 4.2: A 68 GLN : amide:sc= 0.027 K(o=1.9,f=-0.79) USER MOD Single : A 4 LYS NZ :NH3+ 157:sc= 0.519 (180deg=0.198) USER MOD Single : A 5 LYS NZ :NH3+ -160:sc= 1.29 (180deg=0.969) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0265 USER MOD Single : A 10 TYR OH : rot 70:sc= -0.259 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 13:sc= 0.0367 USER MOD Single : A 14 SER OG : rot -43:sc= 0.0104 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.262 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 176:sc=-0.00491 (180deg=-0.0404) USER MOD Single : A 23 LYS NZ :NH3+ -173:sc= 1.26 (180deg=1.17) USER MOD Single : A 25 ASN : amide:sc= -0.591 X(o=-0.59,f=-1) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 159:sc= 1.26 (180deg=1.18) USER MOD Single : A 31 SER OG : rot -40:sc= -0.165 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 101:sc= 1.1 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.044 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0.133 K(o=0.13,f=-1) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc=-0.00611 X(o=-0.0061,f=-0.0061) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0.699 K(o=0.7,f=0) USER MOD Single : A 77 TYR OH : rot -8:sc= 1.3 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 147:sc= 0.0619 (180deg=0.0264) USER MOD Single : A 97 THR OG1 : rot 120:sc= -0.342 USER MOD Single : A 101 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.084) USER MOD Single : A 102 MET CE :methyl -161:sc=-0.00219 (180deg=-0.276) USER MOD Single : A 103 LYS NZ :NH3+ 162:sc= 1.17 (180deg=0.916) USER MOD Single : A 105 TYR OH : rot 158:sc= 1.26 USER MOD Single : A 111 SER OG : rot 152:sc= 2.06 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -1.21 K(o=-1.2,f=-1.9) USER MOD Single : A 120 HIS : no HD1:sc= -0.885 X(o=-0.89,f=-0.69) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS :FLIP no HD1:sc= -0.727 F(o=-2,f=-0.73) USER MOD Single : A 128 ASN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 135 ASN : amide:sc= -0.241 X(o=-0.24,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -179:sc= 1.3 (180deg=1.23) USER MOD Single : A 150 SER OG : rot -48:sc= -0.0178 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 33 N LYS A 4 -5.161 -17.423 -1.323 1.00 4.22 N ATOM 34 CA LYS A 4 -3.874 -16.890 -0.883 1.00 1.54 C ATOM 35 C LYS A 4 -3.137 -16.232 -2.042 1.00 21.22 C ATOM 36 O LYS A 4 -2.223 -16.805 -2.636 1.00 35.12 O ATOM 37 CB LYS A 4 -3.059 -17.937 -0.101 1.00 53.53 C ATOM 38 CG LYS A 4 -2.383 -19.121 -0.837 1.00 64.42 C ATOM 39 CD LYS A 4 -3.249 -19.996 -1.761 1.00 23.44 C ATOM 40 CE LYS A 4 -3.505 -19.484 -3.189 1.00 33.23 C ATOM 41 NZ LYS A 4 -2.290 -19.317 -4.007 1.00 52.51 N ATOM 0 HA LYS A 4 -4.046 -16.092 -0.161 1.00 1.54 H new ATOM 0 HB2 LYS A 4 -2.274 -17.400 0.432 1.00 53.53 H new ATOM 0 HB3 LYS A 4 -3.722 -18.363 0.652 1.00 53.53 H new ATOM 0 HG2 LYS A 4 -1.564 -18.718 -1.433 1.00 64.42 H new ATOM 0 HG3 LYS A 4 -1.939 -19.771 -0.083 1.00 64.42 H new ATOM 0 HD2 LYS A 4 -2.778 -20.976 -1.835 1.00 23.44 H new ATOM 0 HD3 LYS A 4 -4.215 -20.142 -1.278 1.00 23.44 H new ATOM 0 HE2 LYS A 4 -4.176 -20.178 -3.695 1.00 33.23 H new ATOM 0 HE3 LYS A 4 -4.022 -18.526 -3.130 1.00 33.23 H new ATOM 0 HZ1 LYS A 4 -2.542 -19.355 -5.015 1.00 52.51 H new ATOM 0 HZ2 LYS A 4 -1.852 -18.398 -3.794 1.00 52.51 H new ATOM 0 HZ3 LYS A 4 -1.617 -20.080 -3.789 1.00 52.51 H new ATOM 51 N LYS A 5 -3.588 -15.056 -2.448 1.00 14.40 N ATOM 52 CA LYS A 5 -2.867 -14.209 -3.384 1.00 31.00 C ATOM 53 C LYS A 5 -2.406 -12.981 -2.656 1.00 1.50 C ATOM 54 O LYS A 5 -3.074 -12.514 -1.739 1.00 64.34 O ATOM 55 CB LYS A 5 -3.792 -13.813 -4.526 1.00 42.42 C ATOM 56 CG LYS A 5 -3.863 -14.940 -5.544 1.00 43.35 C ATOM 57 CD LYS A 5 -2.643 -14.947 -6.479 1.00 53.24 C ATOM 58 CE LYS A 5 -3.017 -15.303 -7.918 1.00 42.51 C ATOM 59 NZ LYS A 5 -1.955 -14.914 -8.865 1.00 52.45 N ATOM 0 H LYS A 5 -4.473 -14.659 -2.134 1.00 14.40 H new ATOM 0 HA LYS A 5 -2.009 -14.743 -3.792 1.00 31.00 H new ATOM 0 HB2 LYS A 5 -4.788 -13.595 -4.141 1.00 42.42 H new ATOM 0 HB3 LYS A 5 -3.428 -12.903 -5.002 1.00 42.42 H new ATOM 0 HG2 LYS A 5 -3.927 -15.896 -5.024 1.00 43.35 H new ATOM 0 HG3 LYS A 5 -4.773 -14.838 -6.135 1.00 43.35 H new ATOM 0 HD2 LYS A 5 -2.169 -13.966 -6.461 1.00 53.24 H new ATOM 0 HD3 LYS A 5 -1.909 -15.663 -6.109 1.00 53.24 H new ATOM 0 HE2 LYS A 5 -3.198 -16.375 -7.993 1.00 42.51 H new ATOM 0 HE3 LYS A 5 -3.947 -14.803 -8.188 1.00 42.51 H new ATOM 0 HZ1 LYS A 5 -2.352 -14.848 -9.824 1.00 52.45 H new ATOM 0 HZ2 LYS A 5 -1.564 -13.991 -8.588 1.00 52.45 H new ATOM 0 HZ3 LYS A 5 -1.199 -15.628 -8.852 1.00 52.45 H new ATOM 69 N THR A 6 -1.334 -12.402 -3.155 1.00 74.15 N ATOM 70 CA THR A 6 -0.765 -11.205 -2.567 1.00 63.11 C ATOM 71 C THR A 6 -0.265 -10.293 -3.689 1.00 20.23 C ATOM 72 O THR A 6 0.351 -10.763 -4.653 1.00 12.44 O ATOM 73 CB THR A 6 0.304 -11.618 -1.539 1.00 62.03 C ATOM 74 OG1 THR A 6 -0.247 -12.305 -0.442 1.00 4.30 O ATOM 75 CG2 THR A 6 1.032 -10.436 -0.914 1.00 74.24 C ATOM 0 H THR A 6 -0.834 -12.745 -3.975 1.00 74.15 H new ATOM 0 HA THR A 6 -1.502 -10.622 -2.015 1.00 63.11 H new ATOM 0 HB THR A 6 0.983 -12.239 -2.123 1.00 62.03 H new ATOM 0 HG1 THR A 6 0.467 -12.549 0.183 1.00 4.30 H new ATOM 0 HG21 THR A 6 1.771 -10.800 -0.200 1.00 74.24 H new ATOM 0 HG22 THR A 6 1.533 -9.863 -1.694 1.00 74.24 H new ATOM 0 HG23 THR A 6 0.314 -9.797 -0.400 1.00 74.24 H new ATOM 83 N LEU A 7 -0.591 -9.002 -3.578 1.00 73.02 N ATOM 84 CA LEU A 7 -0.149 -7.917 -4.462 1.00 60.01 C ATOM 85 C LEU A 7 0.678 -6.895 -3.658 1.00 41.23 C ATOM 86 O LEU A 7 0.537 -6.793 -2.435 1.00 55.41 O ATOM 87 CB LEU A 7 -1.411 -7.310 -5.094 1.00 40.32 C ATOM 88 CG LEU A 7 -1.209 -6.290 -6.224 1.00 3.30 C ATOM 89 CD1 LEU A 7 -0.354 -6.801 -7.389 1.00 23.11 C ATOM 90 CD2 LEU A 7 -2.592 -5.927 -6.785 1.00 11.32 C ATOM 0 H LEU A 7 -1.201 -8.667 -2.832 1.00 73.02 H new ATOM 0 HA LEU A 7 0.505 -8.273 -5.258 1.00 60.01 H new ATOM 0 HB2 LEU A 7 -2.021 -8.126 -5.481 1.00 40.32 H new ATOM 0 HB3 LEU A 7 -1.987 -6.829 -4.303 1.00 40.32 H new ATOM 0 HG LEU A 7 -0.680 -5.441 -5.790 1.00 3.30 H new ATOM 0 HD11 LEU A 7 -0.261 -6.019 -8.143 1.00 23.11 H new ATOM 0 HD12 LEU A 7 0.636 -7.071 -7.022 1.00 23.11 H new ATOM 0 HD13 LEU A 7 -0.828 -7.677 -7.831 1.00 23.11 H new ATOM 0 HD21 LEU A 7 -2.479 -5.202 -7.591 1.00 11.32 H new ATOM 0 HD22 LEU A 7 -3.076 -6.825 -7.169 1.00 11.32 H new ATOM 0 HD23 LEU A 7 -3.204 -5.496 -5.993 1.00 11.32 H new ATOM 101 N ILE A 8 1.545 -6.140 -4.333 1.00 62.13 N ATOM 102 CA ILE A 8 2.276 -4.977 -3.838 1.00 21.41 C ATOM 103 C ILE A 8 1.857 -3.836 -4.764 1.00 22.21 C ATOM 104 O ILE A 8 1.945 -3.991 -5.984 1.00 11.13 O ATOM 105 CB ILE A 8 3.812 -5.223 -3.876 1.00 51.53 C ATOM 106 CG1 ILE A 8 4.256 -6.354 -2.928 1.00 64.33 C ATOM 107 CG2 ILE A 8 4.582 -3.952 -3.496 1.00 43.13 C ATOM 108 CD1 ILE A 8 5.380 -7.278 -3.440 1.00 31.30 C ATOM 0 H ILE A 8 1.769 -6.340 -5.308 1.00 62.13 H new ATOM 0 HA ILE A 8 2.048 -4.754 -2.796 1.00 21.41 H new ATOM 0 HB ILE A 8 4.040 -5.515 -4.901 1.00 51.53 H new ATOM 0 HG12 ILE A 8 4.584 -5.905 -1.991 1.00 64.33 H new ATOM 0 HG13 ILE A 8 3.386 -6.969 -2.699 1.00 64.33 H new ATOM 0 HG21 ILE A 8 5.653 -4.151 -3.530 1.00 43.13 H new ATOM 0 HG22 ILE A 8 4.338 -3.155 -4.199 1.00 43.13 H new ATOM 0 HG23 ILE A 8 4.302 -3.645 -2.488 1.00 43.13 H new ATOM 0 HD11 ILE A 8 5.603 -8.032 -2.685 1.00 31.30 H new ATOM 0 HD12 ILE A 8 5.058 -7.768 -4.359 1.00 31.30 H new ATOM 0 HD13 ILE A 8 6.274 -6.687 -3.639 1.00 31.30 H new ATOM 119 N LEU A 9 1.383 -2.719 -4.206 1.00 2.40 N ATOM 120 CA LEU A 9 0.976 -1.518 -4.932 1.00 21.02 C ATOM 121 C LEU A 9 1.666 -0.312 -4.298 1.00 31.33 C ATOM 122 O LEU A 9 1.150 0.262 -3.337 1.00 34.04 O ATOM 123 CB LEU A 9 -0.552 -1.334 -4.875 1.00 33.21 C ATOM 124 CG LEU A 9 -1.384 -2.483 -5.463 1.00 63.14 C ATOM 125 CD1 LEU A 9 -2.868 -2.209 -5.232 1.00 20.21 C ATOM 126 CD2 LEU A 9 -1.107 -2.676 -6.955 1.00 11.34 C ATOM 0 H LEU A 9 1.269 -2.625 -3.197 1.00 2.40 H new ATOM 0 HA LEU A 9 1.265 -1.614 -5.979 1.00 21.02 H new ATOM 0 HB2 LEU A 9 -0.844 -1.194 -3.834 1.00 33.21 H new ATOM 0 HB3 LEU A 9 -0.809 -0.416 -5.404 1.00 33.21 H new ATOM 0 HG LEU A 9 -1.098 -3.404 -4.956 1.00 63.14 H new ATOM 0 HD11 LEU A 9 -3.458 -3.025 -5.650 1.00 20.21 H new ATOM 0 HD12 LEU A 9 -3.062 -2.132 -4.162 1.00 20.21 H new ATOM 0 HD13 LEU A 9 -3.146 -1.274 -5.719 1.00 20.21 H new ATOM 0 HD21 LEU A 9 -1.714 -3.498 -7.334 1.00 11.34 H new ATOM 0 HD22 LEU A 9 -1.357 -1.761 -7.493 1.00 11.34 H new ATOM 0 HD23 LEU A 9 -0.052 -2.906 -7.102 1.00 11.34 H new ATOM 137 N TYR A 10 2.841 0.081 -4.789 1.00 13.14 N ATOM 138 CA TYR A 10 3.524 1.276 -4.291 1.00 11.34 C ATOM 139 C TYR A 10 3.479 2.382 -5.332 1.00 12.13 C ATOM 140 O TYR A 10 3.300 2.150 -6.529 1.00 63.34 O ATOM 141 CB TYR A 10 4.966 0.955 -3.846 1.00 74.13 C ATOM 142 CG TYR A 10 5.735 0.075 -4.779 1.00 2.23 C ATOM 143 CD1 TYR A 10 5.893 0.436 -6.129 1.00 34.42 C ATOM 144 CD2 TYR A 10 6.257 -1.126 -4.279 1.00 23.33 C ATOM 145 CE1 TYR A 10 6.447 -0.469 -7.034 1.00 54.14 C ATOM 146 CE2 TYR A 10 6.779 -2.051 -5.197 1.00 75.43 C ATOM 147 CZ TYR A 10 6.849 -1.734 -6.579 1.00 73.25 C ATOM 148 OH TYR A 10 7.438 -2.562 -7.473 1.00 44.32 O ATOM 0 H TYR A 10 3.340 -0.410 -5.531 1.00 13.14 H new ATOM 0 HA TYR A 10 2.997 1.632 -3.406 1.00 11.34 H new ATOM 0 HB2 TYR A 10 5.509 1.892 -3.724 1.00 74.13 H new ATOM 0 HB3 TYR A 10 4.930 0.477 -2.867 1.00 74.13 H new ATOM 0 HD1 TYR A 10 5.585 1.415 -6.465 1.00 34.42 H new ATOM 0 HD2 TYR A 10 6.258 -1.334 -3.219 1.00 23.33 H new ATOM 0 HE1 TYR A 10 6.565 -0.199 -8.073 1.00 54.14 H new ATOM 0 HE2 TYR A 10 7.130 -3.011 -4.849 1.00 75.43 H new ATOM 0 HH TYR A 10 8.327 -2.218 -7.702 1.00 44.32 H new ATOM 157 N TYR A 11 3.791 3.584 -4.874 1.00 55.35 N ATOM 158 CA TYR A 11 4.165 4.704 -5.698 1.00 61.23 C ATOM 159 C TYR A 11 5.671 4.815 -5.518 1.00 4.34 C ATOM 160 O TYR A 11 6.161 4.768 -4.383 1.00 3.12 O ATOM 161 CB TYR A 11 3.398 5.932 -5.207 1.00 21.42 C ATOM 162 CG TYR A 11 3.968 7.259 -5.655 1.00 41.25 C ATOM 163 CD1 TYR A 11 4.120 7.550 -7.021 1.00 11.41 C ATOM 164 CD2 TYR A 11 4.343 8.212 -4.697 1.00 54.11 C ATOM 165 CE1 TYR A 11 4.580 8.814 -7.434 1.00 35.21 C ATOM 166 CE2 TYR A 11 4.863 9.449 -5.097 1.00 54.32 C ATOM 167 CZ TYR A 11 4.941 9.774 -6.464 1.00 51.41 C ATOM 168 OH TYR A 11 5.329 11.023 -6.829 1.00 22.03 O ATOM 0 H TYR A 11 3.788 3.806 -3.879 1.00 55.35 H new ATOM 0 HA TYR A 11 3.926 4.601 -6.756 1.00 61.23 H new ATOM 0 HB2 TYR A 11 2.367 5.861 -5.553 1.00 21.42 H new ATOM 0 HB3 TYR A 11 3.371 5.914 -4.117 1.00 21.42 H new ATOM 0 HD1 TYR A 11 3.882 6.798 -7.759 1.00 11.41 H new ATOM 0 HD2 TYR A 11 4.230 7.991 -3.646 1.00 54.11 H new ATOM 0 HE1 TYR A 11 4.656 9.048 -8.486 1.00 35.21 H new ATOM 0 HE2 TYR A 11 5.205 10.155 -4.355 1.00 54.32 H new ATOM 0 HH TYR A 11 5.539 11.548 -6.028 1.00 22.03 H new ATOM 177 N SER A 12 6.432 4.856 -6.609 1.00 3.21 N ATOM 178 CA SER A 12 7.836 5.209 -6.522 1.00 72.22 C ATOM 179 C SER A 12 7.920 6.730 -6.617 1.00 20.22 C ATOM 180 O SER A 12 7.342 7.297 -7.545 1.00 74.32 O ATOM 181 CB SER A 12 8.648 4.486 -7.603 1.00 14.13 C ATOM 182 OG SER A 12 8.326 4.929 -8.904 1.00 74.34 O ATOM 0 H SER A 12 6.100 4.651 -7.551 1.00 3.21 H new ATOM 0 HA SER A 12 8.274 4.887 -5.577 1.00 72.22 H new ATOM 0 HB2 SER A 12 9.711 4.643 -7.421 1.00 14.13 H new ATOM 0 HB3 SER A 12 8.468 3.413 -7.532 1.00 14.13 H new ATOM 0 HG SER A 12 7.802 5.755 -8.848 1.00 74.34 H new ATOM 187 N TRP A 13 8.644 7.384 -5.700 1.00 4.54 N ATOM 188 CA TRP A 13 8.822 8.833 -5.724 1.00 41.52 C ATOM 189 C TRP A 13 9.533 9.274 -7.016 1.00 21.11 C ATOM 190 O TRP A 13 8.871 9.618 -7.995 1.00 3.43 O ATOM 191 CB TRP A 13 9.516 9.285 -4.434 1.00 24.41 C ATOM 192 CG TRP A 13 9.412 10.747 -4.134 1.00 24.34 C ATOM 193 CD1 TRP A 13 8.305 11.503 -4.319 1.00 12.21 C ATOM 194 CD2 TRP A 13 10.418 11.657 -3.588 1.00 32.44 C ATOM 195 NE1 TRP A 13 8.548 12.788 -3.899 1.00 0.53 N ATOM 196 CE2 TRP A 13 9.837 12.952 -3.462 1.00 60.31 C ATOM 197 CE3 TRP A 13 11.761 11.527 -3.177 1.00 40.12 C ATOM 198 CZ2 TRP A 13 10.546 14.057 -2.974 1.00 42.25 C ATOM 199 CZ3 TRP A 13 12.486 12.628 -2.686 1.00 21.43 C ATOM 200 CH2 TRP A 13 11.887 13.896 -2.592 1.00 54.24 C ATOM 0 H TRP A 13 9.119 6.922 -4.925 1.00 4.54 H new ATOM 0 HA TRP A 13 7.855 9.335 -5.747 1.00 41.52 H new ATOM 0 HB2 TRP A 13 9.093 8.728 -3.598 1.00 24.41 H new ATOM 0 HB3 TRP A 13 10.571 9.017 -4.495 1.00 24.41 H new ATOM 0 HD1 TRP A 13 7.372 11.150 -4.734 1.00 12.21 H new ATOM 0 HE1 TRP A 13 7.851 13.533 -3.911 1.00 0.53 H new ATOM 0 HE3 TRP A 13 12.243 10.562 -3.241 1.00 40.12 H new ATOM 0 HZ2 TRP A 13 10.067 15.021 -2.893 1.00 42.25 H new ATOM 0 HZ3 TRP A 13 13.513 12.498 -2.378 1.00 21.43 H new ATOM 0 HH2 TRP A 13 12.454 14.740 -2.229 1.00 54.24 H new ATOM 210 N SER A 14 10.868 9.173 -7.072 1.00 32.11 N ATOM 211 CA SER A 14 11.630 9.464 -8.288 1.00 71.35 C ATOM 212 C SER A 14 12.876 8.583 -8.486 1.00 40.34 C ATOM 213 O SER A 14 13.507 8.669 -9.540 1.00 2.50 O ATOM 214 CB SER A 14 11.995 10.950 -8.298 1.00 12.30 C ATOM 215 OG SER A 14 12.103 11.402 -9.633 1.00 24.43 O ATOM 0 H SER A 14 11.444 8.889 -6.280 1.00 32.11 H new ATOM 0 HA SER A 14 10.988 9.221 -9.134 1.00 71.35 H new ATOM 0 HB2 SER A 14 11.235 11.525 -7.769 1.00 12.30 H new ATOM 0 HB3 SER A 14 12.937 11.107 -7.773 1.00 12.30 H new ATOM 0 HG SER A 14 12.589 10.738 -10.165 1.00 24.43 H new ATOM 220 N GLY A 15 13.230 7.726 -7.528 1.00 62.01 N ATOM 221 CA GLY A 15 14.353 6.792 -7.616 1.00 43.11 C ATOM 222 C GLY A 15 14.779 6.279 -6.237 1.00 11.41 C ATOM 223 O GLY A 15 15.940 5.940 -6.029 1.00 40.14 O ATOM 0 H GLY A 15 12.728 7.661 -6.642 1.00 62.01 H new ATOM 0 HA2 GLY A 15 14.075 5.948 -8.247 1.00 43.11 H new ATOM 0 HA3 GLY A 15 15.198 7.285 -8.097 1.00 43.11 H new ATOM 227 N GLU A 16 13.861 6.279 -5.269 1.00 74.23 N ATOM 228 CA GLU A 16 14.143 6.257 -3.840 1.00 44.13 C ATOM 229 C GLU A 16 13.288 5.145 -3.232 1.00 51.22 C ATOM 230 O GLU A 16 13.816 4.113 -2.812 1.00 42.54 O ATOM 231 CB GLU A 16 13.832 7.646 -3.244 1.00 43.52 C ATOM 232 CG GLU A 16 14.635 8.800 -3.885 1.00 12.51 C ATOM 233 CD GLU A 16 15.647 9.418 -2.927 1.00 54.33 C ATOM 234 OE1 GLU A 16 16.717 8.803 -2.719 1.00 34.31 O ATOM 235 OE2 GLU A 16 15.383 10.521 -2.396 1.00 34.20 O ATOM 0 H GLU A 16 12.861 6.295 -5.472 1.00 74.23 H new ATOM 0 HA GLU A 16 15.191 6.051 -3.624 1.00 44.13 H new ATOM 0 HB2 GLU A 16 12.768 7.850 -3.360 1.00 43.52 H new ATOM 0 HB3 GLU A 16 14.038 7.625 -2.174 1.00 43.52 H new ATOM 0 HG2 GLU A 16 15.156 8.428 -4.767 1.00 12.51 H new ATOM 0 HG3 GLU A 16 13.945 9.572 -4.225 1.00 12.51 H new ATOM 240 N THR A 17 11.957 5.285 -3.277 1.00 73.02 N ATOM 241 CA THR A 17 11.005 4.279 -2.804 1.00 55.14 C ATOM 242 C THR A 17 11.238 2.939 -3.516 1.00 52.13 C ATOM 243 O THR A 17 11.108 1.885 -2.898 1.00 63.23 O ATOM 244 CB THR A 17 9.555 4.787 -2.967 1.00 32.40 C ATOM 245 OG1 THR A 17 9.510 6.204 -2.933 1.00 31.20 O ATOM 246 CG2 THR A 17 8.570 4.221 -1.931 1.00 62.35 C ATOM 0 H THR A 17 11.505 6.119 -3.652 1.00 73.02 H new ATOM 0 HA THR A 17 11.167 4.108 -1.740 1.00 55.14 H new ATOM 0 HB THR A 17 9.232 4.420 -3.941 1.00 32.40 H new ATOM 0 HG1 THR A 17 8.583 6.505 -3.040 1.00 31.20 H new ATOM 0 HG21 THR A 17 7.575 4.627 -2.115 1.00 62.35 H new ATOM 0 HG22 THR A 17 8.540 3.135 -2.014 1.00 62.35 H new ATOM 0 HG23 THR A 17 8.896 4.500 -0.929 1.00 62.35 H new ATOM 254 N LYS A 18 11.702 2.989 -4.770 1.00 2.24 N ATOM 255 CA LYS A 18 12.101 1.850 -5.586 1.00 63.25 C ATOM 256 C LYS A 18 13.038 0.867 -4.869 1.00 21.13 C ATOM 257 O LYS A 18 12.818 -0.334 -4.999 1.00 73.14 O ATOM 258 CB LYS A 18 12.615 2.383 -6.938 1.00 43.22 C ATOM 259 CG LYS A 18 13.469 1.372 -7.722 1.00 42.23 C ATOM 260 CD LYS A 18 13.791 1.833 -9.148 1.00 41.23 C ATOM 261 CE LYS A 18 15.016 2.755 -9.192 1.00 23.34 C ATOM 262 NZ LYS A 18 15.464 2.996 -10.579 1.00 33.22 N ATOM 0 H LYS A 18 11.813 3.875 -5.264 1.00 2.24 H new ATOM 0 HA LYS A 18 11.234 1.219 -5.780 1.00 63.25 H new ATOM 0 HB2 LYS A 18 11.762 2.675 -7.550 1.00 43.22 H new ATOM 0 HB3 LYS A 18 13.205 3.283 -6.762 1.00 43.22 H new ATOM 0 HG2 LYS A 18 14.401 1.198 -7.184 1.00 42.23 H new ATOM 0 HG3 LYS A 18 12.943 0.418 -7.765 1.00 42.23 H new ATOM 0 HD2 LYS A 18 13.970 0.962 -9.779 1.00 41.23 H new ATOM 0 HD3 LYS A 18 12.929 2.355 -9.563 1.00 41.23 H new ATOM 0 HE2 LYS A 18 14.774 3.706 -8.716 1.00 23.34 H new ATOM 0 HE3 LYS A 18 15.829 2.309 -8.618 1.00 23.34 H new ATOM 0 HZ1 LYS A 18 16.294 3.623 -10.572 1.00 33.22 H new ATOM 0 HZ2 LYS A 18 15.718 2.091 -11.024 1.00 33.22 H new ATOM 0 HZ3 LYS A 18 14.696 3.444 -11.119 1.00 33.22 H new ATOM 272 N LYS A 19 14.008 1.306 -4.051 1.00 51.43 N ATOM 273 CA LYS A 19 14.845 0.357 -3.292 1.00 62.15 C ATOM 274 C LYS A 19 13.987 -0.613 -2.473 1.00 40.42 C ATOM 275 O LYS A 19 14.264 -1.809 -2.407 1.00 13.51 O ATOM 276 CB LYS A 19 15.779 1.100 -2.317 1.00 14.20 C ATOM 277 CG LYS A 19 16.950 1.874 -2.951 1.00 0.44 C ATOM 278 CD LYS A 19 18.316 1.403 -2.419 1.00 20.23 C ATOM 279 CE LYS A 19 18.516 1.684 -0.922 1.00 31.13 C ATOM 280 NZ LYS A 19 19.601 0.872 -0.324 1.00 22.11 N ATOM 0 H LYS A 19 14.231 2.290 -3.898 1.00 51.43 H new ATOM 0 HA LYS A 19 15.431 -0.196 -4.026 1.00 62.15 H new ATOM 0 HB2 LYS A 19 15.180 1.801 -1.736 1.00 14.20 H new ATOM 0 HB3 LYS A 19 16.189 0.374 -1.615 1.00 14.20 H new ATOM 0 HG2 LYS A 19 16.921 1.750 -4.034 1.00 0.44 H new ATOM 0 HG3 LYS A 19 16.831 2.939 -2.749 1.00 0.44 H new ATOM 0 HD2 LYS A 19 18.418 0.332 -2.597 1.00 20.23 H new ATOM 0 HD3 LYS A 19 19.107 1.897 -2.983 1.00 20.23 H new ATOM 0 HE2 LYS A 19 18.741 2.741 -0.783 1.00 31.13 H new ATOM 0 HE3 LYS A 19 17.585 1.484 -0.392 1.00 31.13 H new ATOM 0 HZ1 LYS A 19 19.691 1.103 0.686 1.00 22.11 H new ATOM 0 HZ2 LYS A 19 19.377 -0.138 -0.430 1.00 22.11 H new ATOM 0 HZ3 LYS A 19 20.498 1.080 -0.808 1.00 22.11 H new ATOM 290 N MET A 20 12.943 -0.073 -1.848 1.00 21.01 N ATOM 291 CA MET A 20 12.068 -0.766 -0.918 1.00 63.15 C ATOM 292 C MET A 20 11.109 -1.718 -1.640 1.00 53.13 C ATOM 293 O MET A 20 10.499 -2.572 -1.002 1.00 20.20 O ATOM 294 CB MET A 20 11.300 0.317 -0.138 1.00 22.11 C ATOM 295 CG MET A 20 10.760 -0.134 1.218 1.00 31.20 C ATOM 296 SD MET A 20 11.972 -0.881 2.340 1.00 42.23 S ATOM 297 CE MET A 20 13.287 0.367 2.377 1.00 72.24 C ATOM 0 H MET A 20 12.676 0.902 -1.985 1.00 21.01 H new ATOM 0 HA MET A 20 12.652 -1.391 -0.242 1.00 63.15 H new ATOM 0 HB2 MET A 20 11.959 1.172 0.015 1.00 22.11 H new ATOM 0 HB3 MET A 20 10.466 0.663 -0.749 1.00 22.11 H new ATOM 0 HG2 MET A 20 10.315 0.728 1.716 1.00 31.20 H new ATOM 0 HG3 MET A 20 9.959 -0.853 1.048 1.00 31.20 H new ATOM 0 HE1 MET A 20 14.058 0.062 3.085 1.00 72.24 H new ATOM 0 HE2 MET A 20 13.725 0.464 1.383 1.00 72.24 H new ATOM 0 HE3 MET A 20 12.870 1.326 2.685 1.00 72.24 H new ATOM 305 N ALA A 21 10.941 -1.576 -2.957 1.00 34.02 N ATOM 306 CA ALA A 21 10.132 -2.441 -3.775 1.00 22.00 C ATOM 307 C ALA A 21 10.929 -3.710 -4.050 1.00 52.35 C ATOM 308 O ALA A 21 10.493 -4.798 -3.677 1.00 44.54 O ATOM 309 CB ALA A 21 9.764 -1.669 -5.039 1.00 0.54 C ATOM 0 H ALA A 21 11.385 -0.826 -3.487 1.00 34.02 H new ATOM 0 HA ALA A 21 9.203 -2.742 -3.290 1.00 22.00 H new ATOM 0 HB1 ALA A 21 9.149 -2.297 -5.683 1.00 0.54 H new ATOM 0 HB2 ALA A 21 9.207 -0.772 -4.768 1.00 0.54 H new ATOM 0 HB3 ALA A 21 10.673 -1.385 -5.570 1.00 0.54 H new ATOM 315 N GLU A 22 12.110 -3.564 -4.658 1.00 74.41 N ATOM 316 CA GLU A 22 12.916 -4.698 -5.098 1.00 40.14 C ATOM 317 C GLU A 22 13.251 -5.620 -3.923 1.00 63.23 C ATOM 318 O GLU A 22 13.133 -6.837 -4.045 1.00 62.12 O ATOM 319 CB GLU A 22 14.230 -4.223 -5.757 1.00 74.24 C ATOM 320 CG GLU A 22 14.084 -3.174 -6.875 1.00 2.44 C ATOM 321 CD GLU A 22 15.411 -2.822 -7.570 1.00 74.04 C ATOM 322 OE1 GLU A 22 16.457 -3.477 -7.330 1.00 34.42 O ATOM 323 OE2 GLU A 22 15.429 -1.898 -8.409 1.00 33.43 O ATOM 0 H GLU A 22 12.530 -2.656 -4.857 1.00 74.41 H new ATOM 0 HA GLU A 22 12.326 -5.248 -5.831 1.00 40.14 H new ATOM 0 HB2 GLU A 22 14.874 -3.810 -4.981 1.00 74.24 H new ATOM 0 HB3 GLU A 22 14.743 -5.093 -6.167 1.00 74.24 H new ATOM 0 HG2 GLU A 22 13.381 -3.546 -7.620 1.00 2.44 H new ATOM 0 HG3 GLU A 22 13.652 -2.266 -6.455 1.00 2.44 H new ATOM 328 N LYS A 23 13.665 -5.053 -2.776 1.00 24.24 N ATOM 329 CA LYS A 23 14.055 -5.866 -1.624 1.00 33.10 C ATOM 330 C LYS A 23 12.887 -6.755 -1.200 1.00 54.45 C ATOM 331 O LYS A 23 13.019 -7.980 -1.176 1.00 4.42 O ATOM 332 CB LYS A 23 14.588 -4.998 -0.465 1.00 33.04 C ATOM 333 CG LYS A 23 15.097 -5.904 0.670 1.00 40.45 C ATOM 334 CD LYS A 23 15.788 -5.161 1.814 1.00 15.41 C ATOM 335 CE LYS A 23 16.311 -6.202 2.818 1.00 0.33 C ATOM 336 NZ LYS A 23 16.784 -5.601 4.080 1.00 44.15 N ATOM 0 H LYS A 23 13.736 -4.046 -2.628 1.00 24.24 H new ATOM 0 HA LYS A 23 14.882 -6.513 -1.915 1.00 33.10 H new ATOM 0 HB2 LYS A 23 15.394 -4.356 -0.820 1.00 33.04 H new ATOM 0 HB3 LYS A 23 13.799 -4.344 -0.095 1.00 33.04 H new ATOM 0 HG2 LYS A 23 14.255 -6.466 1.075 1.00 40.45 H new ATOM 0 HG3 LYS A 23 15.794 -6.631 0.253 1.00 40.45 H new ATOM 0 HD2 LYS A 23 16.610 -4.555 1.432 1.00 15.41 H new ATOM 0 HD3 LYS A 23 15.090 -4.480 2.301 1.00 15.41 H new ATOM 0 HE2 LYS A 23 15.518 -6.917 3.038 1.00 0.33 H new ATOM 0 HE3 LYS A 23 17.127 -6.762 2.361 1.00 0.33 H new ATOM 0 HZ1 LYS A 23 17.232 -6.333 4.667 1.00 44.15 H new ATOM 0 HZ2 LYS A 23 17.476 -4.854 3.871 1.00 44.15 H new ATOM 0 HZ3 LYS A 23 15.977 -5.192 4.593 1.00 44.15 H new ATOM 346 N ILE A 24 11.756 -6.133 -0.874 1.00 41.24 N ATOM 347 CA ILE A 24 10.607 -6.800 -0.278 1.00 2.22 C ATOM 348 C ILE A 24 9.980 -7.781 -1.271 1.00 44.53 C ATOM 349 O ILE A 24 9.466 -8.802 -0.831 1.00 14.22 O ATOM 350 CB ILE A 24 9.618 -5.723 0.241 1.00 14.40 C ATOM 351 CG1 ILE A 24 10.307 -4.827 1.303 1.00 21.21 C ATOM 352 CG2 ILE A 24 8.334 -6.359 0.796 1.00 35.43 C ATOM 353 CD1 ILE A 24 9.417 -3.753 1.948 1.00 31.22 C ATOM 0 H ILE A 24 11.613 -5.134 -1.020 1.00 41.24 H new ATOM 0 HA ILE A 24 10.912 -7.404 0.577 1.00 2.22 H new ATOM 0 HB ILE A 24 9.327 -5.095 -0.601 1.00 14.40 H new ATOM 0 HG12 ILE A 24 10.701 -5.468 2.092 1.00 21.21 H new ATOM 0 HG13 ILE A 24 11.160 -4.334 0.837 1.00 21.21 H new ATOM 0 HG21 ILE A 24 7.664 -5.576 1.151 1.00 35.43 H new ATOM 0 HG22 ILE A 24 7.841 -6.929 0.009 1.00 35.43 H new ATOM 0 HG23 ILE A 24 8.585 -7.024 1.623 1.00 35.43 H new ATOM 0 HD11 ILE A 24 9.999 -3.186 2.674 1.00 31.22 H new ATOM 0 HD12 ILE A 24 9.043 -3.079 1.177 1.00 31.22 H new ATOM 0 HD13 ILE A 24 8.577 -4.231 2.451 1.00 31.22 H new ATOM 364 N ASN A 25 10.028 -7.538 -2.588 1.00 31.44 N ATOM 365 CA ASN A 25 9.464 -8.506 -3.532 1.00 55.51 C ATOM 366 C ASN A 25 10.251 -9.822 -3.566 1.00 22.24 C ATOM 367 O ASN A 25 9.707 -10.840 -3.993 1.00 13.52 O ATOM 368 CB ASN A 25 9.381 -7.928 -4.946 1.00 35.01 C ATOM 369 CG ASN A 25 8.563 -8.813 -5.891 1.00 61.25 C ATOM 370 OD1 ASN A 25 8.975 -9.095 -7.009 1.00 32.23 O ATOM 371 ND2 ASN A 25 7.392 -9.292 -5.507 1.00 73.44 N ATOM 0 H ASN A 25 10.438 -6.706 -3.012 1.00 31.44 H new ATOM 0 HA ASN A 25 8.458 -8.721 -3.172 1.00 55.51 H new ATOM 0 HB2 ASN A 25 8.933 -6.935 -4.904 1.00 35.01 H new ATOM 0 HB3 ASN A 25 10.388 -7.807 -5.346 1.00 35.01 H new ATOM 0 HD21 ASN A 25 6.851 -9.884 -6.138 1.00 73.44 H new ATOM 0 HD22 ASN A 25 7.029 -9.070 -4.580 1.00 73.44 H new ATOM 377 N SER A 26 11.505 -9.807 -3.113 1.00 2.31 N ATOM 378 CA SER A 26 12.302 -11.001 -2.895 1.00 53.25 C ATOM 379 C SER A 26 11.952 -11.623 -1.533 1.00 42.11 C ATOM 380 O SER A 26 11.795 -12.842 -1.473 1.00 33.40 O ATOM 381 CB SER A 26 13.783 -10.624 -3.049 1.00 24.40 C ATOM 382 OG SER A 26 14.661 -11.731 -3.136 1.00 44.44 O ATOM 0 H SER A 26 11.999 -8.944 -2.885 1.00 2.31 H new ATOM 0 HA SER A 26 12.084 -11.772 -3.634 1.00 53.25 H new ATOM 0 HB2 SER A 26 13.899 -10.012 -3.944 1.00 24.40 H new ATOM 0 HB3 SER A 26 14.079 -10.007 -2.201 1.00 24.40 H new ATOM 0 HG SER A 26 15.582 -11.411 -3.234 1.00 44.44 H new ATOM 387 N GLU A 27 11.803 -10.833 -0.452 1.00 23.23 N ATOM 388 CA GLU A 27 11.552 -11.400 0.871 1.00 35.23 C ATOM 389 C GLU A 27 10.101 -11.877 1.100 1.00 24.20 C ATOM 390 O GLU A 27 9.892 -12.781 1.919 1.00 53.23 O ATOM 391 CB GLU A 27 12.092 -10.520 2.024 1.00 31.44 C ATOM 392 CG GLU A 27 11.946 -9.010 2.080 1.00 22.02 C ATOM 393 CD GLU A 27 12.569 -8.415 3.359 1.00 62.12 C ATOM 394 OE1 GLU A 27 12.215 -8.826 4.487 1.00 71.42 O ATOM 395 OE2 GLU A 27 13.452 -7.535 3.256 1.00 75.35 O ATOM 0 H GLU A 27 11.853 -9.814 -0.475 1.00 23.23 H new ATOM 0 HA GLU A 27 12.144 -12.315 0.888 1.00 35.23 H new ATOM 0 HB2 GLU A 27 11.638 -10.904 2.938 1.00 31.44 H new ATOM 0 HB3 GLU A 27 13.161 -10.725 2.088 1.00 31.44 H new ATOM 0 HG2 GLU A 27 12.422 -8.567 1.205 1.00 22.02 H new ATOM 0 HG3 GLU A 27 10.889 -8.746 2.035 1.00 22.02 H new ATOM 400 N ILE A 28 9.098 -11.353 0.388 1.00 42.12 N ATOM 401 CA ILE A 28 7.750 -11.927 0.357 1.00 35.30 C ATOM 402 C ILE A 28 7.811 -13.210 -0.500 1.00 51.33 C ATOM 403 O ILE A 28 8.755 -13.429 -1.256 1.00 42.41 O ATOM 404 CB ILE A 28 6.729 -10.855 -0.134 1.00 2.22 C ATOM 405 CG1 ILE A 28 6.636 -9.738 0.932 1.00 13.40 C ATOM 406 CG2 ILE A 28 5.317 -11.393 -0.430 1.00 0.41 C ATOM 407 CD1 ILE A 28 5.643 -8.604 0.651 1.00 61.31 C ATOM 0 H ILE A 28 9.199 -10.515 -0.185 1.00 42.12 H new ATOM 0 HA ILE A 28 7.395 -12.216 1.346 1.00 35.30 H new ATOM 0 HB ILE A 28 7.108 -10.486 -1.087 1.00 2.22 H new ATOM 0 HG12 ILE A 28 6.369 -10.197 1.884 1.00 13.40 H new ATOM 0 HG13 ILE A 28 7.627 -9.301 1.055 1.00 13.40 H new ATOM 0 HG21 ILE A 28 4.679 -10.575 -0.765 1.00 0.41 H new ATOM 0 HG22 ILE A 28 5.373 -12.152 -1.210 1.00 0.41 H new ATOM 0 HG23 ILE A 28 4.898 -11.833 0.475 1.00 0.41 H new ATOM 0 HD11 ILE A 28 5.671 -7.885 1.470 1.00 61.31 H new ATOM 0 HD12 ILE A 28 5.914 -8.105 -0.279 1.00 61.31 H new ATOM 0 HD13 ILE A 28 4.637 -9.015 0.563 1.00 61.31 H new ATOM 418 N LYS A 29 6.785 -14.061 -0.394 1.00 23.44 N ATOM 419 CA LYS A 29 6.527 -15.227 -1.258 1.00 1.44 C ATOM 420 C LYS A 29 6.407 -14.832 -2.743 1.00 60.14 C ATOM 421 O LYS A 29 6.614 -13.677 -3.100 1.00 23.14 O ATOM 422 CB LYS A 29 5.258 -15.953 -0.743 1.00 63.35 C ATOM 423 CG LYS A 29 5.534 -17.376 -0.239 1.00 54.35 C ATOM 424 CD LYS A 29 5.927 -18.413 -1.297 1.00 31.21 C ATOM 425 CE LYS A 29 4.759 -18.679 -2.251 1.00 63.15 C ATOM 426 NZ LYS A 29 5.010 -19.807 -3.165 1.00 3.22 N ATOM 0 H LYS A 29 6.075 -13.954 0.331 1.00 23.44 H new ATOM 0 HA LYS A 29 7.376 -15.908 -1.205 1.00 1.44 H new ATOM 0 HB2 LYS A 29 4.816 -15.369 0.064 1.00 63.35 H new ATOM 0 HB3 LYS A 29 4.522 -15.996 -1.546 1.00 63.35 H new ATOM 0 HG2 LYS A 29 6.331 -17.326 0.503 1.00 54.35 H new ATOM 0 HG3 LYS A 29 4.642 -17.735 0.275 1.00 54.35 H new ATOM 0 HD2 LYS A 29 6.790 -18.057 -1.860 1.00 31.21 H new ATOM 0 HD3 LYS A 29 6.225 -19.342 -0.811 1.00 31.21 H new ATOM 0 HE2 LYS A 29 3.860 -18.883 -1.669 1.00 63.15 H new ATOM 0 HE3 LYS A 29 4.563 -17.781 -2.836 1.00 63.15 H new ATOM 0 HZ1 LYS A 29 4.104 -20.170 -3.525 1.00 3.22 H new ATOM 0 HZ2 LYS A 29 5.595 -19.485 -3.962 1.00 3.22 H new ATOM 0 HZ3 LYS A 29 5.508 -20.564 -2.654 1.00 3.22 H new ATOM 436 N ASP A 30 6.007 -15.777 -3.606 1.00 1.13 N ATOM 437 CA ASP A 30 5.734 -15.668 -5.050 1.00 51.14 C ATOM 438 C ASP A 30 4.504 -14.790 -5.347 1.00 1.12 C ATOM 439 O ASP A 30 3.565 -15.167 -6.061 1.00 34.30 O ATOM 440 CB ASP A 30 5.538 -17.055 -5.686 1.00 73.15 C ATOM 441 CG ASP A 30 6.782 -17.932 -5.688 1.00 62.21 C ATOM 442 OD1 ASP A 30 7.559 -17.874 -6.668 1.00 64.11 O ATOM 443 OD2 ASP A 30 6.916 -18.745 -4.744 1.00 63.02 O ATOM 0 H ASP A 30 5.851 -16.731 -3.280 1.00 1.13 H new ATOM 0 HA ASP A 30 6.608 -15.189 -5.491 1.00 51.14 H new ATOM 0 HB2 ASP A 30 4.743 -17.576 -5.152 1.00 73.15 H new ATOM 0 HB3 ASP A 30 5.200 -16.924 -6.714 1.00 73.15 H new ATOM 447 N SER A 31 4.495 -13.610 -4.753 1.00 13.40 N ATOM 448 CA SER A 31 3.475 -12.589 -4.793 1.00 34.42 C ATOM 449 C SER A 31 3.762 -11.600 -5.938 1.00 63.45 C ATOM 450 O SER A 31 4.798 -11.695 -6.605 1.00 63.31 O ATOM 451 CB SER A 31 3.500 -11.958 -3.401 1.00 43.11 C ATOM 452 OG SER A 31 3.318 -12.947 -2.392 1.00 55.43 O ATOM 0 H SER A 31 5.283 -13.319 -4.174 1.00 13.40 H new ATOM 0 HA SER A 31 2.477 -12.971 -5.007 1.00 34.42 H new ATOM 0 HB2 SER A 31 4.449 -11.445 -3.247 1.00 43.11 H new ATOM 0 HB3 SER A 31 2.715 -11.205 -3.324 1.00 43.11 H new ATOM 0 HG SER A 31 2.640 -13.592 -2.684 1.00 55.43 H new ATOM 457 N GLU A 32 2.838 -10.679 -6.222 1.00 75.01 N ATOM 458 CA GLU A 32 2.847 -9.840 -7.419 1.00 12.43 C ATOM 459 C GLU A 32 3.326 -8.420 -7.099 1.00 54.33 C ATOM 460 O GLU A 32 3.158 -7.934 -5.980 1.00 43.25 O ATOM 461 CB GLU A 32 1.422 -9.811 -7.975 1.00 44.42 C ATOM 462 CG GLU A 32 1.064 -11.095 -8.745 1.00 53.33 C ATOM 463 CD GLU A 32 -0.433 -11.432 -8.677 1.00 74.14 C ATOM 464 OE1 GLU A 32 -1.272 -10.628 -9.148 1.00 55.31 O ATOM 465 OE2 GLU A 32 -0.774 -12.505 -8.117 1.00 41.14 O ATOM 0 H GLU A 32 2.044 -10.493 -5.610 1.00 75.01 H new ATOM 0 HA GLU A 32 3.539 -10.251 -8.154 1.00 12.43 H new ATOM 0 HB2 GLU A 32 0.718 -9.675 -7.154 1.00 44.42 H new ATOM 0 HB3 GLU A 32 1.311 -8.952 -8.636 1.00 44.42 H new ATOM 0 HG2 GLU A 32 1.359 -10.982 -9.788 1.00 53.33 H new ATOM 0 HG3 GLU A 32 1.638 -11.928 -8.340 1.00 53.33 H new ATOM 470 N LEU A 33 3.877 -7.728 -8.092 1.00 71.23 N ATOM 471 CA LEU A 33 4.695 -6.524 -7.909 1.00 42.54 C ATOM 472 C LEU A 33 4.269 -5.421 -8.881 1.00 74.22 C ATOM 473 O LEU A 33 4.787 -5.336 -9.995 1.00 41.42 O ATOM 474 CB LEU A 33 6.195 -6.872 -8.053 1.00 34.12 C ATOM 475 CG LEU A 33 7.121 -5.683 -7.724 1.00 43.15 C ATOM 476 CD1 LEU A 33 7.105 -5.336 -6.227 1.00 64.22 C ATOM 477 CD2 LEU A 33 8.564 -5.904 -8.187 1.00 63.34 C ATOM 0 H LEU A 33 3.767 -7.992 -9.071 1.00 71.23 H new ATOM 0 HA LEU A 33 4.537 -6.140 -6.901 1.00 42.54 H new ATOM 0 HB2 LEU A 33 6.434 -7.706 -7.393 1.00 34.12 H new ATOM 0 HB3 LEU A 33 6.389 -7.206 -9.072 1.00 34.12 H new ATOM 0 HG LEU A 33 6.716 -4.840 -8.284 1.00 43.15 H new ATOM 0 HD11 LEU A 33 7.771 -4.493 -6.042 1.00 64.22 H new ATOM 0 HD12 LEU A 33 6.092 -5.071 -5.926 1.00 64.22 H new ATOM 0 HD13 LEU A 33 7.441 -6.198 -5.650 1.00 64.22 H new ATOM 0 HD21 LEU A 33 9.167 -5.034 -7.928 1.00 63.34 H new ATOM 0 HD22 LEU A 33 8.972 -6.788 -7.696 1.00 63.34 H new ATOM 0 HD23 LEU A 33 8.581 -6.048 -9.267 1.00 63.34 H new ATOM 488 N LYS A 34 3.342 -4.550 -8.470 1.00 53.53 N ATOM 489 CA LYS A 34 2.866 -3.445 -9.298 1.00 40.11 C ATOM 490 C LYS A 34 3.316 -2.115 -8.725 1.00 13.22 C ATOM 491 O LYS A 34 3.754 -1.974 -7.582 1.00 74.13 O ATOM 492 CB LYS A 34 1.336 -3.493 -9.442 1.00 40.34 C ATOM 493 CG LYS A 34 0.840 -3.799 -10.861 1.00 71.44 C ATOM 494 CD LYS A 34 0.679 -2.531 -11.715 1.00 12.40 C ATOM 495 CE LYS A 34 0.005 -2.883 -13.045 1.00 4.54 C ATOM 496 NZ LYS A 34 -0.488 -1.681 -13.764 1.00 74.43 N ATOM 0 H LYS A 34 2.902 -4.594 -7.551 1.00 53.53 H new ATOM 0 HA LYS A 34 3.301 -3.549 -10.292 1.00 40.11 H new ATOM 0 HB2 LYS A 34 0.943 -4.249 -8.762 1.00 40.34 H new ATOM 0 HB3 LYS A 34 0.924 -2.535 -9.125 1.00 40.34 H new ATOM 0 HG2 LYS A 34 1.541 -4.475 -11.350 1.00 71.44 H new ATOM 0 HG3 LYS A 34 -0.117 -4.318 -10.804 1.00 71.44 H new ATOM 0 HD2 LYS A 34 0.082 -1.793 -11.178 1.00 12.40 H new ATOM 0 HD3 LYS A 34 1.654 -2.079 -11.899 1.00 12.40 H new ATOM 0 HE2 LYS A 34 0.713 -3.417 -13.678 1.00 4.54 H new ATOM 0 HE3 LYS A 34 -0.829 -3.560 -12.859 1.00 4.54 H new ATOM 0 HZ1 LYS A 34 -0.936 -1.970 -14.657 1.00 74.43 H new ATOM 0 HZ2 LYS A 34 -1.184 -1.184 -13.173 1.00 74.43 H new ATOM 0 HZ3 LYS A 34 0.310 -1.046 -13.967 1.00 74.43 H new ATOM 506 N GLU A 35 3.113 -1.110 -9.558 1.00 23.20 N ATOM 507 CA GLU A 35 3.524 0.265 -9.370 1.00 51.12 C ATOM 508 C GLU A 35 2.344 1.162 -9.724 1.00 40.14 C ATOM 509 O GLU A 35 1.515 0.800 -10.564 1.00 51.12 O ATOM 510 CB GLU A 35 4.746 0.579 -10.260 1.00 24.01 C ATOM 511 CG GLU A 35 4.446 0.464 -11.766 1.00 53.24 C ATOM 512 CD GLU A 35 5.621 0.773 -12.693 1.00 52.34 C ATOM 513 OE1 GLU A 35 6.808 0.657 -12.297 1.00 14.13 O ATOM 514 OE2 GLU A 35 5.332 1.101 -13.871 1.00 31.30 O ATOM 0 H GLU A 35 2.623 -1.245 -10.443 1.00 23.20 H new ATOM 0 HA GLU A 35 3.818 0.439 -8.335 1.00 51.12 H new ATOM 0 HB2 GLU A 35 5.096 1.588 -10.042 1.00 24.01 H new ATOM 0 HB3 GLU A 35 5.558 -0.102 -10.005 1.00 24.01 H new ATOM 0 HG2 GLU A 35 4.097 -0.548 -11.974 1.00 53.24 H new ATOM 0 HG3 GLU A 35 3.626 1.140 -12.009 1.00 53.24 H new ATOM 519 N VAL A 36 2.313 2.352 -9.135 1.00 20.11 N ATOM 520 CA VAL A 36 1.330 3.404 -9.355 1.00 35.24 C ATOM 521 C VAL A 36 2.104 4.719 -9.523 1.00 0.10 C ATOM 522 O VAL A 36 3.267 4.802 -9.113 1.00 12.23 O ATOM 523 CB VAL A 36 0.338 3.421 -8.163 1.00 12.41 C ATOM 524 CG1 VAL A 36 -0.866 4.335 -8.441 1.00 73.12 C ATOM 525 CG2 VAL A 36 -0.191 2.012 -7.824 1.00 62.44 C ATOM 0 H VAL A 36 3.017 2.624 -8.449 1.00 20.11 H new ATOM 0 HA VAL A 36 0.733 3.243 -10.252 1.00 35.24 H new ATOM 0 HB VAL A 36 0.904 3.804 -7.314 1.00 12.41 H new ATOM 0 HG11 VAL A 36 -1.539 4.321 -7.584 1.00 73.12 H new ATOM 0 HG12 VAL A 36 -0.518 5.353 -8.613 1.00 73.12 H new ATOM 0 HG13 VAL A 36 -1.396 3.979 -9.324 1.00 73.12 H new ATOM 0 HG21 VAL A 36 -0.882 2.075 -6.983 1.00 62.44 H new ATOM 0 HG22 VAL A 36 -0.710 1.600 -8.690 1.00 62.44 H new ATOM 0 HG23 VAL A 36 0.644 1.364 -7.559 1.00 62.44 H new ATOM 535 N LYS A 37 1.509 5.760 -10.117 1.00 55.22 N ATOM 536 CA LYS A 37 2.106 7.098 -10.216 1.00 51.15 C ATOM 537 C LYS A 37 1.044 8.167 -9.952 1.00 20.10 C ATOM 538 O LYS A 37 -0.136 7.823 -9.845 1.00 1.11 O ATOM 539 CB LYS A 37 2.869 7.246 -11.540 1.00 44.12 C ATOM 540 CG LYS A 37 1.973 7.336 -12.776 1.00 33.41 C ATOM 541 CD LYS A 37 2.714 6.840 -14.018 1.00 74.43 C ATOM 542 CE LYS A 37 1.946 7.220 -15.287 1.00 54.32 C ATOM 543 NZ LYS A 37 2.767 7.135 -16.514 1.00 74.21 N ATOM 0 H LYS A 37 0.587 5.696 -10.548 1.00 55.22 H new ATOM 0 HA LYS A 37 2.858 7.242 -9.441 1.00 51.15 H new ATOM 0 HB2 LYS A 37 3.490 8.140 -11.490 1.00 44.12 H new ATOM 0 HB3 LYS A 37 3.542 6.397 -11.655 1.00 44.12 H new ATOM 0 HG2 LYS A 37 1.072 6.742 -12.622 1.00 33.41 H new ATOM 0 HG3 LYS A 37 1.653 8.367 -12.925 1.00 33.41 H new ATOM 0 HD2 LYS A 37 3.715 7.271 -14.048 1.00 74.43 H new ATOM 0 HD3 LYS A 37 2.835 5.758 -13.969 1.00 74.43 H new ATOM 0 HE2 LYS A 37 1.081 6.564 -15.390 1.00 54.32 H new ATOM 0 HE3 LYS A 37 1.565 8.236 -15.183 1.00 54.32 H new ATOM 0 HZ1 LYS A 37 2.191 7.404 -17.337 1.00 74.21 H new ATOM 0 HZ2 LYS A 37 3.579 7.780 -16.434 1.00 74.21 H new ATOM 0 HZ3 LYS A 37 3.110 6.161 -16.635 1.00 74.21 H new ATOM 553 N VAL A 38 1.445 9.434 -9.823 1.00 14.54 N ATOM 554 CA VAL A 38 0.534 10.580 -9.737 1.00 35.11 C ATOM 555 C VAL A 38 0.778 11.498 -10.937 1.00 42.22 C ATOM 556 O VAL A 38 1.673 11.243 -11.747 1.00 63.35 O ATOM 557 CB VAL A 38 0.616 11.308 -8.369 1.00 1.51 C ATOM 558 CG1 VAL A 38 0.238 10.350 -7.227 1.00 53.11 C ATOM 559 CG2 VAL A 38 1.959 11.997 -8.056 1.00 52.34 C ATOM 0 H VAL A 38 2.429 9.698 -9.774 1.00 14.54 H new ATOM 0 HA VAL A 38 -0.495 10.225 -9.785 1.00 35.11 H new ATOM 0 HB VAL A 38 -0.106 12.121 -8.450 1.00 1.51 H new ATOM 0 HG11 VAL A 38 0.301 10.876 -6.275 1.00 53.11 H new ATOM 0 HG12 VAL A 38 -0.780 9.990 -7.376 1.00 53.11 H new ATOM 0 HG13 VAL A 38 0.925 9.504 -7.220 1.00 53.11 H new ATOM 0 HG21 VAL A 38 1.904 12.473 -7.077 1.00 52.34 H new ATOM 0 HG22 VAL A 38 2.757 11.255 -8.054 1.00 52.34 H new ATOM 0 HG23 VAL A 38 2.167 12.751 -8.815 1.00 52.34 H new ATOM 569 N SER A 39 -0.048 12.533 -11.068 1.00 55.24 N ATOM 570 CA SER A 39 0.042 13.559 -12.073 1.00 60.04 C ATOM 571 C SER A 39 1.130 14.544 -11.627 1.00 53.14 C ATOM 572 O SER A 39 1.618 14.497 -10.493 1.00 72.24 O ATOM 573 CB SER A 39 -1.329 14.227 -12.084 1.00 52.42 C ATOM 574 OG SER A 39 -2.082 13.752 -13.182 1.00 60.41 O ATOM 0 H SER A 39 -0.836 12.675 -10.436 1.00 55.24 H new ATOM 0 HA SER A 39 0.297 13.188 -13.066 1.00 60.04 H new ATOM 0 HB2 SER A 39 -1.854 14.017 -11.152 1.00 52.42 H new ATOM 0 HB3 SER A 39 -1.216 15.309 -12.149 1.00 52.42 H new ATOM 0 HG SER A 39 -2.986 14.129 -13.146 1.00 60.41 H new ATOM 579 N GLU A 40 1.507 15.450 -12.518 1.00 15.14 N ATOM 580 CA GLU A 40 2.713 16.252 -12.344 1.00 20.33 C ATOM 581 C GLU A 40 2.394 17.649 -11.822 1.00 71.43 C ATOM 582 O GLU A 40 1.391 18.259 -12.193 1.00 11.40 O ATOM 583 CB GLU A 40 3.532 16.298 -13.635 1.00 60.12 C ATOM 584 CG GLU A 40 2.838 17.036 -14.784 1.00 75.01 C ATOM 585 CD GLU A 40 3.713 17.062 -16.030 1.00 62.13 C ATOM 586 OE1 GLU A 40 4.205 15.984 -16.439 1.00 32.23 O ATOM 587 OE2 GLU A 40 3.983 18.154 -16.577 1.00 43.21 O ATOM 0 H GLU A 40 0.992 15.650 -13.375 1.00 15.14 H new ATOM 0 HA GLU A 40 3.326 15.767 -11.584 1.00 20.33 H new ATOM 0 HB2 GLU A 40 4.488 16.781 -13.431 1.00 60.12 H new ATOM 0 HB3 GLU A 40 3.751 15.278 -13.951 1.00 60.12 H new ATOM 0 HG2 GLU A 40 1.890 16.549 -15.012 1.00 75.01 H new ATOM 0 HG3 GLU A 40 2.607 18.056 -14.477 1.00 75.01 H new ATOM 592 N GLY A 41 3.293 18.178 -10.994 1.00 24.23 N ATOM 593 CA GLY A 41 3.117 19.475 -10.356 1.00 41.41 C ATOM 594 C GLY A 41 2.315 19.379 -9.061 1.00 61.45 C ATOM 595 O GLY A 41 2.118 20.400 -8.403 1.00 12.54 O ATOM 0 H GLY A 41 4.167 17.714 -10.748 1.00 24.23 H new ATOM 0 HA2 GLY A 41 4.094 19.909 -10.144 1.00 41.41 H new ATOM 0 HA3 GLY A 41 2.611 20.151 -11.045 1.00 41.41 H new ATOM 599 N THR A 42 1.870 18.176 -8.683 1.00 72.14 N ATOM 600 CA THR A 42 1.041 17.946 -7.515 1.00 35.10 C ATOM 601 C THR A 42 1.704 18.515 -6.249 1.00 31.00 C ATOM 602 O THR A 42 1.042 19.196 -5.470 1.00 43.31 O ATOM 603 CB THR A 42 0.771 16.437 -7.402 1.00 62.11 C ATOM 604 OG1 THR A 42 0.227 15.877 -8.590 1.00 62.01 O ATOM 605 CG2 THR A 42 -0.254 16.152 -6.317 1.00 24.34 C ATOM 0 H THR A 42 2.086 17.322 -9.198 1.00 72.14 H new ATOM 0 HA THR A 42 0.090 18.467 -7.620 1.00 35.10 H new ATOM 0 HB THR A 42 1.744 15.995 -7.187 1.00 62.11 H new ATOM 0 HG1 THR A 42 0.936 15.423 -9.092 1.00 62.01 H new ATOM 0 HG21 THR A 42 -0.429 15.078 -6.255 1.00 24.34 H new ATOM 0 HG22 THR A 42 0.120 16.515 -5.359 1.00 24.34 H new ATOM 0 HG23 THR A 42 -1.189 16.659 -6.557 1.00 24.34 H new ATOM 613 N PHE A 43 3.000 18.250 -6.039 1.00 42.12 N ATOM 614 CA PHE A 43 3.747 18.797 -4.903 1.00 72.45 C ATOM 615 C PHE A 43 5.049 19.459 -5.353 1.00 2.52 C ATOM 616 O PHE A 43 5.469 19.299 -6.501 1.00 72.43 O ATOM 617 CB PHE A 43 3.997 17.684 -3.880 1.00 62.23 C ATOM 618 CG PHE A 43 2.718 17.087 -3.335 1.00 71.25 C ATOM 619 CD1 PHE A 43 1.934 17.819 -2.426 1.00 34.31 C ATOM 620 CD2 PHE A 43 2.255 15.851 -3.817 1.00 52.53 C ATOM 621 CE1 PHE A 43 0.708 17.307 -1.971 1.00 35.02 C ATOM 622 CE2 PHE A 43 1.002 15.371 -3.402 1.00 63.02 C ATOM 623 CZ PHE A 43 0.231 16.088 -2.472 1.00 52.45 C ATOM 0 H PHE A 43 3.557 17.653 -6.650 1.00 42.12 H new ATOM 0 HA PHE A 43 3.153 19.580 -4.431 1.00 72.45 H new ATOM 0 HB2 PHE A 43 4.590 16.897 -4.345 1.00 62.23 H new ATOM 0 HB3 PHE A 43 4.587 18.082 -3.054 1.00 62.23 H new ATOM 0 HD1 PHE A 43 2.277 18.781 -2.075 1.00 34.31 H new ATOM 0 HD2 PHE A 43 2.859 15.274 -4.502 1.00 52.53 H new ATOM 0 HE1 PHE A 43 0.134 17.852 -1.236 1.00 35.02 H new ATOM 0 HE2 PHE A 43 0.627 14.441 -3.802 1.00 63.02 H new ATOM 0 HZ PHE A 43 -0.723 15.702 -2.145 1.00 52.45 H new ATOM 632 N ASP A 44 5.696 20.187 -4.437 1.00 35.00 N ATOM 633 CA ASP A 44 6.996 20.826 -4.666 1.00 3.34 C ATOM 634 C ASP A 44 8.052 20.016 -3.914 1.00 35.34 C ATOM 635 O ASP A 44 7.730 19.134 -3.114 1.00 14.43 O ATOM 636 CB ASP A 44 6.968 22.303 -4.210 1.00 3.33 C ATOM 637 CG ASP A 44 7.955 23.222 -4.949 1.00 14.24 C ATOM 638 OD1 ASP A 44 9.154 22.882 -5.073 1.00 41.15 O ATOM 639 OD2 ASP A 44 7.552 24.297 -5.447 1.00 71.31 O ATOM 0 H ASP A 44 5.325 20.351 -3.501 1.00 35.00 H new ATOM 0 HA ASP A 44 7.237 20.838 -5.729 1.00 3.34 H new ATOM 0 HB2 ASP A 44 5.959 22.692 -4.346 1.00 3.33 H new ATOM 0 HB3 ASP A 44 7.184 22.344 -3.142 1.00 3.33 H new ATOM 643 N ALA A 45 9.319 20.351 -4.112 1.00 4.14 N ATOM 644 CA ALA A 45 10.440 19.874 -3.330 1.00 24.23 C ATOM 645 C ALA A 45 10.947 21.037 -2.478 1.00 34.00 C ATOM 646 O ALA A 45 12.048 21.549 -2.697 1.00 75.43 O ATOM 647 CB ALA A 45 11.507 19.338 -4.280 1.00 73.43 C ATOM 0 H ALA A 45 9.601 20.990 -4.855 1.00 4.14 H new ATOM 0 HA ALA A 45 10.157 19.060 -2.663 1.00 24.23 H new ATOM 0 HB1 ALA A 45 12.358 18.975 -3.704 1.00 73.43 H new ATOM 0 HB2 ALA A 45 11.092 18.520 -4.869 1.00 73.43 H new ATOM 0 HB3 ALA A 45 11.834 20.136 -4.947 1.00 73.43 H new ATOM 653 N ASP A 46 10.113 21.537 -1.571 1.00 14.34 N ATOM 654 CA ASP A 46 10.458 22.593 -0.627 1.00 71.02 C ATOM 655 C ASP A 46 10.540 21.980 0.783 1.00 34.14 C ATOM 656 O ASP A 46 10.703 20.761 0.919 1.00 42.23 O ATOM 657 CB ASP A 46 9.425 23.711 -0.785 1.00 24.12 C ATOM 658 CG ASP A 46 9.886 24.989 -0.102 1.00 42.11 C ATOM 659 OD1 ASP A 46 10.733 25.700 -0.676 1.00 41.54 O ATOM 660 OD2 ASP A 46 9.417 25.210 1.033 1.00 54.32 O ATOM 0 H ASP A 46 9.152 21.209 -1.470 1.00 14.34 H new ATOM 0 HA ASP A 46 11.435 23.039 -0.815 1.00 71.02 H new ATOM 0 HB2 ASP A 46 9.253 23.904 -1.844 1.00 24.12 H new ATOM 0 HB3 ASP A 46 8.473 23.392 -0.361 1.00 24.12 H new ATOM 664 N MET A 47 10.446 22.784 1.842 1.00 73.04 N ATOM 665 CA MET A 47 10.369 22.359 3.235 1.00 31.33 C ATOM 666 C MET A 47 9.165 22.993 3.945 1.00 73.12 C ATOM 667 O MET A 47 8.607 22.389 4.863 1.00 71.45 O ATOM 668 CB MET A 47 11.690 22.704 3.946 1.00 61.13 C ATOM 669 CG MET A 47 11.868 24.216 4.137 1.00 4.12 C ATOM 670 SD MET A 47 13.447 24.805 4.795 1.00 4.30 S ATOM 671 CE MET A 47 14.487 24.598 3.333 1.00 73.11 C ATOM 0 H MET A 47 10.420 23.799 1.744 1.00 73.04 H new ATOM 0 HA MET A 47 10.222 21.280 3.271 1.00 31.33 H new ATOM 0 HB2 MET A 47 11.717 22.211 4.918 1.00 61.13 H new ATOM 0 HB3 MET A 47 12.526 22.312 3.366 1.00 61.13 H new ATOM 0 HG2 MET A 47 11.708 24.696 3.172 1.00 4.12 H new ATOM 0 HG3 MET A 47 11.078 24.565 4.802 1.00 4.12 H new ATOM 0 HE1 MET A 47 15.504 24.916 3.562 1.00 73.11 H new ATOM 0 HE2 MET A 47 14.493 23.549 3.036 1.00 73.11 H new ATOM 0 HE3 MET A 47 14.092 25.204 2.517 1.00 73.11 H new ATOM 679 N TYR A 48 8.753 24.200 3.540 1.00 14.23 N ATOM 680 CA TYR A 48 7.667 24.966 4.129 1.00 41.43 C ATOM 681 C TYR A 48 6.494 25.037 3.156 1.00 23.10 C ATOM 682 O TYR A 48 5.359 24.810 3.579 1.00 75.03 O ATOM 683 CB TYR A 48 8.164 26.353 4.578 1.00 73.22 C ATOM 684 CG TYR A 48 9.015 27.138 3.592 1.00 71.43 C ATOM 685 CD1 TYR A 48 8.424 27.821 2.512 1.00 40.25 C ATOM 686 CD2 TYR A 48 10.417 27.157 3.747 1.00 1.41 C ATOM 687 CE1 TYR A 48 9.231 28.450 1.548 1.00 24.31 C ATOM 688 CE2 TYR A 48 11.231 27.776 2.784 1.00 54.14 C ATOM 689 CZ TYR A 48 10.637 28.409 1.673 1.00 14.34 C ATOM 690 OH TYR A 48 11.423 29.058 0.777 1.00 1.53 O ATOM 0 H TYR A 48 9.192 24.684 2.757 1.00 14.23 H new ATOM 0 HA TYR A 48 7.307 24.464 5.027 1.00 41.43 H new ATOM 0 HB2 TYR A 48 7.294 26.959 4.830 1.00 73.22 H new ATOM 0 HB3 TYR A 48 8.740 26.225 5.495 1.00 73.22 H new ATOM 0 HD1 TYR A 48 7.348 27.862 2.424 1.00 40.25 H new ATOM 0 HD2 TYR A 48 10.867 26.693 4.612 1.00 1.41 H new ATOM 0 HE1 TYR A 48 8.777 28.964 0.714 1.00 24.31 H new ATOM 0 HE2 TYR A 48 12.305 27.767 2.894 1.00 54.14 H new ATOM 0 HH TYR A 48 12.365 28.926 1.013 1.00 1.53 H new ATOM 699 N LYS A 49 6.740 25.243 1.852 1.00 51.44 N ATOM 700 CA LYS A 49 5.677 25.253 0.844 1.00 60.31 C ATOM 701 C LYS A 49 4.938 23.921 0.910 1.00 1.30 C ATOM 702 O LYS A 49 3.713 23.877 0.912 1.00 1.20 O ATOM 703 CB LYS A 49 6.255 25.496 -0.570 1.00 22.41 C ATOM 704 CG LYS A 49 5.187 25.935 -1.586 1.00 13.11 C ATOM 705 CD LYS A 49 4.845 27.427 -1.478 1.00 44.12 C ATOM 706 CE LYS A 49 3.521 27.723 -2.196 1.00 60.21 C ATOM 707 NZ LYS A 49 3.095 29.124 -2.015 1.00 3.42 N ATOM 0 H LYS A 49 7.673 25.405 1.473 1.00 51.44 H new ATOM 0 HA LYS A 49 4.984 26.069 1.050 1.00 60.31 H new ATOM 0 HB2 LYS A 49 7.031 26.259 -0.514 1.00 22.41 H new ATOM 0 HB3 LYS A 49 6.732 24.582 -0.924 1.00 22.41 H new ATOM 0 HG2 LYS A 49 5.540 25.719 -2.594 1.00 13.11 H new ATOM 0 HG3 LYS A 49 4.282 25.347 -1.433 1.00 13.11 H new ATOM 0 HD2 LYS A 49 4.770 27.715 -0.429 1.00 44.12 H new ATOM 0 HD3 LYS A 49 5.645 28.023 -1.916 1.00 44.12 H new ATOM 0 HE2 LYS A 49 3.630 27.512 -3.260 1.00 60.21 H new ATOM 0 HE3 LYS A 49 2.746 27.057 -1.817 1.00 60.21 H new ATOM 0 HZ1 LYS A 49 2.197 29.281 -2.516 1.00 3.42 H new ATOM 0 HZ2 LYS A 49 2.965 29.319 -1.002 1.00 3.42 H new ATOM 0 HZ3 LYS A 49 3.822 29.760 -2.400 1.00 3.42 H new ATOM 717 N THR A 50 5.688 22.831 1.022 1.00 4.51 N ATOM 718 CA THR A 50 5.176 21.475 1.028 1.00 40.22 C ATOM 719 C THR A 50 4.473 21.102 2.342 1.00 21.43 C ATOM 720 O THR A 50 3.812 20.061 2.401 1.00 14.20 O ATOM 721 CB THR A 50 6.351 20.543 0.711 1.00 73.45 C ATOM 722 OG1 THR A 50 7.440 20.831 1.571 1.00 74.42 O ATOM 723 CG2 THR A 50 6.829 20.727 -0.723 1.00 40.14 C ATOM 0 H THR A 50 6.703 22.873 1.114 1.00 4.51 H new ATOM 0 HA THR A 50 4.398 21.375 0.271 1.00 40.22 H new ATOM 0 HB THR A 50 6.004 19.519 0.852 1.00 73.45 H new ATOM 0 HG1 THR A 50 8.187 20.231 1.365 1.00 74.42 H new ATOM 0 HG21 THR A 50 7.663 20.053 -0.918 1.00 40.14 H new ATOM 0 HG22 THR A 50 6.013 20.503 -1.410 1.00 40.14 H new ATOM 0 HG23 THR A 50 7.154 21.757 -0.869 1.00 40.14 H new ATOM 731 N SER A 51 4.585 21.910 3.400 1.00 44.24 N ATOM 732 CA SER A 51 3.740 21.755 4.572 1.00 63.11 C ATOM 733 C SER A 51 2.339 22.250 4.205 1.00 0.33 C ATOM 734 O SER A 51 1.351 21.545 4.406 1.00 73.05 O ATOM 735 CB SER A 51 4.344 22.527 5.757 1.00 14.21 C ATOM 736 OG SER A 51 4.091 21.824 6.955 1.00 52.31 O ATOM 0 H SER A 51 5.255 22.677 3.462 1.00 44.24 H new ATOM 0 HA SER A 51 3.674 20.712 4.881 1.00 63.11 H new ATOM 0 HB2 SER A 51 5.418 22.650 5.615 1.00 14.21 H new ATOM 0 HB3 SER A 51 3.913 23.527 5.811 1.00 14.21 H new ATOM 0 HG SER A 51 4.477 22.315 7.710 1.00 52.31 H new ATOM 741 N ASP A 52 2.272 23.453 3.629 1.00 20.43 N ATOM 742 CA ASP A 52 1.042 24.149 3.270 1.00 44.45 C ATOM 743 C ASP A 52 0.238 23.390 2.219 1.00 34.10 C ATOM 744 O ASP A 52 -0.947 23.166 2.441 1.00 41.35 O ATOM 745 CB ASP A 52 1.390 25.546 2.768 1.00 2.30 C ATOM 746 CG ASP A 52 0.147 26.381 2.453 1.00 74.03 C ATOM 747 OD1 ASP A 52 -0.599 26.711 3.400 1.00 43.12 O ATOM 748 OD2 ASP A 52 0.027 26.772 1.265 1.00 43.31 O ATOM 0 H ASP A 52 3.108 23.987 3.392 1.00 20.43 H new ATOM 0 HA ASP A 52 0.415 24.216 4.159 1.00 44.45 H new ATOM 0 HB2 ASP A 52 1.988 26.060 3.520 1.00 2.30 H new ATOM 0 HB3 ASP A 52 2.005 25.464 1.872 1.00 2.30 H new ATOM 752 N ILE A 53 0.872 22.949 1.122 1.00 61.05 N ATOM 753 CA ILE A 53 0.186 22.218 0.046 1.00 55.42 C ATOM 754 C ILE A 53 -0.555 21.014 0.645 1.00 43.24 C ATOM 755 O ILE A 53 -1.761 20.856 0.457 1.00 61.21 O ATOM 756 CB ILE A 53 1.151 21.763 -1.084 1.00 61.33 C ATOM 757 CG1 ILE A 53 1.938 22.907 -1.763 1.00 72.02 C ATOM 758 CG2 ILE A 53 0.355 21.035 -2.184 1.00 11.32 C ATOM 759 CD1 ILE A 53 3.194 22.405 -2.499 1.00 73.02 C ATOM 0 H ILE A 53 1.869 23.088 0.956 1.00 61.05 H new ATOM 0 HA ILE A 53 -0.526 22.900 -0.418 1.00 55.42 H new ATOM 0 HB ILE A 53 1.877 21.116 -0.592 1.00 61.33 H new ATOM 0 HG12 ILE A 53 1.287 23.421 -2.471 1.00 72.02 H new ATOM 0 HG13 ILE A 53 2.231 23.639 -1.010 1.00 72.02 H new ATOM 0 HG21 ILE A 53 1.034 20.717 -2.975 1.00 11.32 H new ATOM 0 HG22 ILE A 53 -0.140 20.162 -1.758 1.00 11.32 H new ATOM 0 HG23 ILE A 53 -0.394 21.710 -2.598 1.00 11.32 H new ATOM 0 HD11 ILE A 53 3.709 23.249 -2.958 1.00 73.02 H new ATOM 0 HD12 ILE A 53 3.861 21.916 -1.789 1.00 73.02 H new ATOM 0 HD13 ILE A 53 2.903 21.694 -3.272 1.00 73.02 H new ATOM 770 N ALA A 54 0.159 20.146 1.371 1.00 31.23 N ATOM 771 CA ALA A 54 -0.476 18.951 1.899 1.00 54.13 C ATOM 772 C ALA A 54 -1.517 19.308 2.962 1.00 73.03 C ATOM 773 O ALA A 54 -2.530 18.625 3.030 1.00 31.21 O ATOM 774 CB ALA A 54 0.562 17.951 2.421 1.00 40.53 C ATOM 0 H ALA A 54 1.148 20.250 1.597 1.00 31.23 H new ATOM 0 HA ALA A 54 -1.004 18.460 1.082 1.00 54.13 H new ATOM 0 HB1 ALA A 54 0.054 17.068 2.809 1.00 40.53 H new ATOM 0 HB2 ALA A 54 1.227 17.659 1.608 1.00 40.53 H new ATOM 0 HB3 ALA A 54 1.145 18.414 3.218 1.00 40.53 H new ATOM 780 N LEU A 55 -1.312 20.348 3.776 1.00 42.23 N ATOM 781 CA LEU A 55 -2.286 20.796 4.773 1.00 24.33 C ATOM 782 C LEU A 55 -3.597 21.209 4.102 1.00 73.02 C ATOM 783 O LEU A 55 -4.674 20.814 4.547 1.00 22.43 O ATOM 784 CB LEU A 55 -1.670 21.938 5.600 1.00 41.14 C ATOM 785 CG LEU A 55 -2.507 22.504 6.762 1.00 52.32 C ATOM 786 CD1 LEU A 55 -3.424 23.628 6.289 1.00 33.01 C ATOM 787 CD2 LEU A 55 -3.243 21.442 7.585 1.00 0.41 C ATOM 0 H LEU A 55 -0.458 20.906 3.760 1.00 42.23 H new ATOM 0 HA LEU A 55 -2.528 19.976 5.449 1.00 24.33 H new ATOM 0 HB2 LEU A 55 -0.723 21.585 6.008 1.00 41.14 H new ATOM 0 HB3 LEU A 55 -1.439 22.759 4.921 1.00 41.14 H new ATOM 0 HG LEU A 55 -1.792 22.935 7.463 1.00 52.32 H new ATOM 0 HD11 LEU A 55 -4.001 24.006 7.133 1.00 33.01 H new ATOM 0 HD12 LEU A 55 -2.824 24.435 5.869 1.00 33.01 H new ATOM 0 HD13 LEU A 55 -4.103 23.247 5.526 1.00 33.01 H new ATOM 0 HD21 LEU A 55 -3.808 21.926 8.382 1.00 0.41 H new ATOM 0 HD22 LEU A 55 -3.926 20.890 6.939 1.00 0.41 H new ATOM 0 HD23 LEU A 55 -2.519 20.753 8.020 1.00 0.41 H new ATOM 798 N ASP A 56 -3.514 21.995 3.034 1.00 61.23 N ATOM 799 CA ASP A 56 -4.653 22.404 2.221 1.00 35.13 C ATOM 800 C ASP A 56 -5.432 21.164 1.746 1.00 32.10 C ATOM 801 O ASP A 56 -6.628 21.022 2.029 1.00 31.43 O ATOM 802 CB ASP A 56 -4.131 23.256 1.056 1.00 63.24 C ATOM 803 CG ASP A 56 -5.045 23.270 -0.084 1.00 21.30 C ATOM 804 OD1 ASP A 56 -6.113 23.875 0.142 1.00 55.12 O ATOM 805 OD2 ASP A 56 -4.601 22.812 -1.162 1.00 73.24 O ATOM 0 H ASP A 56 -2.628 22.375 2.701 1.00 61.23 H new ATOM 0 HA ASP A 56 -5.352 23.007 2.800 1.00 35.13 H new ATOM 0 HB2 ASP A 56 -3.971 24.277 1.401 1.00 63.24 H new ATOM 0 HB3 ASP A 56 -3.162 22.872 0.736 1.00 63.24 H new ATOM 809 N GLN A 57 -4.744 20.228 1.085 1.00 52.35 N ATOM 810 CA GLN A 57 -5.366 19.033 0.512 1.00 43.22 C ATOM 811 C GLN A 57 -5.793 18.005 1.570 1.00 42.33 C ATOM 812 O GLN A 57 -6.599 17.122 1.268 1.00 24.22 O ATOM 813 CB GLN A 57 -4.419 18.386 -0.506 1.00 54.45 C ATOM 814 CG GLN A 57 -4.066 19.353 -1.639 1.00 63.25 C ATOM 815 CD GLN A 57 -3.295 18.661 -2.752 1.00 75.31 C ATOM 816 OE1 GLN A 57 -2.074 18.582 -2.726 1.00 40.51 O ATOM 817 NE2 GLN A 57 -3.981 18.154 -3.761 1.00 21.40 N ATOM 0 H GLN A 57 -3.737 20.279 0.932 1.00 52.35 H new ATOM 0 HA GLN A 57 -6.279 19.361 0.015 1.00 43.22 H new ATOM 0 HB2 GLN A 57 -3.507 18.065 -0.003 1.00 54.45 H new ATOM 0 HB3 GLN A 57 -4.885 17.492 -0.921 1.00 54.45 H new ATOM 0 HG2 GLN A 57 -4.980 19.786 -2.045 1.00 63.25 H new ATOM 0 HG3 GLN A 57 -3.472 20.176 -1.242 1.00 63.25 H new ATOM 0 HE21 GLN A 57 -4.998 18.225 -3.773 1.00 21.40 H new ATOM 0 HE22 GLN A 57 -3.493 17.691 -4.528 1.00 21.40 H new ATOM 824 N ILE A 58 -5.269 18.081 2.795 1.00 1.52 N ATOM 825 CA ILE A 58 -5.788 17.364 3.954 1.00 15.54 C ATOM 826 C ILE A 58 -7.167 17.919 4.298 1.00 13.40 C ATOM 827 O ILE A 58 -8.145 17.174 4.296 1.00 40.31 O ATOM 828 CB ILE A 58 -4.771 17.416 5.126 1.00 24.22 C ATOM 829 CG1 ILE A 58 -3.609 16.433 4.876 1.00 75.03 C ATOM 830 CG2 ILE A 58 -5.354 17.215 6.538 1.00 2.51 C ATOM 831 CD1 ILE A 58 -2.386 16.769 5.735 1.00 75.45 C ATOM 0 H ILE A 58 -4.454 18.656 3.010 1.00 1.52 H new ATOM 0 HA ILE A 58 -5.916 16.304 3.733 1.00 15.54 H new ATOM 0 HB ILE A 58 -4.411 18.445 5.127 1.00 24.22 H new ATOM 0 HG12 ILE A 58 -3.939 15.417 5.094 1.00 75.03 H new ATOM 0 HG13 ILE A 58 -3.331 16.459 3.822 1.00 75.03 H new ATOM 0 HG21 ILE A 58 -4.552 17.271 7.274 1.00 2.51 H new ATOM 0 HG22 ILE A 58 -6.089 17.993 6.742 1.00 2.51 H new ATOM 0 HG23 ILE A 58 -5.833 16.238 6.598 1.00 2.51 H new ATOM 0 HD11 ILE A 58 -1.590 16.054 5.530 1.00 75.45 H new ATOM 0 HD12 ILE A 58 -2.040 17.775 5.498 1.00 75.45 H new ATOM 0 HD13 ILE A 58 -2.657 16.718 6.790 1.00 75.45 H new ATOM 842 N GLN A 59 -7.247 19.216 4.601 1.00 41.43 N ATOM 843 CA GLN A 59 -8.388 19.802 5.294 1.00 23.04 C ATOM 844 C GLN A 59 -9.687 19.782 4.483 1.00 33.04 C ATOM 845 O GLN A 59 -10.746 20.058 5.048 1.00 3.42 O ATOM 846 CB GLN A 59 -8.035 21.238 5.702 1.00 75.03 C ATOM 847 CG GLN A 59 -7.080 21.264 6.906 1.00 43.25 C ATOM 848 CD GLN A 59 -6.798 22.685 7.373 1.00 24.23 C ATOM 849 OE1 GLN A 59 -6.587 23.609 6.451 1.00 24.34 O flip ATOM 850 NE2 GLN A 59 -6.760 22.969 8.568 1.00 43.53 N flip ATOM 0 H GLN A 59 -6.517 19.890 4.370 1.00 41.43 H new ATOM 0 HA GLN A 59 -8.583 19.184 6.170 1.00 23.04 H new ATOM 0 HB2 GLN A 59 -7.574 21.754 4.860 1.00 75.03 H new ATOM 0 HB3 GLN A 59 -8.947 21.782 5.948 1.00 75.03 H new ATOM 0 HG2 GLN A 59 -7.513 20.691 7.726 1.00 43.25 H new ATOM 0 HG3 GLN A 59 -6.143 20.777 6.637 1.00 43.25 H new ATOM 0 HE21 GLN A 59 -6.925 22.247 9.269 1.00 43.53 H new ATOM 0 HE22 GLN A 59 -6.564 23.927 8.859 1.00 43.53 H new ATOM 857 N GLY A 60 -9.632 19.473 3.184 1.00 1.10 N ATOM 858 CA GLY A 60 -10.780 19.568 2.290 1.00 43.32 C ATOM 859 C GLY A 60 -10.993 20.991 1.779 1.00 14.10 C ATOM 860 O GLY A 60 -11.930 21.242 1.019 1.00 22.33 O ATOM 0 H GLY A 60 -8.781 19.148 2.724 1.00 1.10 H new ATOM 0 HA2 GLY A 60 -10.636 18.897 1.443 1.00 43.32 H new ATOM 0 HA3 GLY A 60 -11.676 19.233 2.814 1.00 43.32 H new ATOM 864 N ASN A 61 -10.087 21.904 2.148 1.00 74.04 N ATOM 865 CA ASN A 61 -9.985 23.242 1.584 1.00 74.04 C ATOM 866 C ASN A 61 -9.841 23.143 0.061 1.00 35.34 C ATOM 867 O ASN A 61 -10.359 23.989 -0.667 1.00 0.21 O ATOM 868 CB ASN A 61 -8.755 23.970 2.153 1.00 31.13 C ATOM 869 CG ASN A 61 -8.775 24.304 3.642 1.00 2.41 C ATOM 870 OD1 ASN A 61 -9.620 23.878 4.428 1.00 12.24 O ATOM 871 ND2 ASN A 61 -7.775 25.038 4.088 1.00 43.42 N ATOM 0 H ASN A 61 -9.388 21.721 2.868 1.00 74.04 H new ATOM 0 HA ASN A 61 -10.885 23.800 1.842 1.00 74.04 H new ATOM 0 HB2 ASN A 61 -7.876 23.356 1.955 1.00 31.13 H new ATOM 0 HB3 ASN A 61 -8.625 24.900 1.599 1.00 31.13 H new ATOM 0 HD21 ASN A 61 -7.703 25.252 5.083 1.00 43.42 H new ATOM 0 HD22 ASN A 61 -7.073 25.392 3.438 1.00 43.42 H new ATOM 877 N LYS A 62 -9.172 22.092 -0.423 1.00 20.01 N ATOM 878 CA LYS A 62 -8.881 21.848 -1.823 1.00 75.32 C ATOM 879 C LYS A 62 -9.222 20.431 -2.237 1.00 54.11 C ATOM 880 O LYS A 62 -9.513 19.553 -1.419 1.00 0.11 O ATOM 881 CB LYS A 62 -7.384 22.136 -2.045 1.00 24.33 C ATOM 882 CG LYS A 62 -7.079 23.555 -2.561 1.00 74.11 C ATOM 883 CD LYS A 62 -7.885 23.913 -3.808 1.00 43.34 C ATOM 884 CE LYS A 62 -7.207 24.996 -4.643 1.00 63.35 C ATOM 885 NZ LYS A 62 -7.704 24.943 -6.031 1.00 20.03 N ATOM 0 H LYS A 62 -8.806 21.360 0.185 1.00 20.01 H new ATOM 0 HA LYS A 62 -9.497 22.502 -2.441 1.00 75.32 H new ATOM 0 HB2 LYS A 62 -6.854 21.982 -1.105 1.00 24.33 H new ATOM 0 HB3 LYS A 62 -6.989 21.411 -2.756 1.00 24.33 H new ATOM 0 HG2 LYS A 62 -7.294 24.278 -1.774 1.00 74.11 H new ATOM 0 HG3 LYS A 62 -6.015 23.635 -2.785 1.00 74.11 H new ATOM 0 HD2 LYS A 62 -8.023 23.020 -4.418 1.00 43.34 H new ATOM 0 HD3 LYS A 62 -8.877 24.253 -3.512 1.00 43.34 H new ATOM 0 HE2 LYS A 62 -7.407 25.978 -4.213 1.00 63.35 H new ATOM 0 HE3 LYS A 62 -6.126 24.856 -4.629 1.00 63.35 H new ATOM 0 HZ1 LYS A 62 -7.239 25.683 -6.595 1.00 20.03 H new ATOM 0 HZ2 LYS A 62 -7.492 24.011 -6.440 1.00 20.03 H new ATOM 0 HZ3 LYS A 62 -8.732 25.098 -6.038 1.00 20.03 H new ATOM 895 N ASP A 63 -9.169 20.225 -3.547 1.00 53.33 N ATOM 896 CA ASP A 63 -9.231 18.924 -4.181 1.00 24.04 C ATOM 897 C ASP A 63 -7.925 18.164 -3.961 1.00 51.15 C ATOM 898 O ASP A 63 -6.936 18.716 -3.469 1.00 21.41 O ATOM 899 CB ASP A 63 -9.606 19.079 -5.658 1.00 3.11 C ATOM 900 CG ASP A 63 -8.493 19.646 -6.528 1.00 35.31 C ATOM 901 OD1 ASP A 63 -8.428 20.889 -6.647 1.00 62.44 O ATOM 902 OD2 ASP A 63 -7.695 18.862 -7.085 1.00 34.44 O ATOM 0 H ASP A 63 -9.078 20.989 -4.216 1.00 53.33 H new ATOM 0 HA ASP A 63 -10.015 18.322 -3.722 1.00 24.04 H new ATOM 0 HB2 ASP A 63 -9.899 18.105 -6.051 1.00 3.11 H new ATOM 0 HB3 ASP A 63 -10.478 19.729 -5.734 1.00 3.11 H new ATOM 906 N PHE A 64 -7.932 16.873 -4.282 1.00 23.40 N ATOM 907 CA PHE A 64 -6.898 15.927 -3.890 1.00 63.35 C ATOM 908 C PHE A 64 -6.265 15.299 -5.133 1.00 32.34 C ATOM 909 O PHE A 64 -6.890 15.300 -6.199 1.00 4.33 O ATOM 910 CB PHE A 64 -7.492 14.914 -2.893 1.00 2.41 C ATOM 911 CG PHE A 64 -8.820 14.268 -3.245 1.00 32.21 C ATOM 912 CD1 PHE A 64 -8.859 13.048 -3.945 1.00 3.10 C ATOM 913 CD2 PHE A 64 -10.021 14.849 -2.790 1.00 75.02 C ATOM 914 CE1 PHE A 64 -10.091 12.407 -4.167 1.00 51.32 C ATOM 915 CE2 PHE A 64 -11.252 14.216 -3.031 1.00 12.41 C ATOM 916 CZ PHE A 64 -11.288 12.989 -3.716 1.00 4.51 C ATOM 0 H PHE A 64 -8.676 16.448 -4.835 1.00 23.40 H new ATOM 0 HA PHE A 64 -6.081 16.427 -3.370 1.00 63.35 H new ATOM 0 HB2 PHE A 64 -6.761 14.119 -2.748 1.00 2.41 H new ATOM 0 HB3 PHE A 64 -7.609 15.418 -1.934 1.00 2.41 H new ATOM 0 HD1 PHE A 64 -7.945 12.605 -4.311 1.00 3.10 H new ATOM 0 HD2 PHE A 64 -9.995 15.786 -2.253 1.00 75.02 H new ATOM 0 HE1 PHE A 64 -10.117 11.461 -4.688 1.00 51.32 H new ATOM 0 HE2 PHE A 64 -12.170 14.672 -2.690 1.00 12.41 H new ATOM 0 HZ PHE A 64 -12.232 12.496 -3.895 1.00 4.51 H new ATOM 925 N PRO A 65 -5.030 14.772 -5.023 1.00 43.45 N ATOM 926 CA PRO A 65 -4.326 14.231 -6.172 1.00 20.14 C ATOM 927 C PRO A 65 -5.045 13.030 -6.756 1.00 52.15 C ATOM 928 O PRO A 65 -5.801 12.361 -6.058 1.00 44.41 O ATOM 929 CB PRO A 65 -2.948 13.829 -5.671 1.00 15.44 C ATOM 930 CG PRO A 65 -3.142 13.627 -4.176 1.00 33.32 C ATOM 931 CD PRO A 65 -4.184 14.683 -3.840 1.00 13.10 C ATOM 0 HA PRO A 65 -4.269 14.972 -6.969 1.00 20.14 H new ATOM 0 HB2 PRO A 65 -2.598 12.917 -6.155 1.00 15.44 H new ATOM 0 HB3 PRO A 65 -2.208 14.602 -5.876 1.00 15.44 H new ATOM 0 HG2 PRO A 65 -3.492 12.621 -3.943 1.00 33.32 H new ATOM 0 HG3 PRO A 65 -2.216 13.778 -3.621 1.00 33.32 H new ATOM 0 HD2 PRO A 65 -4.764 14.399 -2.961 1.00 13.10 H new ATOM 0 HD3 PRO A 65 -3.716 15.642 -3.617 1.00 13.10 H new ATOM 936 N GLU A 66 -4.706 12.727 -8.004 1.00 73.43 N ATOM 937 CA GLU A 66 -5.172 11.574 -8.756 1.00 4.43 C ATOM 938 C GLU A 66 -4.036 10.553 -8.861 1.00 63.01 C ATOM 939 O GLU A 66 -2.862 10.913 -8.712 1.00 21.01 O ATOM 940 CB GLU A 66 -5.682 12.022 -10.136 1.00 54.25 C ATOM 941 CG GLU A 66 -4.570 12.549 -11.063 1.00 11.24 C ATOM 942 CD GLU A 66 -5.105 13.017 -12.419 1.00 22.12 C ATOM 943 OE1 GLU A 66 -5.891 12.262 -13.032 1.00 34.30 O ATOM 944 OE2 GLU A 66 -4.728 14.136 -12.859 1.00 42.32 O ATOM 0 H GLU A 66 -4.066 13.310 -8.543 1.00 73.43 H new ATOM 0 HA GLU A 66 -6.007 11.097 -8.244 1.00 4.43 H new ATOM 0 HB2 GLU A 66 -6.180 11.182 -10.620 1.00 54.25 H new ATOM 0 HB3 GLU A 66 -6.431 12.802 -10.002 1.00 54.25 H new ATOM 0 HG2 GLU A 66 -4.057 13.377 -10.574 1.00 11.24 H new ATOM 0 HG3 GLU A 66 -3.831 11.764 -11.220 1.00 11.24 H new ATOM 949 N ILE A 67 -4.366 9.298 -9.181 1.00 3.34 N ATOM 950 CA ILE A 67 -3.383 8.340 -9.684 1.00 12.11 C ATOM 951 C ILE A 67 -3.484 8.264 -11.206 1.00 72.01 C ATOM 952 O ILE A 67 -4.511 8.624 -11.781 1.00 23.44 O ATOM 953 CB ILE A 67 -3.555 6.952 -9.028 1.00 60.24 C ATOM 954 CG1 ILE A 67 -4.947 6.339 -9.316 1.00 4.10 C ATOM 955 CG2 ILE A 67 -3.224 7.060 -7.527 1.00 32.31 C ATOM 956 CD1 ILE A 67 -5.114 4.916 -8.784 1.00 62.32 C ATOM 0 H ILE A 67 -5.311 8.923 -9.099 1.00 3.34 H new ATOM 0 HA ILE A 67 -2.384 8.684 -9.416 1.00 12.11 H new ATOM 0 HB ILE A 67 -2.851 6.249 -9.474 1.00 60.24 H new ATOM 0 HG12 ILE A 67 -5.713 6.975 -8.873 1.00 4.10 H new ATOM 0 HG13 ILE A 67 -5.118 6.337 -10.393 1.00 4.10 H new ATOM 0 HG21 ILE A 67 -3.343 6.084 -7.057 1.00 32.31 H new ATOM 0 HG22 ILE A 67 -2.195 7.398 -7.405 1.00 32.31 H new ATOM 0 HG23 ILE A 67 -3.899 7.774 -7.056 1.00 32.31 H new ATOM 0 HD11 ILE A 67 -6.114 4.553 -9.023 1.00 62.32 H new ATOM 0 HD12 ILE A 67 -4.372 4.265 -9.246 1.00 62.32 H new ATOM 0 HD13 ILE A 67 -4.976 4.913 -7.703 1.00 62.32 H new ATOM 967 N GLN A 68 -2.452 7.717 -11.843 1.00 44.52 N ATOM 968 CA GLN A 68 -2.464 7.272 -13.227 1.00 24.11 C ATOM 969 C GLN A 68 -2.110 5.791 -13.177 1.00 33.00 C ATOM 970 O GLN A 68 -1.001 5.425 -12.775 1.00 75.23 O ATOM 971 CB GLN A 68 -1.479 8.096 -14.053 1.00 71.04 C ATOM 972 CG GLN A 68 -1.840 9.587 -14.077 1.00 23.14 C ATOM 973 CD GLN A 68 -0.863 10.399 -14.922 1.00 33.44 C ATOM 974 OE1 GLN A 68 -0.080 9.863 -15.705 1.00 14.11 O ATOM 975 NE2 GLN A 68 -0.873 11.706 -14.762 1.00 0.30 N ATOM 0 H GLN A 68 -1.551 7.567 -11.388 1.00 44.52 H new ATOM 0 HA GLN A 68 -3.431 7.410 -13.711 1.00 24.11 H new ATOM 0 HB2 GLN A 68 -0.476 7.974 -13.645 1.00 71.04 H new ATOM 0 HB3 GLN A 68 -1.456 7.714 -15.074 1.00 71.04 H new ATOM 0 HG2 GLN A 68 -2.849 9.709 -14.471 1.00 23.14 H new ATOM 0 HG3 GLN A 68 -1.847 9.975 -13.058 1.00 23.14 H new ATOM 0 HE21 GLN A 68 -1.529 12.135 -14.109 1.00 0.30 H new ATOM 0 HE22 GLN A 68 -0.225 12.290 -15.291 1.00 0.30 H new ATOM 982 N LEU A 69 -3.104 4.940 -13.412 1.00 13.11 N ATOM 983 CA LEU A 69 -3.033 3.507 -13.255 1.00 20.30 C ATOM 984 C LEU A 69 -4.176 2.887 -14.060 1.00 63.32 C ATOM 985 O LEU A 69 -5.177 3.561 -14.330 1.00 53.25 O ATOM 986 CB LEU A 69 -3.245 3.190 -11.763 1.00 52.33 C ATOM 987 CG LEU A 69 -2.925 1.740 -11.382 1.00 71.04 C ATOM 988 CD1 LEU A 69 -1.458 1.436 -11.653 1.00 11.32 C ATOM 989 CD2 LEU A 69 -3.284 1.473 -9.924 1.00 64.23 C ATOM 0 H LEU A 69 -4.020 5.254 -13.732 1.00 13.11 H new ATOM 0 HA LEU A 69 -2.075 3.116 -13.597 1.00 20.30 H new ATOM 0 HB2 LEU A 69 -2.621 3.857 -11.168 1.00 52.33 H new ATOM 0 HB3 LEU A 69 -4.281 3.404 -11.500 1.00 52.33 H new ATOM 0 HG LEU A 69 -3.530 1.075 -11.999 1.00 71.04 H new ATOM 0 HD11 LEU A 69 -1.244 0.403 -11.378 1.00 11.32 H new ATOM 0 HD12 LEU A 69 -1.246 1.581 -12.712 1.00 11.32 H new ATOM 0 HD13 LEU A 69 -0.833 2.106 -11.063 1.00 11.32 H new ATOM 0 HD21 LEU A 69 -3.049 0.438 -9.675 1.00 64.23 H new ATOM 0 HD22 LEU A 69 -2.711 2.140 -9.280 1.00 64.23 H new ATOM 0 HD23 LEU A 69 -4.349 1.649 -9.773 1.00 64.23 H new ATOM 1000 N ASP A 70 -4.070 1.602 -14.369 1.00 1.20 N ATOM 1001 CA ASP A 70 -5.154 0.810 -14.944 1.00 40.23 C ATOM 1002 C ASP A 70 -6.014 0.221 -13.829 1.00 34.22 C ATOM 1003 O ASP A 70 -5.563 0.054 -12.692 1.00 75.43 O ATOM 1004 CB ASP A 70 -4.593 -0.343 -15.782 1.00 2.14 C ATOM 1005 CG ASP A 70 -4.124 0.117 -17.151 1.00 54.31 C ATOM 1006 OD1 ASP A 70 -3.073 0.781 -17.246 1.00 35.42 O ATOM 1007 OD2 ASP A 70 -4.806 -0.243 -18.139 1.00 60.31 O ATOM 0 H ASP A 70 -3.213 1.069 -14.225 1.00 1.20 H new ATOM 0 HA ASP A 70 -5.752 1.465 -15.578 1.00 40.23 H new ATOM 0 HB2 ASP A 70 -3.760 -0.804 -15.251 1.00 2.14 H new ATOM 0 HB3 ASP A 70 -5.359 -1.109 -15.901 1.00 2.14 H new ATOM 1011 N ASN A 71 -7.237 -0.181 -14.165 1.00 64.02 N ATOM 1012 CA ASN A 71 -8.102 -0.888 -13.237 1.00 43.14 C ATOM 1013 C ASN A 71 -7.666 -2.343 -13.183 1.00 1.14 C ATOM 1014 O ASN A 71 -7.368 -2.939 -14.220 1.00 74.04 O ATOM 1015 CB ASN A 71 -9.564 -0.808 -13.688 1.00 34.22 C ATOM 1016 CG ASN A 71 -10.451 -1.494 -12.659 1.00 71.23 C ATOM 1017 OD1 ASN A 71 -10.608 -0.998 -11.551 1.00 23.03 O ATOM 1018 ND2 ASN A 71 -11.023 -2.643 -12.973 1.00 53.53 N ATOM 0 H ASN A 71 -7.651 -0.025 -15.084 1.00 64.02 H new ATOM 0 HA ASN A 71 -8.023 -0.429 -12.252 1.00 43.14 H new ATOM 0 HB2 ASN A 71 -9.863 0.234 -13.805 1.00 34.22 H new ATOM 0 HB3 ASN A 71 -9.682 -1.285 -14.661 1.00 34.22 H new ATOM 0 HD21 ASN A 71 -11.604 -3.128 -12.288 1.00 53.53 H new ATOM 0 HD22 ASN A 71 -10.884 -3.045 -13.900 1.00 53.53 H new ATOM 1024 N ILE A 72 -7.675 -2.924 -11.990 1.00 2.23 N ATOM 1025 CA ILE A 72 -7.482 -4.340 -11.736 1.00 42.22 C ATOM 1026 C ILE A 72 -8.591 -4.711 -10.756 1.00 12.24 C ATOM 1027 O ILE A 72 -9.001 -3.879 -9.940 1.00 54.23 O ATOM 1028 CB ILE A 72 -6.074 -4.600 -11.148 1.00 75.43 C ATOM 1029 CG1 ILE A 72 -4.950 -4.094 -12.080 1.00 23.21 C ATOM 1030 CG2 ILE A 72 -5.875 -6.105 -10.863 1.00 61.32 C ATOM 1031 CD1 ILE A 72 -3.607 -3.974 -11.345 1.00 44.43 C ATOM 0 H ILE A 72 -7.825 -2.391 -11.133 1.00 2.23 H new ATOM 0 HA ILE A 72 -7.535 -4.944 -12.642 1.00 42.22 H new ATOM 0 HB ILE A 72 -6.012 -4.040 -10.215 1.00 75.43 H new ATOM 0 HG12 ILE A 72 -4.843 -4.777 -12.923 1.00 23.21 H new ATOM 0 HG13 ILE A 72 -5.228 -3.123 -12.490 1.00 23.21 H new ATOM 0 HG21 ILE A 72 -4.880 -6.269 -10.450 1.00 61.32 H new ATOM 0 HG22 ILE A 72 -6.625 -6.442 -10.147 1.00 61.32 H new ATOM 0 HG23 ILE A 72 -5.980 -6.668 -11.790 1.00 61.32 H new ATOM 0 HD11 ILE A 72 -2.845 -3.615 -12.036 1.00 44.43 H new ATOM 0 HD12 ILE A 72 -3.706 -3.271 -10.518 1.00 44.43 H new ATOM 0 HD13 ILE A 72 -3.315 -4.950 -10.958 1.00 44.43 H new ATOM 1042 N ASP A 73 -9.069 -5.951 -10.815 1.00 63.25 N ATOM 1043 CA ASP A 73 -9.972 -6.479 -9.801 1.00 14.30 C ATOM 1044 C ASP A 73 -9.122 -6.870 -8.591 1.00 60.44 C ATOM 1045 O ASP A 73 -8.450 -7.911 -8.579 1.00 11.32 O ATOM 1046 CB ASP A 73 -10.791 -7.651 -10.356 1.00 42.54 C ATOM 1047 CG ASP A 73 -12.306 -7.548 -10.140 1.00 60.04 C ATOM 1048 OD1 ASP A 73 -12.864 -6.440 -9.967 1.00 14.40 O ATOM 1049 OD2 ASP A 73 -12.964 -8.606 -10.256 1.00 44.25 O ATOM 0 H ASP A 73 -8.843 -6.611 -11.559 1.00 63.25 H new ATOM 0 HA ASP A 73 -10.703 -5.730 -9.497 1.00 14.30 H new ATOM 0 HB2 ASP A 73 -10.597 -7.735 -11.425 1.00 42.54 H new ATOM 0 HB3 ASP A 73 -10.436 -8.572 -9.895 1.00 42.54 H new ATOM 1053 N TYR A 74 -9.083 -5.999 -7.587 1.00 60.13 N ATOM 1054 CA TYR A 74 -8.312 -6.175 -6.362 1.00 72.05 C ATOM 1055 C TYR A 74 -8.987 -7.158 -5.400 1.00 12.51 C ATOM 1056 O TYR A 74 -8.409 -7.518 -4.378 1.00 62.45 O ATOM 1057 CB TYR A 74 -8.101 -4.813 -5.689 1.00 13.21 C ATOM 1058 CG TYR A 74 -7.451 -3.783 -6.594 1.00 72.43 C ATOM 1059 CD1 TYR A 74 -6.100 -3.921 -6.967 1.00 20.33 C ATOM 1060 CD2 TYR A 74 -8.199 -2.689 -7.066 1.00 60.35 C ATOM 1061 CE1 TYR A 74 -5.500 -2.970 -7.810 1.00 20.34 C ATOM 1062 CE2 TYR A 74 -7.608 -1.732 -7.910 1.00 73.01 C ATOM 1063 CZ TYR A 74 -6.254 -1.878 -8.294 1.00 63.14 C ATOM 1064 OH TYR A 74 -5.666 -0.991 -9.144 1.00 55.45 O ATOM 0 H TYR A 74 -9.605 -5.123 -7.605 1.00 60.13 H new ATOM 0 HA TYR A 74 -7.344 -6.602 -6.626 1.00 72.05 H new ATOM 0 HB2 TYR A 74 -9.064 -4.431 -5.351 1.00 13.21 H new ATOM 0 HB3 TYR A 74 -7.482 -4.947 -4.802 1.00 13.21 H new ATOM 0 HD1 TYR A 74 -5.524 -4.759 -6.604 1.00 20.33 H new ATOM 0 HD2 TYR A 74 -9.235 -2.583 -6.778 1.00 60.35 H new ATOM 0 HE1 TYR A 74 -4.462 -3.074 -8.088 1.00 20.34 H new ATOM 0 HE2 TYR A 74 -8.185 -0.890 -8.263 1.00 73.01 H new ATOM 0 HH TYR A 74 -6.312 -0.296 -9.390 1.00 55.45 H new ATOM 1073 N ASN A 75 -10.198 -7.631 -5.716 1.00 60.13 N ATOM 1074 CA ASN A 75 -10.979 -8.498 -4.831 1.00 53.34 C ATOM 1075 C ASN A 75 -10.334 -9.874 -4.601 1.00 0.43 C ATOM 1076 O ASN A 75 -10.762 -10.595 -3.704 1.00 61.25 O ATOM 1077 CB ASN A 75 -12.406 -8.682 -5.386 1.00 23.03 C ATOM 1078 CG ASN A 75 -13.458 -8.564 -4.289 1.00 23.42 C ATOM 1079 OD1 ASN A 75 -14.357 -7.736 -4.388 1.00 34.02 O ATOM 1080 ND2 ASN A 75 -13.357 -9.343 -3.230 1.00 51.11 N ATOM 0 H ASN A 75 -10.665 -7.421 -6.598 1.00 60.13 H new ATOM 0 HA ASN A 75 -11.012 -7.996 -3.864 1.00 53.34 H new ATOM 0 HB2 ASN A 75 -12.597 -7.933 -6.155 1.00 23.03 H new ATOM 0 HB3 ASN A 75 -12.487 -9.658 -5.864 1.00 23.03 H new ATOM 0 HD21 ASN A 75 -14.035 -9.264 -2.472 1.00 51.11 H new ATOM 0 HD22 ASN A 75 -12.601 -10.025 -3.169 1.00 51.11 H new ATOM 1086 N ASN A 76 -9.347 -10.250 -5.424 1.00 32.23 N ATOM 1087 CA ASN A 76 -8.717 -11.575 -5.461 1.00 40.52 C ATOM 1088 C ASN A 76 -7.663 -11.792 -4.374 1.00 2.40 C ATOM 1089 O ASN A 76 -7.222 -12.927 -4.179 1.00 15.50 O ATOM 1090 CB ASN A 76 -7.973 -11.758 -6.797 1.00 0.50 C ATOM 1091 CG ASN A 76 -8.885 -11.819 -8.007 1.00 64.32 C ATOM 1092 OD1 ASN A 76 -9.407 -12.877 -8.350 1.00 74.32 O ATOM 1093 ND2 ASN A 76 -9.134 -10.695 -8.655 1.00 31.32 N ATOM 0 H ASN A 76 -8.949 -9.611 -6.112 1.00 32.23 H new ATOM 0 HA ASN A 76 -9.534 -12.281 -5.316 1.00 40.52 H new ATOM 0 HB2 ASN A 76 -7.270 -10.935 -6.926 1.00 0.50 H new ATOM 0 HB3 ASN A 76 -7.385 -12.675 -6.751 1.00 0.50 H new ATOM 0 HD21 ASN A 76 -9.768 -10.697 -9.454 1.00 31.32 H new ATOM 0 HD22 ASN A 76 -8.692 -9.826 -8.357 1.00 31.32 H new ATOM 1099 N TYR A 77 -7.165 -10.719 -3.760 1.00 31.11 N ATOM 1100 CA TYR A 77 -5.930 -10.730 -2.987 1.00 72.22 C ATOM 1101 C TYR A 77 -6.265 -10.938 -1.515 1.00 1.43 C ATOM 1102 O TYR A 77 -7.145 -10.284 -0.962 1.00 44.14 O ATOM 1103 CB TYR A 77 -5.135 -9.463 -3.303 1.00 31.24 C ATOM 1104 CG TYR A 77 -4.712 -9.441 -4.762 1.00 73.12 C ATOM 1105 CD1 TYR A 77 -3.576 -10.157 -5.171 1.00 44.15 C ATOM 1106 CD2 TYR A 77 -5.512 -8.806 -5.728 1.00 23.34 C ATOM 1107 CE1 TYR A 77 -3.218 -10.210 -6.529 1.00 1.22 C ATOM 1108 CE2 TYR A 77 -5.188 -8.878 -7.094 1.00 34.23 C ATOM 1109 CZ TYR A 77 -4.010 -9.546 -7.494 1.00 61.22 C ATOM 1110 OH TYR A 77 -3.665 -9.580 -8.807 1.00 12.24 O ATOM 0 H TYR A 77 -7.618 -9.805 -3.788 1.00 31.11 H new ATOM 0 HA TYR A 77 -5.280 -11.561 -3.259 1.00 72.22 H new ATOM 0 HB2 TYR A 77 -5.740 -8.584 -3.082 1.00 31.24 H new ATOM 0 HB3 TYR A 77 -4.254 -9.412 -2.663 1.00 31.24 H new ATOM 0 HD1 TYR A 77 -2.973 -10.671 -4.437 1.00 44.15 H new ATOM 0 HD2 TYR A 77 -6.387 -8.255 -5.416 1.00 23.34 H new ATOM 0 HE1 TYR A 77 -2.339 -10.757 -6.835 1.00 1.22 H new ATOM 0 HE2 TYR A 77 -5.835 -8.426 -7.831 1.00 34.23 H new ATOM 0 HH TYR A 77 -2.781 -9.992 -8.902 1.00 12.24 H new ATOM 1119 N ASP A 78 -5.603 -11.912 -0.895 1.00 60.14 N ATOM 1120 CA ASP A 78 -5.656 -12.146 0.547 1.00 13.33 C ATOM 1121 C ASP A 78 -4.943 -11.014 1.299 1.00 54.12 C ATOM 1122 O ASP A 78 -5.377 -10.626 2.382 1.00 3.30 O ATOM 1123 CB ASP A 78 -5.020 -13.510 0.863 1.00 63.13 C ATOM 1124 CG ASP A 78 -5.029 -13.824 2.355 1.00 71.33 C ATOM 1125 OD1 ASP A 78 -6.130 -13.912 2.946 1.00 35.11 O ATOM 1126 OD2 ASP A 78 -3.940 -14.141 2.885 1.00 34.43 O ATOM 0 H ASP A 78 -5.004 -12.573 -1.389 1.00 60.14 H new ATOM 0 HA ASP A 78 -6.695 -12.158 0.877 1.00 13.33 H new ATOM 0 HB2 ASP A 78 -5.558 -14.292 0.327 1.00 63.13 H new ATOM 0 HB3 ASP A 78 -3.993 -13.522 0.498 1.00 63.13 H new ATOM 1130 N LEU A 79 -3.883 -10.450 0.703 1.00 15.32 N ATOM 1131 CA LEU A 79 -3.041 -9.416 1.293 1.00 71.22 C ATOM 1132 C LEU A 79 -2.608 -8.416 0.210 1.00 64.33 C ATOM 1133 O LEU A 79 -2.311 -8.817 -0.920 1.00 21.04 O ATOM 1134 CB LEU A 79 -1.847 -10.128 1.945 1.00 53.41 C ATOM 1135 CG LEU A 79 -0.711 -9.217 2.434 1.00 74.21 C ATOM 1136 CD1 LEU A 79 -1.105 -8.341 3.630 1.00 13.53 C ATOM 1137 CD2 LEU A 79 0.476 -10.092 2.822 1.00 73.31 C ATOM 0 H LEU A 79 -3.583 -10.715 -0.235 1.00 15.32 H new ATOM 0 HA LEU A 79 -3.573 -8.840 2.050 1.00 71.22 H new ATOM 0 HB2 LEU A 79 -2.213 -10.708 2.792 1.00 53.41 H new ATOM 0 HB3 LEU A 79 -1.435 -10.837 1.227 1.00 53.41 H new ATOM 0 HG LEU A 79 -0.463 -8.538 1.618 1.00 74.21 H new ATOM 0 HD11 LEU A 79 -0.256 -7.723 3.924 1.00 13.53 H new ATOM 0 HD12 LEU A 79 -1.942 -7.700 3.352 1.00 13.53 H new ATOM 0 HD13 LEU A 79 -1.397 -8.977 4.466 1.00 13.53 H new ATOM 0 HD21 LEU A 79 1.294 -9.462 3.172 1.00 73.31 H new ATOM 0 HD22 LEU A 79 0.179 -10.776 3.617 1.00 73.31 H new ATOM 0 HD23 LEU A 79 0.805 -10.664 1.955 1.00 73.31 H new ATOM 1148 N ILE A 80 -2.533 -7.120 0.538 1.00 63.31 N ATOM 1149 CA ILE A 80 -2.005 -6.071 -0.341 1.00 60.44 C ATOM 1150 C ILE A 80 -1.057 -5.187 0.477 1.00 12.14 C ATOM 1151 O ILE A 80 -1.485 -4.527 1.426 1.00 72.22 O ATOM 1152 CB ILE A 80 -3.125 -5.278 -1.060 1.00 71.12 C ATOM 1153 CG1 ILE A 80 -4.076 -6.242 -1.812 1.00 51.54 C ATOM 1154 CG2 ILE A 80 -2.474 -4.278 -2.038 1.00 51.35 C ATOM 1155 CD1 ILE A 80 -5.110 -5.572 -2.729 1.00 23.00 C ATOM 0 H ILE A 80 -2.845 -6.765 1.442 1.00 63.31 H new ATOM 0 HA ILE A 80 -1.440 -6.525 -1.155 1.00 60.44 H new ATOM 0 HB ILE A 80 -3.719 -4.734 -0.326 1.00 71.12 H new ATOM 0 HG12 ILE A 80 -3.473 -6.924 -2.411 1.00 51.54 H new ATOM 0 HG13 ILE A 80 -4.607 -6.847 -1.077 1.00 51.54 H new ATOM 0 HG21 ILE A 80 -3.252 -3.713 -2.551 1.00 51.35 H new ATOM 0 HG22 ILE A 80 -1.833 -3.592 -1.484 1.00 51.35 H new ATOM 0 HG23 ILE A 80 -1.877 -4.822 -2.770 1.00 51.35 H new ATOM 0 HD11 ILE A 80 -5.723 -6.337 -3.206 1.00 23.00 H new ATOM 0 HD12 ILE A 80 -5.746 -4.912 -2.139 1.00 23.00 H new ATOM 0 HD13 ILE A 80 -4.595 -4.991 -3.494 1.00 23.00 H new ATOM 1166 N LEU A 81 0.233 -5.179 0.136 1.00 44.11 N ATOM 1167 CA LEU A 81 1.188 -4.224 0.701 1.00 11.24 C ATOM 1168 C LEU A 81 1.163 -2.955 -0.137 1.00 54.21 C ATOM 1169 O LEU A 81 0.972 -3.014 -1.356 1.00 42.24 O ATOM 1170 CB LEU A 81 2.618 -4.786 0.688 1.00 41.43 C ATOM 1171 CG LEU A 81 3.026 -5.609 1.926 1.00 2.50 C ATOM 1172 CD1 LEU A 81 3.469 -4.671 3.055 1.00 42.14 C ATOM 1173 CD2 LEU A 81 1.931 -6.547 2.448 1.00 1.40 C ATOM 0 H LEU A 81 0.643 -5.829 -0.535 1.00 44.11 H new ATOM 0 HA LEU A 81 0.902 -4.023 1.733 1.00 11.24 H new ATOM 0 HB2 LEU A 81 2.734 -5.413 -0.196 1.00 41.43 H new ATOM 0 HB3 LEU A 81 3.314 -3.954 0.582 1.00 41.43 H new ATOM 0 HG LEU A 81 3.848 -6.246 1.600 1.00 2.50 H new ATOM 0 HD11 LEU A 81 3.756 -5.260 3.926 1.00 42.14 H new ATOM 0 HD12 LEU A 81 4.321 -4.078 2.722 1.00 42.14 H new ATOM 0 HD13 LEU A 81 2.646 -4.007 3.321 1.00 42.14 H new ATOM 0 HD21 LEU A 81 2.300 -7.088 3.319 1.00 1.40 H new ATOM 0 HD22 LEU A 81 1.055 -5.963 2.728 1.00 1.40 H new ATOM 0 HD23 LEU A 81 1.659 -7.258 1.668 1.00 1.40 H new ATOM 1184 N ILE A 82 1.388 -1.807 0.503 1.00 15.42 N ATOM 1185 CA ILE A 82 1.274 -0.502 -0.129 1.00 74.15 C ATOM 1186 C ILE A 82 2.479 0.347 0.282 1.00 42.13 C ATOM 1187 O ILE A 82 2.855 0.370 1.457 1.00 51.35 O ATOM 1188 CB ILE A 82 -0.104 0.120 0.212 1.00 72.25 C ATOM 1189 CG1 ILE A 82 -1.236 -0.786 -0.343 1.00 20.24 C ATOM 1190 CG2 ILE A 82 -0.215 1.543 -0.360 1.00 44.12 C ATOM 1191 CD1 ILE A 82 -2.673 -0.337 -0.074 1.00 61.32 C ATOM 0 H ILE A 82 1.657 -1.762 1.486 1.00 15.42 H new ATOM 0 HA ILE A 82 1.301 -0.571 -1.216 1.00 74.15 H new ATOM 0 HB ILE A 82 -0.204 0.188 1.295 1.00 72.25 H new ATOM 0 HG12 ILE A 82 -1.104 -0.873 -1.421 1.00 20.24 H new ATOM 0 HG13 ILE A 82 -1.108 -1.784 0.075 1.00 20.24 H new ATOM 0 HG21 ILE A 82 -1.190 1.961 -0.109 1.00 44.12 H new ATOM 0 HG22 ILE A 82 0.569 2.169 0.067 1.00 44.12 H new ATOM 0 HG23 ILE A 82 -0.103 1.509 -1.444 1.00 44.12 H new ATOM 0 HD11 ILE A 82 -3.367 -1.054 -0.513 1.00 61.32 H new ATOM 0 HD12 ILE A 82 -2.841 -0.281 1.001 1.00 61.32 H new ATOM 0 HD13 ILE A 82 -2.837 0.645 -0.519 1.00 61.32 H new ATOM 1202 N GLY A 83 3.070 1.072 -0.673 1.00 62.23 N ATOM 1203 CA GLY A 83 4.312 1.829 -0.502 1.00 74.42 C ATOM 1204 C GLY A 83 4.185 3.294 -0.913 1.00 54.43 C ATOM 1205 O GLY A 83 3.589 3.574 -1.953 1.00 44.55 O ATOM 0 H GLY A 83 2.685 1.150 -1.614 1.00 62.23 H new ATOM 0 HA2 GLY A 83 4.621 1.777 0.542 1.00 74.42 H new ATOM 0 HA3 GLY A 83 5.100 1.360 -1.091 1.00 74.42 H new ATOM 1209 N SER A 84 4.795 4.221 -0.172 1.00 51.34 N ATOM 1210 CA SER A 84 4.773 5.653 -0.468 1.00 63.45 C ATOM 1211 C SER A 84 6.022 6.346 0.136 1.00 21.44 C ATOM 1212 O SER A 84 6.564 5.852 1.131 1.00 54.31 O ATOM 1213 CB SER A 84 3.432 6.189 0.069 1.00 54.52 C ATOM 1214 OG SER A 84 3.424 7.564 0.405 1.00 13.52 O ATOM 0 H SER A 84 5.328 3.992 0.667 1.00 51.34 H new ATOM 0 HA SER A 84 4.830 5.863 -1.536 1.00 63.45 H new ATOM 0 HB2 SER A 84 2.661 6.010 -0.681 1.00 54.52 H new ATOM 0 HB3 SER A 84 3.157 5.614 0.953 1.00 54.52 H new ATOM 0 HG SER A 84 3.578 7.666 1.367 1.00 13.52 H new ATOM 1219 N PRO A 85 6.473 7.491 -0.424 1.00 15.30 N ATOM 1220 CA PRO A 85 7.489 8.372 0.159 1.00 43.35 C ATOM 1221 C PRO A 85 6.939 9.112 1.375 1.00 40.55 C ATOM 1222 O PRO A 85 5.746 9.439 1.425 1.00 54.34 O ATOM 1223 CB PRO A 85 7.805 9.418 -0.926 1.00 62.35 C ATOM 1224 CG PRO A 85 6.554 9.456 -1.789 1.00 0.43 C ATOM 1225 CD PRO A 85 5.977 8.052 -1.668 1.00 54.15 C ATOM 0 HA PRO A 85 8.359 7.795 0.472 1.00 43.35 H new ATOM 0 HB2 PRO A 85 8.016 10.394 -0.488 1.00 62.35 H new ATOM 0 HB3 PRO A 85 8.681 9.134 -1.509 1.00 62.35 H new ATOM 0 HG2 PRO A 85 5.849 10.209 -1.436 1.00 0.43 H new ATOM 0 HG3 PRO A 85 6.791 9.702 -2.824 1.00 0.43 H new ATOM 0 HD2 PRO A 85 4.887 8.082 -1.669 1.00 54.15 H new ATOM 0 HD3 PRO A 85 6.280 7.437 -2.515 1.00 54.15 H new ATOM 1230 N VAL A 86 7.809 9.483 2.307 1.00 62.34 N ATOM 1231 CA VAL A 86 7.466 10.389 3.387 1.00 1.12 C ATOM 1232 C VAL A 86 7.878 11.813 2.983 1.00 52.53 C ATOM 1233 O VAL A 86 9.069 12.070 2.795 1.00 42.53 O ATOM 1234 CB VAL A 86 8.099 9.909 4.707 1.00 12.31 C ATOM 1235 CG1 VAL A 86 7.905 10.915 5.847 1.00 11.53 C ATOM 1236 CG2 VAL A 86 7.490 8.557 5.113 1.00 74.01 C ATOM 0 H VAL A 86 8.776 9.160 2.331 1.00 62.34 H new ATOM 0 HA VAL A 86 6.390 10.400 3.564 1.00 1.12 H new ATOM 0 HB VAL A 86 9.170 9.807 4.534 1.00 12.31 H new ATOM 0 HG11 VAL A 86 8.369 10.530 6.755 1.00 11.53 H new ATOM 0 HG12 VAL A 86 8.368 11.864 5.577 1.00 11.53 H new ATOM 0 HG13 VAL A 86 6.840 11.067 6.020 1.00 11.53 H new ATOM 0 HG21 VAL A 86 7.940 8.221 6.047 1.00 74.01 H new ATOM 0 HG22 VAL A 86 6.414 8.668 5.248 1.00 74.01 H new ATOM 0 HG23 VAL A 86 7.683 7.822 4.332 1.00 74.01 H new ATOM 1246 N TRP A 87 6.907 12.725 2.838 1.00 20.11 N ATOM 1247 CA TRP A 87 7.180 14.160 2.733 1.00 62.43 C ATOM 1248 C TRP A 87 7.529 14.727 4.122 1.00 40.12 C ATOM 1249 O TRP A 87 7.669 13.972 5.089 1.00 2.32 O ATOM 1250 CB TRP A 87 5.997 14.887 2.055 1.00 24.43 C ATOM 1251 CG TRP A 87 6.356 15.583 0.774 1.00 63.33 C ATOM 1252 CD1 TRP A 87 6.846 16.836 0.639 1.00 74.11 C ATOM 1253 CD2 TRP A 87 6.237 15.075 -0.583 1.00 42.34 C ATOM 1254 NE1 TRP A 87 7.082 17.110 -0.698 1.00 73.32 N ATOM 1255 CE2 TRP A 87 6.710 16.058 -1.499 1.00 33.42 C ATOM 1256 CE3 TRP A 87 5.713 13.892 -1.127 1.00 63.34 C ATOM 1257 CZ2 TRP A 87 6.694 15.864 -2.886 1.00 55.22 C ATOM 1258 CZ3 TRP A 87 5.611 13.719 -2.518 1.00 3.41 C ATOM 1259 CH2 TRP A 87 6.106 14.696 -3.402 1.00 1.51 C ATOM 0 H TRP A 87 5.916 12.488 2.791 1.00 20.11 H new ATOM 0 HA TRP A 87 8.047 14.329 2.094 1.00 62.43 H new ATOM 0 HB2 TRP A 87 5.208 14.163 1.853 1.00 24.43 H new ATOM 0 HB3 TRP A 87 5.588 15.619 2.751 1.00 24.43 H new ATOM 0 HD1 TRP A 87 7.027 17.522 1.453 1.00 74.11 H new ATOM 0 HE1 TRP A 87 7.481 17.982 -1.044 1.00 73.32 H new ATOM 0 HE3 TRP A 87 5.383 13.103 -0.467 1.00 63.34 H new ATOM 0 HZ2 TRP A 87 7.126 16.600 -3.548 1.00 55.22 H new ATOM 0 HZ3 TRP A 87 5.148 12.827 -2.913 1.00 3.41 H new ATOM 0 HH2 TRP A 87 6.035 14.549 -4.470 1.00 1.51 H new ATOM 1269 N SER A 88 7.657 16.050 4.259 1.00 74.25 N ATOM 1270 CA SER A 88 8.152 16.728 5.458 1.00 33.11 C ATOM 1271 C SER A 88 7.197 16.691 6.680 1.00 34.30 C ATOM 1272 O SER A 88 7.234 17.584 7.531 1.00 44.15 O ATOM 1273 CB SER A 88 8.607 18.153 5.089 1.00 42.41 C ATOM 1274 OG SER A 88 9.641 18.140 4.114 1.00 54.12 O ATOM 0 H SER A 88 7.410 16.699 3.512 1.00 74.25 H new ATOM 0 HA SER A 88 9.011 16.157 5.811 1.00 33.11 H new ATOM 0 HB2 SER A 88 7.757 18.720 4.710 1.00 42.41 H new ATOM 0 HB3 SER A 88 8.958 18.666 5.984 1.00 42.41 H new ATOM 0 HG SER A 88 9.903 19.060 3.903 1.00 54.12 H new ATOM 1279 N GLY A 89 6.349 15.668 6.790 1.00 31.02 N ATOM 1280 CA GLY A 89 5.472 15.320 7.903 1.00 20.42 C ATOM 1281 C GLY A 89 4.488 14.260 7.445 1.00 1.51 C ATOM 1282 O GLY A 89 4.287 13.273 8.146 1.00 0.22 O ATOM 0 H GLY A 89 6.251 14.999 6.026 1.00 31.02 H new ATOM 0 HA2 GLY A 89 6.059 14.950 8.743 1.00 20.42 H new ATOM 0 HA3 GLY A 89 4.938 16.204 8.252 1.00 20.42 H new ATOM 1286 N TYR A 90 3.892 14.460 6.269 1.00 64.02 N ATOM 1287 CA TYR A 90 2.646 13.816 5.876 1.00 20.21 C ATOM 1288 C TYR A 90 2.834 13.001 4.595 1.00 31.11 C ATOM 1289 O TYR A 90 3.830 13.183 3.885 1.00 62.35 O ATOM 1290 CB TYR A 90 1.551 14.893 5.693 1.00 1.42 C ATOM 1291 CG TYR A 90 1.478 15.973 6.767 1.00 15.22 C ATOM 1292 CD1 TYR A 90 1.549 15.604 8.118 1.00 63.03 C ATOM 1293 CD2 TYR A 90 1.354 17.337 6.435 1.00 42.34 C ATOM 1294 CE1 TYR A 90 1.560 16.565 9.136 1.00 60.45 C ATOM 1295 CE2 TYR A 90 1.392 18.319 7.446 1.00 51.23 C ATOM 1296 CZ TYR A 90 1.504 17.932 8.804 1.00 62.03 C ATOM 1297 OH TYR A 90 1.567 18.843 9.809 1.00 43.54 O ATOM 0 H TYR A 90 4.269 15.083 5.555 1.00 64.02 H new ATOM 0 HA TYR A 90 2.337 13.124 6.660 1.00 20.21 H new ATOM 0 HB2 TYR A 90 1.707 15.379 4.730 1.00 1.42 H new ATOM 0 HB3 TYR A 90 0.584 14.393 5.645 1.00 1.42 H new ATOM 0 HD1 TYR A 90 1.596 14.557 8.379 1.00 63.03 H new ATOM 0 HD2 TYR A 90 1.230 17.631 5.403 1.00 42.34 H new ATOM 0 HE1 TYR A 90 1.611 16.259 10.171 1.00 60.45 H new ATOM 0 HE2 TYR A 90 1.336 19.366 7.185 1.00 51.23 H new ATOM 0 HH TYR A 90 1.518 19.747 9.434 1.00 43.54 H new ATOM 1306 N PRO A 91 1.887 12.109 4.258 1.00 42.54 N ATOM 1307 CA PRO A 91 1.773 11.612 2.904 1.00 31.43 C ATOM 1308 C PRO A 91 1.328 12.742 1.998 1.00 41.13 C ATOM 1309 O PRO A 91 0.472 13.555 2.360 1.00 14.51 O ATOM 1310 CB PRO A 91 0.746 10.472 2.924 1.00 31.32 C ATOM 1311 CG PRO A 91 -0.049 10.696 4.217 1.00 44.55 C ATOM 1312 CD PRO A 91 0.866 11.534 5.115 1.00 20.33 C ATOM 0 HA PRO A 91 2.725 11.239 2.526 1.00 31.43 H new ATOM 0 HB2 PRO A 91 0.098 10.506 2.048 1.00 31.32 H new ATOM 0 HB3 PRO A 91 1.234 9.497 2.922 1.00 31.32 H new ATOM 0 HG2 PRO A 91 -0.986 11.215 4.017 1.00 44.55 H new ATOM 0 HG3 PRO A 91 -0.304 9.748 4.691 1.00 44.55 H new ATOM 0 HD2 PRO A 91 0.300 12.317 5.620 1.00 20.33 H new ATOM 0 HD3 PRO A 91 1.317 10.916 5.891 1.00 20.33 H new ATOM 1317 N ALA A 92 1.808 12.672 0.760 1.00 52.12 N ATOM 1318 CA ALA A 92 1.396 13.473 -0.389 1.00 1.12 C ATOM 1319 C ALA A 92 0.012 12.993 -0.911 1.00 61.42 C ATOM 1320 O ALA A 92 -0.227 12.900 -2.111 1.00 40.53 O ATOM 1321 CB ALA A 92 2.527 13.366 -1.421 1.00 74.24 C ATOM 0 H ALA A 92 2.545 12.010 0.516 1.00 52.12 H new ATOM 0 HA ALA A 92 1.250 14.524 -0.138 1.00 1.12 H new ATOM 0 HB1 ALA A 92 2.269 13.949 -2.305 1.00 74.24 H new ATOM 0 HB2 ALA A 92 3.451 13.750 -0.989 1.00 74.24 H new ATOM 0 HB3 ALA A 92 2.665 12.322 -1.703 1.00 74.24 H new ATOM 1327 N THR A 93 -0.785 12.423 -0.006 1.00 11.51 N ATOM 1328 CA THR A 93 -2.082 11.777 -0.187 1.00 64.43 C ATOM 1329 C THR A 93 -2.122 10.867 -1.449 1.00 14.20 C ATOM 1330 O THR A 93 -3.056 10.945 -2.240 1.00 2.42 O ATOM 1331 CB THR A 93 -3.198 12.834 0.003 1.00 74.24 C ATOM 1332 OG1 THR A 93 -3.095 13.925 -0.878 1.00 61.34 O ATOM 1333 CG2 THR A 93 -3.125 13.453 1.412 1.00 72.15 C ATOM 0 H THR A 93 -0.506 12.401 0.975 1.00 11.51 H new ATOM 0 HA THR A 93 -2.277 11.035 0.588 1.00 64.43 H new ATOM 0 HB THR A 93 -4.124 12.289 -0.179 1.00 74.24 H new ATOM 0 HG1 THR A 93 -3.828 14.553 -0.708 1.00 61.34 H new ATOM 0 HG21 THR A 93 -3.917 14.193 1.526 1.00 72.15 H new ATOM 0 HG22 THR A 93 -3.250 12.670 2.160 1.00 72.15 H new ATOM 0 HG23 THR A 93 -2.157 13.934 1.548 1.00 72.15 H new ATOM 1341 N PRO A 94 -1.180 9.914 -1.633 1.00 44.32 N ATOM 1342 CA PRO A 94 -0.962 9.230 -2.918 1.00 53.11 C ATOM 1343 C PRO A 94 -1.813 7.987 -3.119 1.00 40.15 C ATOM 1344 O PRO A 94 -1.951 7.505 -4.245 1.00 4.22 O ATOM 1345 CB PRO A 94 0.512 8.793 -2.879 1.00 4.43 C ATOM 1346 CG PRO A 94 0.755 8.547 -1.389 1.00 12.20 C ATOM 1347 CD PRO A 94 -0.092 9.607 -0.724 1.00 1.30 C ATOM 0 HA PRO A 94 -1.228 9.906 -3.731 1.00 53.11 H new ATOM 0 HB2 PRO A 94 0.683 7.893 -3.470 1.00 4.43 H new ATOM 0 HB3 PRO A 94 1.173 9.564 -3.274 1.00 4.43 H new ATOM 0 HG2 PRO A 94 0.452 7.543 -1.091 1.00 12.20 H new ATOM 0 HG3 PRO A 94 1.809 8.652 -1.130 1.00 12.20 H new ATOM 0 HD2 PRO A 94 -0.477 9.250 0.231 1.00 1.30 H new ATOM 0 HD3 PRO A 94 0.500 10.499 -0.516 1.00 1.30 H new ATOM 1352 N ILE A 95 -2.325 7.431 -2.029 1.00 74.41 N ATOM 1353 CA ILE A 95 -3.182 6.264 -2.060 1.00 34.42 C ATOM 1354 C ILE A 95 -4.652 6.740 -2.027 1.00 62.13 C ATOM 1355 O ILE A 95 -5.557 5.949 -2.254 1.00 34.02 O ATOM 1356 CB ILE A 95 -2.769 5.300 -0.920 1.00 14.51 C ATOM 1357 CG1 ILE A 95 -1.254 5.127 -0.669 1.00 51.25 C ATOM 1358 CG2 ILE A 95 -3.359 3.897 -1.140 1.00 22.31 C ATOM 1359 CD1 ILE A 95 -0.337 4.749 -1.842 1.00 14.42 C ATOM 0 H ILE A 95 -2.152 7.786 -1.089 1.00 74.41 H new ATOM 0 HA ILE A 95 -3.073 5.685 -2.977 1.00 34.42 H new ATOM 0 HB ILE A 95 -3.175 5.795 -0.038 1.00 14.51 H new ATOM 0 HG12 ILE A 95 -0.882 6.062 -0.250 1.00 51.25 H new ATOM 0 HG13 ILE A 95 -1.134 4.364 0.100 1.00 51.25 H new ATOM 0 HG21 ILE A 95 -3.053 3.242 -0.325 1.00 22.31 H new ATOM 0 HG22 ILE A 95 -4.447 3.960 -1.166 1.00 22.31 H new ATOM 0 HG23 ILE A 95 -2.996 3.494 -2.085 1.00 22.31 H new ATOM 0 HD11 ILE A 95 0.691 4.669 -1.489 1.00 14.42 H new ATOM 0 HD12 ILE A 95 -0.653 3.792 -2.257 1.00 14.42 H new ATOM 0 HD13 ILE A 95 -0.397 5.517 -2.613 1.00 14.42 H new ATOM 1370 N LYS A 96 -4.915 8.047 -1.852 1.00 41.22 N ATOM 1371 CA LYS A 96 -6.243 8.640 -1.710 1.00 64.42 C ATOM 1372 C LYS A 96 -7.168 8.266 -2.868 1.00 23.12 C ATOM 1373 O LYS A 96 -8.345 7.980 -2.640 1.00 12.12 O ATOM 1374 CB LYS A 96 -6.060 10.162 -1.561 1.00 43.32 C ATOM 1375 CG LYS A 96 -7.338 10.972 -1.341 1.00 4.13 C ATOM 1376 CD LYS A 96 -8.112 10.545 -0.086 1.00 74.44 C ATOM 1377 CE LYS A 96 -9.118 11.605 0.378 1.00 75.05 C ATOM 1378 NZ LYS A 96 -10.118 11.958 -0.653 1.00 22.03 N ATOM 0 H LYS A 96 -4.171 8.743 -1.805 1.00 41.22 H new ATOM 0 HA LYS A 96 -6.738 8.245 -0.823 1.00 64.42 H new ATOM 0 HB2 LYS A 96 -5.388 10.347 -0.723 1.00 43.32 H new ATOM 0 HB3 LYS A 96 -5.565 10.538 -2.456 1.00 43.32 H new ATOM 0 HG2 LYS A 96 -7.082 12.029 -1.261 1.00 4.13 H new ATOM 0 HG3 LYS A 96 -7.984 10.865 -2.213 1.00 4.13 H new ATOM 0 HD2 LYS A 96 -8.640 9.613 -0.289 1.00 74.44 H new ATOM 0 HD3 LYS A 96 -7.406 10.342 0.720 1.00 74.44 H new ATOM 0 HE2 LYS A 96 -9.635 11.240 1.265 1.00 75.05 H new ATOM 0 HE3 LYS A 96 -8.577 12.505 0.672 1.00 75.05 H new ATOM 0 HZ1 LYS A 96 -11.022 12.190 -0.195 1.00 22.03 H new ATOM 0 HZ2 LYS A 96 -9.783 12.780 -1.194 1.00 22.03 H new ATOM 0 HZ3 LYS A 96 -10.253 11.152 -1.296 1.00 22.03 H new ATOM 1388 N THR A 97 -6.658 8.248 -4.097 1.00 24.23 N ATOM 1389 CA THR A 97 -7.458 7.827 -5.243 1.00 60.11 C ATOM 1390 C THR A 97 -7.496 6.303 -5.343 1.00 34.14 C ATOM 1391 O THR A 97 -8.529 5.747 -5.716 1.00 62.34 O ATOM 1392 CB THR A 97 -6.875 8.403 -6.535 1.00 64.35 C ATOM 1393 OG1 THR A 97 -6.413 9.712 -6.338 1.00 31.33 O ATOM 1394 CG2 THR A 97 -7.857 8.368 -7.702 1.00 74.25 C ATOM 0 H THR A 97 -5.701 8.518 -4.324 1.00 24.23 H new ATOM 0 HA THR A 97 -8.473 8.200 -5.103 1.00 60.11 H new ATOM 0 HB THR A 97 -6.037 7.759 -6.800 1.00 64.35 H new ATOM 0 HG1 THR A 97 -5.454 9.753 -6.535 1.00 31.33 H new ATOM 0 HG21 THR A 97 -7.384 8.790 -8.589 1.00 74.25 H new ATOM 0 HG22 THR A 97 -8.148 7.337 -7.902 1.00 74.25 H new ATOM 0 HG23 THR A 97 -8.742 8.952 -7.450 1.00 74.25 H new ATOM 1402 N LEU A 98 -6.377 5.623 -5.059 1.00 53.25 N ATOM 1403 CA LEU A 98 -6.249 4.178 -5.233 1.00 1.43 C ATOM 1404 C LEU A 98 -7.225 3.458 -4.318 1.00 15.31 C ATOM 1405 O LEU A 98 -7.996 2.638 -4.800 1.00 62.33 O ATOM 1406 CB LEU A 98 -4.803 3.719 -4.974 1.00 52.32 C ATOM 1407 CG LEU A 98 -4.569 2.223 -5.282 1.00 11.12 C ATOM 1408 CD1 LEU A 98 -4.734 1.904 -6.771 1.00 42.44 C ATOM 1409 CD2 LEU A 98 -3.154 1.829 -4.845 1.00 41.31 C ATOM 0 H LEU A 98 -5.532 6.067 -4.700 1.00 53.25 H new ATOM 0 HA LEU A 98 -6.492 3.926 -6.265 1.00 1.43 H new ATOM 0 HB2 LEU A 98 -4.125 4.318 -5.582 1.00 52.32 H new ATOM 0 HB3 LEU A 98 -4.550 3.912 -3.931 1.00 52.32 H new ATOM 0 HG LEU A 98 -5.319 1.655 -4.731 1.00 11.12 H new ATOM 0 HD11 LEU A 98 -4.560 0.841 -6.937 1.00 42.44 H new ATOM 0 HD12 LEU A 98 -5.745 2.160 -7.088 1.00 42.44 H new ATOM 0 HD13 LEU A 98 -4.015 2.484 -7.349 1.00 42.44 H new ATOM 0 HD21 LEU A 98 -2.987 0.774 -5.061 1.00 41.31 H new ATOM 0 HD22 LEU A 98 -2.425 2.431 -5.388 1.00 41.31 H new ATOM 0 HD23 LEU A 98 -3.042 2.002 -3.775 1.00 41.31 H new ATOM 1420 N LEU A 99 -7.244 3.812 -3.032 1.00 53.52 N ATOM 1421 CA LEU A 99 -8.092 3.240 -1.997 1.00 33.00 C ATOM 1422 C LEU A 99 -9.547 3.218 -2.453 1.00 42.44 C ATOM 1423 O LEU A 99 -10.244 2.230 -2.220 1.00 43.24 O ATOM 1424 CB LEU A 99 -7.799 3.962 -0.664 1.00 74.01 C ATOM 1425 CG LEU A 99 -8.734 5.133 -0.308 1.00 13.53 C ATOM 1426 CD1 LEU A 99 -9.918 4.565 0.465 1.00 0.54 C ATOM 1427 CD2 LEU A 99 -8.079 6.168 0.590 1.00 72.33 C ATOM 0 H LEU A 99 -6.634 4.545 -2.670 1.00 53.52 H new ATOM 0 HA LEU A 99 -7.867 2.189 -1.815 1.00 33.00 H new ATOM 0 HB2 LEU A 99 -7.846 3.229 0.141 1.00 74.01 H new ATOM 0 HB3 LEU A 99 -6.776 4.337 -0.694 1.00 74.01 H new ATOM 0 HG LEU A 99 -9.015 5.619 -1.242 1.00 13.53 H new ATOM 0 HD11 LEU A 99 -10.600 5.373 0.732 1.00 0.54 H new ATOM 0 HD12 LEU A 99 -10.442 3.838 -0.155 1.00 0.54 H new ATOM 0 HD13 LEU A 99 -9.560 4.078 1.372 1.00 0.54 H new ATOM 0 HD21 LEU A 99 -8.790 6.966 0.804 1.00 72.33 H new ATOM 0 HD22 LEU A 99 -7.771 5.697 1.523 1.00 72.33 H new ATOM 0 HD23 LEU A 99 -7.206 6.585 0.088 1.00 72.33 H new ATOM 1438 N ASP A 100 -9.998 4.265 -3.143 1.00 74.22 N ATOM 1439 CA ASP A 100 -11.373 4.392 -3.607 1.00 21.14 C ATOM 1440 C ASP A 100 -11.700 3.305 -4.634 1.00 72.32 C ATOM 1441 O ASP A 100 -12.762 2.689 -4.576 1.00 33.24 O ATOM 1442 CB ASP A 100 -11.583 5.797 -4.180 1.00 3.24 C ATOM 1443 CG ASP A 100 -13.054 6.193 -4.274 1.00 62.31 C ATOM 1444 OD1 ASP A 100 -13.864 5.775 -3.413 1.00 11.11 O ATOM 1445 OD2 ASP A 100 -13.376 7.088 -5.089 1.00 53.54 O ATOM 0 H ASP A 100 -9.408 5.058 -3.397 1.00 74.22 H new ATOM 0 HA ASP A 100 -12.057 4.254 -2.770 1.00 21.14 H new ATOM 0 HB2 ASP A 100 -11.058 6.520 -3.555 1.00 3.24 H new ATOM 0 HB3 ASP A 100 -11.135 5.849 -5.172 1.00 3.24 H new ATOM 1449 N GLN A 101 -10.733 2.979 -5.498 1.00 74.42 N ATOM 1450 CA GLN A 101 -10.819 1.901 -6.482 1.00 1.24 C ATOM 1451 C GLN A 101 -10.847 0.509 -5.836 1.00 35.41 C ATOM 1452 O GLN A 101 -10.975 -0.483 -6.557 1.00 40.41 O ATOM 1453 CB GLN A 101 -9.633 1.943 -7.459 1.00 34.33 C ATOM 1454 CG GLN A 101 -9.220 3.322 -7.971 1.00 20.41 C ATOM 1455 CD GLN A 101 -10.369 4.236 -8.385 1.00 74.21 C ATOM 1456 OE1 GLN A 101 -11.345 3.807 -8.984 1.00 31.20 O ATOM 1457 NE2 GLN A 101 -10.240 5.531 -8.140 1.00 2.20 N ATOM 0 H GLN A 101 -9.842 3.475 -5.531 1.00 74.42 H new ATOM 0 HA GLN A 101 -11.757 2.065 -7.012 1.00 1.24 H new ATOM 0 HB2 GLN A 101 -8.772 1.489 -6.969 1.00 34.33 H new ATOM 0 HB3 GLN A 101 -9.877 1.319 -8.319 1.00 34.33 H new ATOM 0 HG2 GLN A 101 -8.642 3.822 -7.193 1.00 20.41 H new ATOM 0 HG3 GLN A 101 -8.557 3.190 -8.826 1.00 20.41 H new ATOM 0 HE21 GLN A 101 -9.421 5.876 -7.639 1.00 2.20 H new ATOM 0 HE22 GLN A 101 -10.960 6.183 -8.452 1.00 2.20 H new ATOM 1464 N MET A 102 -10.648 0.403 -4.517 1.00 33.13 N ATOM 1465 CA MET A 102 -10.460 -0.859 -3.800 1.00 2.50 C ATOM 1466 C MET A 102 -11.441 -0.979 -2.612 1.00 53.33 C ATOM 1467 O MET A 102 -11.244 -1.802 -1.718 1.00 11.43 O ATOM 1468 CB MET A 102 -8.991 -1.025 -3.353 1.00 1.43 C ATOM 1469 CG MET A 102 -7.914 -0.570 -4.356 1.00 35.12 C ATOM 1470 SD MET A 102 -6.315 -1.437 -4.442 1.00 33.30 S ATOM 1471 CE MET A 102 -5.989 -1.885 -2.726 1.00 61.45 C ATOM 0 H MET A 102 -10.613 1.217 -3.904 1.00 33.13 H new ATOM 0 HA MET A 102 -10.687 -1.676 -4.485 1.00 2.50 H new ATOM 0 HB2 MET A 102 -8.851 -0.469 -2.426 1.00 1.43 H new ATOM 0 HB3 MET A 102 -8.821 -2.077 -3.123 1.00 1.43 H new ATOM 0 HG2 MET A 102 -8.359 -0.614 -5.350 1.00 35.12 H new ATOM 0 HG3 MET A 102 -7.702 0.479 -4.148 1.00 35.12 H new ATOM 0 HE1 MET A 102 -4.928 -2.103 -2.602 1.00 61.45 H new ATOM 0 HE2 MET A 102 -6.268 -1.057 -2.074 1.00 61.45 H new ATOM 0 HE3 MET A 102 -6.574 -2.766 -2.463 1.00 61.45 H new ATOM 1479 N LYS A 103 -12.499 -0.152 -2.565 1.00 33.22 N ATOM 1480 CA LYS A 103 -13.562 -0.146 -1.538 1.00 74.15 C ATOM 1481 C LYS A 103 -14.333 -1.468 -1.436 1.00 24.10 C ATOM 1482 O LYS A 103 -15.166 -1.615 -0.549 1.00 21.20 O ATOM 1483 CB LYS A 103 -14.554 0.995 -1.867 1.00 35.11 C ATOM 1484 CG LYS A 103 -14.070 2.431 -1.616 1.00 3.10 C ATOM 1485 CD LYS A 103 -14.365 2.914 -0.188 1.00 22.03 C ATOM 1486 CE LYS A 103 -13.821 4.326 0.070 1.00 72.25 C ATOM 1487 NZ LYS A 103 -14.512 5.377 -0.706 1.00 12.22 N ATOM 0 H LYS A 103 -12.646 0.566 -3.275 1.00 33.22 H new ATOM 0 HA LYS A 103 -13.075 0.001 -0.574 1.00 74.15 H new ATOM 0 HB2 LYS A 103 -14.833 0.910 -2.917 1.00 35.11 H new ATOM 0 HB3 LYS A 103 -15.460 0.836 -1.283 1.00 35.11 H new ATOM 0 HG2 LYS A 103 -12.997 2.486 -1.799 1.00 3.10 H new ATOM 0 HG3 LYS A 103 -14.550 3.102 -2.329 1.00 3.10 H new ATOM 0 HD2 LYS A 103 -15.442 2.905 -0.018 1.00 22.03 H new ATOM 0 HD3 LYS A 103 -13.923 2.220 0.527 1.00 22.03 H new ATOM 0 HE2 LYS A 103 -13.911 4.552 1.132 1.00 72.25 H new ATOM 0 HE3 LYS A 103 -12.758 4.347 -0.172 1.00 72.25 H new ATOM 0 HZ1 LYS A 103 -14.323 6.306 -0.278 1.00 12.22 H new ATOM 0 HZ2 LYS A 103 -14.164 5.370 -1.686 1.00 12.22 H new ATOM 0 HZ3 LYS A 103 -15.536 5.196 -0.701 1.00 12.22 H new ATOM 1497 N ASN A 104 -14.116 -2.414 -2.338 1.00 2.40 N ATOM 1498 CA ASN A 104 -14.700 -3.738 -2.384 1.00 72.25 C ATOM 1499 C ASN A 104 -13.877 -4.784 -1.620 1.00 71.33 C ATOM 1500 O ASN A 104 -14.288 -5.936 -1.522 1.00 1.51 O ATOM 1501 CB ASN A 104 -14.739 -4.128 -3.863 1.00 61.21 C ATOM 1502 CG ASN A 104 -13.354 -4.209 -4.499 1.00 51.51 C ATOM 1503 OD1 ASN A 104 -12.618 -3.226 -4.528 1.00 20.11 O ATOM 1504 ND2 ASN A 104 -12.968 -5.341 -5.045 1.00 20.20 N ATOM 0 H ASN A 104 -13.475 -2.259 -3.116 1.00 2.40 H new ATOM 0 HA ASN A 104 -15.683 -3.714 -1.914 1.00 72.25 H new ATOM 0 HB2 ASN A 104 -15.236 -5.093 -3.965 1.00 61.21 H new ATOM 0 HB3 ASN A 104 -15.340 -3.401 -4.408 1.00 61.21 H new ATOM 0 HD21 ASN A 104 -12.055 -5.405 -5.495 1.00 20.20 H new ATOM 0 HD22 ASN A 104 -13.582 -6.155 -5.019 1.00 20.20 H new ATOM 1510 N TYR A 105 -12.681 -4.437 -1.143 1.00 72.23 N ATOM 1511 CA TYR A 105 -11.704 -5.394 -0.633 1.00 34.22 C ATOM 1512 C TYR A 105 -12.065 -5.951 0.755 1.00 55.15 C ATOM 1513 O TYR A 105 -12.743 -5.286 1.536 1.00 24.33 O ATOM 1514 CB TYR A 105 -10.358 -4.664 -0.609 1.00 15.42 C ATOM 1515 CG TYR A 105 -9.193 -5.516 -0.186 1.00 22.31 C ATOM 1516 CD1 TYR A 105 -8.608 -6.389 -1.117 1.00 0.11 C ATOM 1517 CD2 TYR A 105 -8.683 -5.423 1.122 1.00 44.51 C ATOM 1518 CE1 TYR A 105 -7.507 -7.170 -0.745 1.00 72.23 C ATOM 1519 CE2 TYR A 105 -7.557 -6.176 1.479 1.00 63.43 C ATOM 1520 CZ TYR A 105 -6.971 -7.066 0.554 1.00 24.40 C ATOM 1521 OH TYR A 105 -5.889 -7.806 0.894 1.00 20.23 O ATOM 0 H TYR A 105 -12.361 -3.469 -1.100 1.00 72.23 H new ATOM 0 HA TYR A 105 -11.675 -6.271 -1.280 1.00 34.22 H new ATOM 0 HB2 TYR A 105 -10.158 -4.265 -1.603 1.00 15.42 H new ATOM 0 HB3 TYR A 105 -10.433 -3.812 0.067 1.00 15.42 H new ATOM 0 HD1 TYR A 105 -9.007 -6.458 -2.118 1.00 0.11 H new ATOM 0 HD2 TYR A 105 -9.156 -4.776 1.846 1.00 44.51 H new ATOM 0 HE1 TYR A 105 -7.067 -7.854 -1.456 1.00 72.23 H new ATOM 0 HE2 TYR A 105 -7.135 -6.075 2.468 1.00 63.43 H new ATOM 0 HH TYR A 105 -5.431 -7.387 1.652 1.00 20.23 H new ATOM 1530 N ARG A 106 -11.618 -7.186 1.050 1.00 24.24 N ATOM 1531 CA ARG A 106 -12.014 -7.992 2.215 1.00 23.03 C ATOM 1532 C ARG A 106 -10.851 -8.816 2.804 1.00 71.44 C ATOM 1533 O ARG A 106 -11.097 -9.850 3.424 1.00 34.21 O ATOM 1534 CB ARG A 106 -13.163 -8.935 1.794 1.00 74.24 C ATOM 1535 CG ARG A 106 -14.361 -8.243 1.128 1.00 33.00 C ATOM 1536 CD ARG A 106 -15.196 -7.414 2.108 1.00 53.35 C ATOM 1537 NE ARG A 106 -16.044 -8.271 2.955 1.00 62.03 N ATOM 1538 CZ ARG A 106 -16.394 -8.041 4.227 1.00 71.15 C ATOM 1539 NH1 ARG A 106 -15.999 -6.956 4.880 1.00 55.34 N ATOM 1540 NH2 ARG A 106 -17.157 -8.917 4.865 1.00 1.22 N ATOM 0 H ARG A 106 -10.943 -7.668 0.457 1.00 24.24 H new ATOM 0 HA ARG A 106 -12.335 -7.306 2.999 1.00 23.03 H new ATOM 0 HB2 ARG A 106 -12.766 -9.682 1.107 1.00 74.24 H new ATOM 0 HB3 ARG A 106 -13.516 -9.469 2.676 1.00 74.24 H new ATOM 0 HG2 ARG A 106 -14.001 -7.595 0.329 1.00 33.00 H new ATOM 0 HG3 ARG A 106 -14.997 -8.997 0.665 1.00 33.00 H new ATOM 0 HD2 ARG A 106 -14.535 -6.819 2.738 1.00 53.35 H new ATOM 0 HD3 ARG A 106 -15.822 -6.715 1.553 1.00 53.35 H new ATOM 0 HE ARG A 106 -16.401 -9.126 2.529 1.00 62.03 H new ATOM 0 HH11 ARG A 106 -15.410 -6.266 4.413 1.00 55.34 H new ATOM 0 HH12 ARG A 106 -16.284 -6.812 5.849 1.00 55.34 H new ATOM 0 HH21 ARG A 106 -17.474 -9.760 4.387 1.00 1.22 H new ATOM 0 HH22 ARG A 106 -17.427 -8.748 5.834 1.00 1.22 H new ATOM 1551 N GLY A 107 -9.596 -8.423 2.562 1.00 2.11 N ATOM 1552 CA GLY A 107 -8.393 -9.105 3.047 1.00 11.10 C ATOM 1553 C GLY A 107 -7.575 -8.183 3.947 1.00 75.45 C ATOM 1554 O GLY A 107 -8.099 -7.209 4.485 1.00 0.41 O ATOM 0 H GLY A 107 -9.384 -7.595 2.005 1.00 2.11 H new ATOM 0 HA2 GLY A 107 -8.675 -10.002 3.598 1.00 11.10 H new ATOM 0 HA3 GLY A 107 -7.786 -9.428 2.201 1.00 11.10 H new ATOM 1558 N GLU A 108 -6.287 -8.470 4.095 1.00 22.03 N ATOM 1559 CA GLU A 108 -5.354 -7.765 4.947 1.00 42.53 C ATOM 1560 C GLU A 108 -4.576 -6.727 4.134 1.00 62.05 C ATOM 1561 O GLU A 108 -4.425 -6.870 2.917 1.00 74.25 O ATOM 1562 CB GLU A 108 -4.432 -8.836 5.549 1.00 73.22 C ATOM 1563 CG GLU A 108 -4.993 -9.396 6.860 1.00 61.02 C ATOM 1564 CD GLU A 108 -6.352 -10.100 6.847 1.00 32.42 C ATOM 1565 OE1 GLU A 108 -7.389 -9.398 6.848 1.00 41.25 O ATOM 1566 OE2 GLU A 108 -6.406 -11.334 7.041 1.00 34.31 O ATOM 0 H GLU A 108 -5.848 -9.243 3.595 1.00 22.03 H new ATOM 0 HA GLU A 108 -5.859 -7.213 5.740 1.00 42.53 H new ATOM 0 HB2 GLU A 108 -4.301 -9.648 4.833 1.00 73.22 H new ATOM 0 HB3 GLU A 108 -3.446 -8.408 5.729 1.00 73.22 H new ATOM 0 HG2 GLU A 108 -4.262 -10.101 7.256 1.00 61.02 H new ATOM 0 HG3 GLU A 108 -5.057 -8.571 7.569 1.00 61.02 H new ATOM 1571 N VAL A 109 -4.070 -5.674 4.783 1.00 41.33 N ATOM 1572 CA VAL A 109 -3.358 -4.584 4.120 1.00 1.41 C ATOM 1573 C VAL A 109 -2.220 -4.134 5.038 1.00 32.24 C ATOM 1574 O VAL A 109 -2.401 -4.132 6.252 1.00 63.21 O ATOM 1575 CB VAL A 109 -4.360 -3.435 3.848 1.00 54.15 C ATOM 1576 CG1 VAL A 109 -3.717 -2.318 3.011 1.00 11.24 C ATOM 1577 CG2 VAL A 109 -5.617 -3.890 3.094 1.00 34.13 C ATOM 0 H VAL A 109 -4.145 -5.556 5.793 1.00 41.33 H new ATOM 0 HA VAL A 109 -2.934 -4.899 3.166 1.00 1.41 H new ATOM 0 HB VAL A 109 -4.643 -3.077 4.838 1.00 54.15 H new ATOM 0 HG11 VAL A 109 -4.447 -1.527 2.838 1.00 11.24 H new ATOM 0 HG12 VAL A 109 -2.860 -1.910 3.546 1.00 11.24 H new ATOM 0 HG13 VAL A 109 -3.388 -2.724 2.054 1.00 11.24 H new ATOM 0 HG21 VAL A 109 -6.276 -3.036 2.937 1.00 34.13 H new ATOM 0 HG22 VAL A 109 -5.331 -4.310 2.130 1.00 34.13 H new ATOM 0 HG23 VAL A 109 -6.138 -4.647 3.679 1.00 34.13 H new ATOM 1587 N ALA A 110 -1.059 -3.719 4.526 1.00 42.33 N ATOM 1588 CA ALA A 110 -0.065 -3.043 5.359 1.00 64.34 C ATOM 1589 C ALA A 110 0.650 -1.936 4.598 1.00 40.43 C ATOM 1590 O ALA A 110 0.761 -2.005 3.371 1.00 40.21 O ATOM 1591 CB ALA A 110 0.933 -4.049 5.934 1.00 0.24 C ATOM 0 H ALA A 110 -0.787 -3.838 3.550 1.00 42.33 H new ATOM 0 HA ALA A 110 -0.594 -2.574 6.188 1.00 64.34 H new ATOM 0 HB1 ALA A 110 1.664 -3.525 6.550 1.00 0.24 H new ATOM 0 HB2 ALA A 110 0.402 -4.781 6.543 1.00 0.24 H new ATOM 0 HB3 ALA A 110 1.446 -4.559 5.119 1.00 0.24 H new ATOM 1597 N SER A 111 1.137 -0.917 5.319 1.00 33.23 N ATOM 1598 CA SER A 111 1.611 0.305 4.684 1.00 73.31 C ATOM 1599 C SER A 111 3.067 0.555 5.085 1.00 75.35 C ATOM 1600 O SER A 111 3.350 1.011 6.195 1.00 64.45 O ATOM 1601 CB SER A 111 0.623 1.411 5.060 1.00 54.31 C ATOM 1602 OG SER A 111 0.466 2.384 4.052 1.00 2.21 O ATOM 0 H SER A 111 1.210 -0.921 6.336 1.00 33.23 H new ATOM 0 HA SER A 111 1.634 0.251 3.596 1.00 73.31 H new ATOM 0 HB2 SER A 111 -0.347 0.964 5.278 1.00 54.31 H new ATOM 0 HB3 SER A 111 0.963 1.897 5.975 1.00 54.31 H new ATOM 0 HG SER A 111 -0.432 2.772 4.109 1.00 2.21 H new ATOM 1607 N PHE A 112 4.016 0.191 4.223 1.00 64.31 N ATOM 1608 CA PHE A 112 5.431 0.466 4.468 1.00 62.04 C ATOM 1609 C PHE A 112 5.759 1.871 3.960 1.00 55.14 C ATOM 1610 O PHE A 112 5.090 2.394 3.064 1.00 32.41 O ATOM 1611 CB PHE A 112 6.313 -0.586 3.774 1.00 13.34 C ATOM 1612 CG PHE A 112 6.502 -0.424 2.274 1.00 14.22 C ATOM 1613 CD1 PHE A 112 7.469 0.473 1.778 1.00 1.33 C ATOM 1614 CD2 PHE A 112 5.732 -1.184 1.373 1.00 64.22 C ATOM 1615 CE1 PHE A 112 7.654 0.622 0.394 1.00 73.22 C ATOM 1616 CE2 PHE A 112 5.934 -1.050 -0.011 1.00 4.42 C ATOM 1617 CZ PHE A 112 6.910 -0.162 -0.499 1.00 51.14 C ATOM 0 H PHE A 112 3.829 -0.296 3.347 1.00 64.31 H new ATOM 0 HA PHE A 112 5.633 0.414 5.538 1.00 62.04 H new ATOM 0 HB2 PHE A 112 7.296 -0.574 4.246 1.00 13.34 H new ATOM 0 HB3 PHE A 112 5.882 -1.570 3.960 1.00 13.34 H new ATOM 0 HD1 PHE A 112 8.071 1.049 2.466 1.00 1.33 H new ATOM 0 HD2 PHE A 112 4.986 -1.870 1.746 1.00 64.22 H new ATOM 0 HE1 PHE A 112 8.368 1.339 0.018 1.00 73.22 H new ATOM 0 HE2 PHE A 112 5.339 -1.630 -0.701 1.00 4.42 H new ATOM 0 HZ PHE A 112 7.086 -0.084 -1.562 1.00 51.14 H new ATOM 1626 N PHE A 113 6.823 2.475 4.488 1.00 15.33 N ATOM 1627 CA PHE A 113 7.271 3.806 4.100 1.00 1.53 C ATOM 1628 C PHE A 113 8.788 3.861 4.141 1.00 72.13 C ATOM 1629 O PHE A 113 9.443 2.908 4.566 1.00 71.45 O ATOM 1630 CB PHE A 113 6.654 4.853 5.033 1.00 20.03 C ATOM 1631 CG PHE A 113 5.165 4.982 4.831 1.00 75.23 C ATOM 1632 CD1 PHE A 113 4.283 4.146 5.541 1.00 64.22 C ATOM 1633 CD2 PHE A 113 4.667 5.861 3.854 1.00 55.52 C ATOM 1634 CE1 PHE A 113 2.905 4.221 5.325 1.00 43.24 C ATOM 1635 CE2 PHE A 113 3.291 5.846 3.573 1.00 75.41 C ATOM 1636 CZ PHE A 113 2.408 5.070 4.337 1.00 33.13 C ATOM 0 H PHE A 113 7.404 2.045 5.207 1.00 15.33 H new ATOM 0 HA PHE A 113 6.945 4.025 3.083 1.00 1.53 H new ATOM 0 HB2 PHE A 113 6.857 4.580 6.069 1.00 20.03 H new ATOM 0 HB3 PHE A 113 7.129 5.819 4.859 1.00 20.03 H new ATOM 0 HD1 PHE A 113 4.675 3.441 6.259 1.00 64.22 H new ATOM 0 HD2 PHE A 113 5.329 6.534 3.330 1.00 55.52 H new ATOM 0 HE1 PHE A 113 2.229 3.625 5.920 1.00 43.24 H new ATOM 0 HE2 PHE A 113 2.908 6.441 2.757 1.00 75.41 H new ATOM 0 HZ PHE A 113 1.344 5.130 4.160 1.00 33.13 H new ATOM 1645 N THR A 114 9.358 4.969 3.692 1.00 64.42 N ATOM 1646 CA THR A 114 10.791 5.202 3.681 1.00 11.11 C ATOM 1647 C THR A 114 10.963 6.682 4.005 1.00 13.53 C ATOM 1648 O THR A 114 10.214 7.518 3.487 1.00 21.44 O ATOM 1649 CB THR A 114 11.432 4.650 2.380 1.00 4.42 C ATOM 1650 OG1 THR A 114 12.501 5.425 1.875 1.00 31.41 O ATOM 1651 CG2 THR A 114 10.433 4.399 1.243 1.00 20.43 C ATOM 0 H THR A 114 8.821 5.750 3.316 1.00 64.42 H new ATOM 0 HA THR A 114 11.352 4.649 4.434 1.00 11.11 H new ATOM 0 HB THR A 114 11.830 3.693 2.716 1.00 4.42 H new ATOM 0 HG1 THR A 114 12.849 5.010 1.058 1.00 31.41 H new ATOM 0 HG21 THR A 114 10.963 4.014 0.372 1.00 20.43 H new ATOM 0 HG22 THR A 114 9.689 3.671 1.566 1.00 20.43 H new ATOM 0 HG23 THR A 114 9.936 5.333 0.982 1.00 20.43 H new ATOM 1659 N SER A 115 11.827 6.959 4.978 1.00 44.41 N ATOM 1660 CA SER A 115 11.923 8.234 5.672 1.00 41.52 C ATOM 1661 C SER A 115 13.339 8.439 6.214 1.00 55.13 C ATOM 1662 O SER A 115 14.115 7.486 6.345 1.00 20.11 O ATOM 1663 CB SER A 115 10.858 8.303 6.786 1.00 75.05 C ATOM 1664 OG SER A 115 10.700 7.100 7.523 1.00 40.21 O ATOM 0 H SER A 115 12.503 6.274 5.315 1.00 44.41 H new ATOM 0 HA SER A 115 11.726 9.047 4.973 1.00 41.52 H new ATOM 0 HB2 SER A 115 11.123 9.105 7.475 1.00 75.05 H new ATOM 0 HB3 SER A 115 9.900 8.570 6.340 1.00 75.05 H new ATOM 0 HG SER A 115 10.011 7.225 8.209 1.00 40.21 H new ATOM 1669 N ALA A 116 13.658 9.678 6.598 1.00 52.32 N ATOM 1670 CA ALA A 116 14.938 10.121 7.133 1.00 23.11 C ATOM 1671 C ALA A 116 14.990 9.909 8.651 1.00 4.33 C ATOM 1672 O ALA A 116 15.635 10.677 9.380 1.00 54.32 O ATOM 1673 CB ALA A 116 15.126 11.600 6.773 1.00 51.45 C ATOM 0 H ALA A 116 12.984 10.442 6.538 1.00 52.32 H new ATOM 0 HA ALA A 116 15.748 9.536 6.698 1.00 23.11 H new ATOM 0 HB1 ALA A 116 16.080 11.952 7.165 1.00 51.45 H new ATOM 0 HB2 ALA A 116 15.115 11.715 5.689 1.00 51.45 H new ATOM 0 HB3 ALA A 116 14.317 12.186 7.208 1.00 51.45 H new ATOM 1679 N GLY A 117 14.238 8.924 9.151 1.00 31.43 N ATOM 1680 CA GLY A 117 14.092 8.675 10.570 1.00 41.31 C ATOM 1681 C GLY A 117 13.395 9.831 11.279 1.00 11.30 C ATOM 1682 O GLY A 117 13.845 10.279 12.338 1.00 12.10 O ATOM 0 H GLY A 117 13.711 8.275 8.567 1.00 31.43 H new ATOM 0 HA2 GLY A 117 13.521 7.759 10.721 1.00 41.31 H new ATOM 0 HA3 GLY A 117 15.075 8.516 11.014 1.00 41.31 H new ATOM 1686 N THR A 118 12.312 10.334 10.692 1.00 22.20 N ATOM 1687 CA THR A 118 11.465 11.398 11.214 1.00 44.11 C ATOM 1688 C THR A 118 10.015 11.100 10.820 1.00 35.42 C ATOM 1689 O THR A 118 9.766 10.134 10.096 1.00 11.24 O ATOM 1690 CB THR A 118 11.925 12.760 10.664 1.00 34.14 C ATOM 1691 OG1 THR A 118 12.052 12.730 9.259 1.00 41.24 O ATOM 1692 CG2 THR A 118 13.260 13.215 11.257 1.00 44.12 C ATOM 0 H THR A 118 11.986 9.989 9.789 1.00 22.20 H new ATOM 0 HA THR A 118 11.539 11.443 12.301 1.00 44.11 H new ATOM 0 HB THR A 118 11.151 13.470 10.956 1.00 34.14 H new ATOM 0 HG1 THR A 118 12.344 13.609 8.938 1.00 41.24 H new ATOM 0 HG21 THR A 118 13.536 14.181 10.834 1.00 44.12 H new ATOM 0 HG22 THR A 118 13.165 13.307 12.339 1.00 44.12 H new ATOM 0 HG23 THR A 118 14.032 12.482 11.021 1.00 44.12 H new ATOM 1700 N ASN A 119 9.059 11.918 11.286 1.00 41.53 N ATOM 1701 CA ASN A 119 7.661 11.983 10.821 1.00 31.04 C ATOM 1702 C ASN A 119 6.845 10.703 11.045 1.00 63.44 C ATOM 1703 O ASN A 119 5.666 10.641 10.710 1.00 44.44 O ATOM 1704 CB ASN A 119 7.606 12.467 9.358 1.00 75.05 C ATOM 1705 CG ASN A 119 8.265 13.831 9.176 1.00 55.52 C ATOM 1706 OD1 ASN A 119 8.218 14.662 10.077 1.00 44.32 O ATOM 1707 ND2 ASN A 119 8.881 14.104 8.040 1.00 74.15 N ATOM 0 H ASN A 119 9.247 12.586 12.034 1.00 41.53 H new ATOM 0 HA ASN A 119 7.166 12.718 11.456 1.00 31.04 H new ATOM 0 HB2 ASN A 119 8.102 11.738 8.717 1.00 75.05 H new ATOM 0 HB3 ASN A 119 6.567 12.522 9.034 1.00 75.05 H new ATOM 0 HD21 ASN A 119 9.324 15.013 7.905 1.00 74.15 H new ATOM 0 HD22 ASN A 119 8.914 13.406 7.297 1.00 74.15 H new ATOM 1713 N HIS A 120 7.454 9.692 11.661 1.00 3.52 N ATOM 1714 CA HIS A 120 7.007 8.316 11.740 1.00 72.23 C ATOM 1715 C HIS A 120 5.581 8.225 12.277 1.00 40.13 C ATOM 1716 O HIS A 120 4.707 7.608 11.661 1.00 72.34 O ATOM 1717 CB HIS A 120 8.003 7.510 12.602 1.00 14.44 C ATOM 1718 CG HIS A 120 8.074 7.912 14.064 1.00 51.44 C ATOM 1719 ND1 HIS A 120 7.565 7.193 15.124 1.00 22.43 N ATOM 1720 CD2 HIS A 120 8.630 9.056 14.573 1.00 60.21 C ATOM 1721 CE1 HIS A 120 7.819 7.885 16.246 1.00 23.01 C ATOM 1722 NE2 HIS A 120 8.436 9.050 15.961 1.00 35.40 N ATOM 0 H HIS A 120 8.337 9.831 12.152 1.00 3.52 H new ATOM 0 HA HIS A 120 6.984 7.885 10.739 1.00 72.23 H new ATOM 0 HB2 HIS A 120 7.735 6.455 12.546 1.00 14.44 H new ATOM 0 HB3 HIS A 120 8.997 7.610 12.167 1.00 14.44 H new ATOM 0 HD2 HIS A 120 9.130 9.827 14.005 1.00 60.21 H new ATOM 0 HE1 HIS A 120 7.564 7.554 17.242 1.00 23.01 H new ATOM 0 HE2 HIS A 120 8.706 9.779 16.621 1.00 35.40 H new ATOM 1729 N LYS A 121 5.352 8.859 13.426 1.00 40.34 N ATOM 1730 CA LYS A 121 4.118 8.757 14.182 1.00 20.40 C ATOM 1731 C LYS A 121 3.009 9.513 13.462 1.00 71.03 C ATOM 1732 O LYS A 121 1.890 9.006 13.359 1.00 51.14 O ATOM 1733 CB LYS A 121 4.356 9.314 15.598 1.00 11.20 C ATOM 1734 CG LYS A 121 3.912 8.306 16.663 1.00 14.31 C ATOM 1735 CD LYS A 121 3.779 8.957 18.044 1.00 23.44 C ATOM 1736 CE LYS A 121 2.369 8.754 18.599 1.00 22.14 C ATOM 1737 NZ LYS A 121 2.202 9.416 19.902 1.00 15.30 N ATOM 0 H LYS A 121 6.041 9.472 13.863 1.00 40.34 H new ATOM 0 HA LYS A 121 3.807 7.716 14.265 1.00 20.40 H new ATOM 0 HB2 LYS A 121 5.413 9.546 15.729 1.00 11.20 H new ATOM 0 HB3 LYS A 121 3.807 10.247 15.723 1.00 11.20 H new ATOM 0 HG2 LYS A 121 2.956 7.869 16.374 1.00 14.31 H new ATOM 0 HG3 LYS A 121 4.633 7.490 16.714 1.00 14.31 H new ATOM 0 HD2 LYS A 121 4.511 8.526 18.728 1.00 23.44 H new ATOM 0 HD3 LYS A 121 3.998 10.022 17.973 1.00 23.44 H new ATOM 0 HE2 LYS A 121 1.639 9.149 17.893 1.00 22.14 H new ATOM 0 HE3 LYS A 121 2.168 7.688 18.703 1.00 22.14 H new ATOM 0 HZ1 LYS A 121 1.235 9.259 20.250 1.00 15.30 H new ATOM 0 HZ2 LYS A 121 2.883 9.021 20.582 1.00 15.30 H new ATOM 0 HZ3 LYS A 121 2.370 10.437 19.797 1.00 15.30 H new ATOM 1747 N ALA A 122 3.343 10.694 12.931 1.00 2.52 N ATOM 1748 CA ALA A 122 2.428 11.536 12.172 1.00 64.11 C ATOM 1749 C ALA A 122 1.880 10.701 11.027 1.00 64.13 C ATOM 1750 O ALA A 122 0.671 10.672 10.781 1.00 61.15 O ATOM 1751 CB ALA A 122 3.145 12.807 11.651 1.00 40.11 C ATOM 0 H ALA A 122 4.277 11.094 13.022 1.00 2.52 H new ATOM 0 HA ALA A 122 1.612 11.879 12.808 1.00 64.11 H new ATOM 0 HB1 ALA A 122 2.439 13.418 11.088 1.00 40.11 H new ATOM 0 HB2 ALA A 122 3.528 13.380 12.495 1.00 40.11 H new ATOM 0 HB3 ALA A 122 3.972 12.518 11.003 1.00 40.11 H new ATOM 1757 N TYR A 123 2.780 10.023 10.319 1.00 24.34 N ATOM 1758 CA TYR A 123 2.464 9.293 9.117 1.00 1.34 C ATOM 1759 C TYR A 123 1.425 8.206 9.350 1.00 13.41 C ATOM 1760 O TYR A 123 0.463 8.112 8.594 1.00 53.31 O ATOM 1761 CB TYR A 123 3.752 8.714 8.546 1.00 71.41 C ATOM 1762 CG TYR A 123 3.697 8.854 7.061 1.00 15.13 C ATOM 1763 CD1 TYR A 123 2.793 8.060 6.344 1.00 11.13 C ATOM 1764 CD2 TYR A 123 4.370 9.916 6.438 1.00 60.05 C ATOM 1765 CE1 TYR A 123 2.645 8.270 4.973 1.00 15.52 C ATOM 1766 CE2 TYR A 123 4.296 10.053 5.046 1.00 53.22 C ATOM 1767 CZ TYR A 123 3.526 9.136 4.298 1.00 23.02 C ATOM 1768 OH TYR A 123 3.626 9.055 2.945 1.00 75.13 O ATOM 0 H TYR A 123 3.765 9.971 10.579 1.00 24.34 H new ATOM 0 HA TYR A 123 2.017 9.982 8.400 1.00 1.34 H new ATOM 0 HB2 TYR A 123 4.618 9.240 8.947 1.00 71.41 H new ATOM 0 HB3 TYR A 123 3.857 7.666 8.827 1.00 71.41 H new ATOM 0 HD1 TYR A 123 2.218 7.296 6.846 1.00 11.13 H new ATOM 0 HD2 TYR A 123 4.939 10.621 7.026 1.00 60.05 H new ATOM 0 HE1 TYR A 123 1.856 7.769 4.431 1.00 15.52 H new ATOM 0 HE2 TYR A 123 4.824 10.854 4.549 1.00 53.22 H new ATOM 0 HH TYR A 123 4.525 9.330 2.666 1.00 75.13 H new ATOM 1777 N VAL A 124 1.606 7.395 10.389 1.00 55.23 N ATOM 1778 CA VAL A 124 0.693 6.319 10.759 1.00 11.23 C ATOM 1779 C VAL A 124 -0.718 6.890 10.937 1.00 53.21 C ATOM 1780 O VAL A 124 -1.663 6.298 10.413 1.00 14.52 O ATOM 1781 CB VAL A 124 1.256 5.663 12.034 1.00 44.44 C ATOM 1782 CG1 VAL A 124 0.308 4.654 12.688 1.00 11.50 C ATOM 1783 CG2 VAL A 124 2.608 5.011 11.688 1.00 51.21 C ATOM 0 H VAL A 124 2.411 7.470 11.011 1.00 55.23 H new ATOM 0 HA VAL A 124 0.614 5.554 9.987 1.00 11.23 H new ATOM 0 HB VAL A 124 1.384 6.447 12.781 1.00 44.44 H new ATOM 0 HG11 VAL A 124 0.778 4.237 13.579 1.00 11.50 H new ATOM 0 HG12 VAL A 124 -0.619 5.154 12.967 1.00 11.50 H new ATOM 0 HG13 VAL A 124 0.089 3.851 11.984 1.00 11.50 H new ATOM 0 HG21 VAL A 124 3.024 4.540 12.579 1.00 51.21 H new ATOM 0 HG22 VAL A 124 2.461 4.257 10.914 1.00 51.21 H new ATOM 0 HG23 VAL A 124 3.297 5.773 11.325 1.00 51.21 H new ATOM 1793 N SER A 125 -0.871 8.037 11.613 1.00 1.20 N ATOM 1794 CA SER A 125 -2.201 8.620 11.768 1.00 0.12 C ATOM 1795 C SER A 125 -2.763 9.090 10.420 1.00 72.22 C ATOM 1796 O SER A 125 -3.899 8.763 10.088 1.00 60.35 O ATOM 1797 CB SER A 125 -2.168 9.767 12.786 1.00 62.31 C ATOM 1798 OG SER A 125 -2.597 9.311 14.051 1.00 15.14 O ATOM 0 H SER A 125 -0.113 8.563 12.048 1.00 1.20 H new ATOM 0 HA SER A 125 -2.869 7.847 12.147 1.00 0.12 H new ATOM 0 HB2 SER A 125 -1.157 10.168 12.860 1.00 62.31 H new ATOM 0 HB3 SER A 125 -2.810 10.581 12.448 1.00 62.31 H new ATOM 0 HG SER A 125 -2.570 10.052 14.692 1.00 15.14 H new ATOM 1803 N HIS A 126 -1.993 9.848 9.633 1.00 74.25 N ATOM 1804 CA HIS A 126 -2.509 10.432 8.391 1.00 54.54 C ATOM 1805 C HIS A 126 -2.821 9.353 7.359 1.00 41.25 C ATOM 1806 O HIS A 126 -3.793 9.482 6.625 1.00 44.22 O ATOM 1807 CB HIS A 126 -1.516 11.433 7.800 1.00 75.13 C ATOM 1808 CG HIS A 126 -1.520 12.779 8.466 1.00 11.54 C ATOM 1809 ND1 HIS A 126 -1.488 13.035 9.811 1.00 4.10 N flip ATOM 1810 CD2 HIS A 126 -1.451 13.980 7.796 1.00 20.11 C flip ATOM 1811 CE1 HIS A 126 -1.367 14.415 9.956 1.00 22.00 C flip ATOM 1812 NE2 HIS A 126 -1.370 14.948 8.722 1.00 12.32 N flip ATOM 0 H HIS A 126 -1.018 10.070 9.832 1.00 74.25 H new ATOM 0 HA HIS A 126 -3.432 10.954 8.641 1.00 54.54 H new ATOM 0 HB2 HIS A 126 -0.513 11.012 7.865 1.00 75.13 H new ATOM 0 HB3 HIS A 126 -1.738 11.565 6.741 1.00 75.13 H new ATOM 0 HD2 HIS A 126 -1.460 14.117 6.725 1.00 20.11 H new ATOM 0 HE1 HIS A 126 -1.286 14.956 10.887 1.00 22.00 H new ATOM 0 HE2 HIS A 126 -1.318 15.946 8.518 1.00 12.32 H new ATOM 1819 N PHE A 127 -2.017 8.291 7.278 1.00 51.32 N ATOM 1820 CA PHE A 127 -2.328 7.191 6.383 1.00 11.22 C ATOM 1821 C PHE A 127 -3.665 6.562 6.772 1.00 75.21 C ATOM 1822 O PHE A 127 -4.436 6.258 5.875 1.00 20.42 O ATOM 1823 CB PHE A 127 -1.201 6.152 6.352 1.00 1.40 C ATOM 1824 CG PHE A 127 -1.597 4.892 5.601 1.00 15.40 C ATOM 1825 CD1 PHE A 127 -1.838 4.924 4.210 1.00 64.14 C ATOM 1826 CD2 PHE A 127 -1.854 3.709 6.321 1.00 20.40 C ATOM 1827 CE1 PHE A 127 -2.299 3.777 3.546 1.00 64.22 C ATOM 1828 CE2 PHE A 127 -2.330 2.567 5.656 1.00 21.24 C ATOM 1829 CZ PHE A 127 -2.538 2.597 4.265 1.00 62.11 C ATOM 0 H PHE A 127 -1.158 8.176 7.816 1.00 51.32 H new ATOM 0 HA PHE A 127 -2.416 7.586 5.371 1.00 11.22 H new ATOM 0 HB2 PHE A 127 -0.320 6.590 5.883 1.00 1.40 H new ATOM 0 HB3 PHE A 127 -0.923 5.891 7.373 1.00 1.40 H new ATOM 0 HD1 PHE A 127 -1.667 5.835 3.655 1.00 64.14 H new ATOM 0 HD2 PHE A 127 -1.685 3.680 7.387 1.00 20.40 H new ATOM 0 HE1 PHE A 127 -2.470 3.803 2.480 1.00 64.22 H new ATOM 0 HE2 PHE A 127 -2.536 1.665 6.213 1.00 21.24 H new ATOM 0 HZ PHE A 127 -2.882 1.711 3.751 1.00 62.11 H new ATOM 1838 N ASN A 128 -3.956 6.393 8.069 1.00 54.45 N ATOM 1839 CA ASN A 128 -5.250 5.857 8.485 1.00 34.44 C ATOM 1840 C ASN A 128 -6.366 6.815 8.111 1.00 53.32 C ATOM 1841 O ASN A 128 -7.342 6.367 7.526 1.00 2.11 O ATOM 1842 CB ASN A 128 -5.309 5.531 9.979 1.00 35.40 C ATOM 1843 CG ASN A 128 -4.717 4.158 10.239 1.00 3.12 C ATOM 1844 OD1 ASN A 128 -5.406 3.147 10.154 1.00 20.22 O ATOM 1845 ND2 ASN A 128 -3.430 4.107 10.546 1.00 51.44 N ATOM 0 H ASN A 128 -3.321 6.617 8.835 1.00 54.45 H new ATOM 0 HA ASN A 128 -5.384 4.916 7.951 1.00 34.44 H new ATOM 0 HB2 ASN A 128 -4.761 6.284 10.545 1.00 35.40 H new ATOM 0 HB3 ASN A 128 -6.342 5.561 10.325 1.00 35.40 H new ATOM 0 HD21 ASN A 128 -2.983 3.207 10.720 1.00 51.44 H new ATOM 0 HD22 ASN A 128 -2.886 4.968 10.608 1.00 51.44 H new ATOM 1851 N GLU A 129 -6.231 8.116 8.376 1.00 51.25 N ATOM 1852 CA GLU A 129 -7.220 9.121 7.967 1.00 15.24 C ATOM 1853 C GLU A 129 -7.589 8.968 6.487 1.00 14.50 C ATOM 1854 O GLU A 129 -8.765 9.042 6.119 1.00 63.04 O ATOM 1855 CB GLU A 129 -6.660 10.532 8.237 1.00 71.11 C ATOM 1856 CG GLU A 129 -7.184 11.137 9.542 1.00 41.51 C ATOM 1857 CD GLU A 129 -8.637 11.594 9.413 1.00 62.01 C ATOM 1858 OE1 GLU A 129 -9.548 10.743 9.501 1.00 20.41 O ATOM 1859 OE2 GLU A 129 -8.881 12.816 9.281 1.00 13.20 O ATOM 0 H GLU A 129 -5.434 8.505 8.880 1.00 51.25 H new ATOM 0 HA GLU A 129 -8.128 8.972 8.551 1.00 15.24 H new ATOM 0 HB2 GLU A 129 -5.572 10.485 8.275 1.00 71.11 H new ATOM 0 HB3 GLU A 129 -6.922 11.187 7.407 1.00 71.11 H new ATOM 0 HG2 GLU A 129 -7.104 10.401 10.342 1.00 41.51 H new ATOM 0 HG3 GLU A 129 -6.560 11.985 9.826 1.00 41.51 H new ATOM 1864 N TRP A 130 -6.587 8.676 5.657 1.00 24.02 N ATOM 1865 CA TRP A 130 -6.717 8.440 4.232 1.00 64.44 C ATOM 1866 C TRP A 130 -6.691 6.944 3.902 1.00 43.44 C ATOM 1867 O TRP A 130 -6.153 6.590 2.857 1.00 22.04 O ATOM 1868 CB TRP A 130 -5.610 9.219 3.501 1.00 74.05 C ATOM 1869 CG TRP A 130 -5.529 10.674 3.847 1.00 14.44 C ATOM 1870 CD1 TRP A 130 -4.442 11.301 4.344 1.00 75.35 C ATOM 1871 CD2 TRP A 130 -6.602 11.662 3.868 1.00 51.23 C ATOM 1872 NE1 TRP A 130 -4.752 12.604 4.660 1.00 15.12 N ATOM 1873 CE2 TRP A 130 -6.083 12.869 4.423 1.00 40.25 C ATOM 1874 CE3 TRP A 130 -7.974 11.642 3.541 1.00 11.54 C ATOM 1875 CZ2 TRP A 130 -6.890 13.986 4.661 1.00 61.01 C ATOM 1876 CZ3 TRP A 130 -8.793 12.763 3.767 1.00 71.41 C ATOM 1877 CH2 TRP A 130 -8.254 13.931 4.332 1.00 73.42 C ATOM 0 H TRP A 130 -5.623 8.596 5.981 1.00 24.02 H new ATOM 0 HA TRP A 130 -7.687 8.801 3.889 1.00 64.44 H new ATOM 0 HB2 TRP A 130 -4.650 8.753 3.724 1.00 74.05 H new ATOM 0 HB3 TRP A 130 -5.768 9.124 2.427 1.00 74.05 H new ATOM 0 HD1 TRP A 130 -3.471 10.847 4.475 1.00 75.35 H new ATOM 0 HE1 TRP A 130 -4.084 13.284 5.022 1.00 15.12 H new ATOM 0 HE3 TRP A 130 -8.403 10.750 3.109 1.00 11.54 H new ATOM 0 HZ2 TRP A 130 -6.469 14.882 5.093 1.00 61.01 H new ATOM 0 HZ3 TRP A 130 -9.840 12.726 3.505 1.00 71.41 H new ATOM 0 HH2 TRP A 130 -8.888 14.786 4.513 1.00 73.42 H new ATOM 1887 N ALA A 131 -7.209 6.049 4.753 1.00 64.05 N ATOM 1888 CA ALA A 131 -7.341 4.619 4.454 1.00 62.21 C ATOM 1889 C ALA A 131 -8.310 3.859 5.372 1.00 12.51 C ATOM 1890 O ALA A 131 -8.368 2.631 5.274 1.00 13.51 O ATOM 1891 CB ALA A 131 -5.978 3.917 4.506 1.00 24.04 C ATOM 0 H ALA A 131 -7.552 6.302 5.680 1.00 64.05 H new ATOM 0 HA ALA A 131 -7.760 4.592 3.448 1.00 62.21 H new ATOM 0 HB1 ALA A 131 -6.105 2.858 4.281 1.00 24.04 H new ATOM 0 HB2 ALA A 131 -5.309 4.366 3.772 1.00 24.04 H new ATOM 0 HB3 ALA A 131 -5.550 4.027 5.502 1.00 24.04 H new ATOM 1897 N ASP A 132 -9.046 4.519 6.270 1.00 11.34 N ATOM 1898 CA ASP A 132 -9.791 3.899 7.380 1.00 51.44 C ATOM 1899 C ASP A 132 -11.065 3.149 6.961 1.00 52.31 C ATOM 1900 O ASP A 132 -12.035 3.042 7.711 1.00 53.24 O ATOM 1901 CB ASP A 132 -10.107 4.946 8.464 1.00 72.25 C ATOM 1902 CG ASP A 132 -10.509 4.288 9.785 1.00 60.25 C ATOM 1903 OD1 ASP A 132 -9.794 3.354 10.228 1.00 51.44 O ATOM 1904 OD2 ASP A 132 -11.516 4.742 10.380 1.00 21.12 O ATOM 0 H ASP A 132 -9.146 5.534 6.248 1.00 11.34 H new ATOM 0 HA ASP A 132 -9.129 3.132 7.783 1.00 51.44 H new ATOM 0 HB2 ASP A 132 -9.234 5.580 8.624 1.00 72.25 H new ATOM 0 HB3 ASP A 132 -10.913 5.594 8.120 1.00 72.25 H new ATOM 1908 N GLY A 133 -11.075 2.611 5.747 1.00 32.00 N ATOM 1909 CA GLY A 133 -12.146 1.797 5.196 1.00 64.32 C ATOM 1910 C GLY A 133 -11.793 0.313 5.095 1.00 1.24 C ATOM 1911 O GLY A 133 -12.693 -0.473 4.807 1.00 55.11 O ATOM 0 H GLY A 133 -10.302 2.737 5.093 1.00 32.00 H new ATOM 0 HA2 GLY A 133 -13.034 1.910 5.818 1.00 64.32 H new ATOM 0 HA3 GLY A 133 -12.402 2.170 4.204 1.00 64.32 H new ATOM 1915 N LEU A 134 -10.524 -0.084 5.284 1.00 4.23 N ATOM 1916 CA LEU A 134 -10.067 -1.463 5.095 1.00 1.13 C ATOM 1917 C LEU A 134 -9.188 -1.897 6.259 1.00 71.45 C ATOM 1918 O LEU A 134 -8.606 -1.065 6.966 1.00 44.45 O ATOM 1919 CB LEU A 134 -9.235 -1.664 3.819 1.00 74.02 C ATOM 1920 CG LEU A 134 -9.820 -1.248 2.468 1.00 1.20 C ATOM 1921 CD1 LEU A 134 -11.149 -1.916 2.113 1.00 20.24 C ATOM 1922 CD2 LEU A 134 -9.848 0.278 2.300 1.00 64.02 C ATOM 0 H LEU A 134 -9.782 0.553 5.575 1.00 4.23 H new ATOM 0 HA LEU A 134 -10.979 -2.056 5.023 1.00 1.13 H new ATOM 0 HB2 LEU A 134 -8.298 -1.122 3.951 1.00 74.02 H new ATOM 0 HB3 LEU A 134 -8.985 -2.723 3.755 1.00 74.02 H new ATOM 0 HG LEU A 134 -9.126 -1.640 1.724 1.00 1.20 H new ATOM 0 HD11 LEU A 134 -11.486 -1.560 1.139 1.00 20.24 H new ATOM 0 HD12 LEU A 134 -11.015 -2.997 2.078 1.00 20.24 H new ATOM 0 HD13 LEU A 134 -11.894 -1.667 2.868 1.00 20.24 H new ATOM 0 HD21 LEU A 134 -10.271 0.529 1.327 1.00 64.02 H new ATOM 0 HD22 LEU A 134 -10.460 0.719 3.087 1.00 64.02 H new ATOM 0 HD23 LEU A 134 -8.833 0.670 2.367 1.00 64.02 H new ATOM 1933 N ASN A 135 -9.029 -3.208 6.388 1.00 34.00 N ATOM 1934 CA ASN A 135 -8.311 -3.871 7.450 1.00 60.13 C ATOM 1935 C ASN A 135 -6.802 -3.820 7.221 1.00 35.20 C ATOM 1936 O ASN A 135 -6.229 -4.646 6.508 1.00 51.23 O ATOM 1937 CB ASN A 135 -8.790 -5.312 7.577 1.00 14.11 C ATOM 1938 CG ASN A 135 -7.978 -5.989 8.661 1.00 55.24 C ATOM 1939 OD1 ASN A 135 -8.069 -5.632 9.830 1.00 4.44 O ATOM 1940 ND2 ASN A 135 -7.116 -6.914 8.299 1.00 71.35 N ATOM 0 H ASN A 135 -9.422 -3.866 5.714 1.00 34.00 H new ATOM 0 HA ASN A 135 -8.516 -3.345 8.382 1.00 60.13 H new ATOM 0 HB2 ASN A 135 -9.851 -5.339 7.825 1.00 14.11 H new ATOM 0 HB3 ASN A 135 -8.670 -5.837 6.629 1.00 14.11 H new ATOM 0 HD21 ASN A 135 -6.510 -7.347 8.996 1.00 71.35 H new ATOM 0 HD22 ASN A 135 -7.054 -7.199 7.322 1.00 71.35 H new ATOM 1946 N VAL A 136 -6.147 -2.853 7.849 1.00 53.34 N ATOM 1947 CA VAL A 136 -4.700 -2.823 7.975 1.00 72.03 C ATOM 1948 C VAL A 136 -4.268 -3.822 9.065 1.00 22.30 C ATOM 1949 O VAL A 136 -4.945 -3.932 10.090 1.00 33.33 O ATOM 1950 CB VAL A 136 -4.280 -1.361 8.235 1.00 60.41 C ATOM 1951 CG1 VAL A 136 -4.786 -0.847 9.582 1.00 44.22 C ATOM 1952 CG2 VAL A 136 -2.771 -1.120 8.134 1.00 55.54 C ATOM 0 H VAL A 136 -6.613 -2.059 8.289 1.00 53.34 H new ATOM 0 HA VAL A 136 -4.190 -3.143 7.067 1.00 72.03 H new ATOM 0 HB VAL A 136 -4.754 -0.798 7.431 1.00 60.41 H new ATOM 0 HG11 VAL A 136 -4.466 0.186 9.721 1.00 44.22 H new ATOM 0 HG12 VAL A 136 -5.875 -0.896 9.604 1.00 44.22 H new ATOM 0 HG13 VAL A 136 -4.379 -1.464 10.383 1.00 44.22 H new ATOM 0 HG21 VAL A 136 -2.556 -0.069 8.330 1.00 55.54 H new ATOM 0 HG22 VAL A 136 -2.254 -1.739 8.867 1.00 55.54 H new ATOM 0 HG23 VAL A 136 -2.427 -1.380 7.133 1.00 55.54 H new ATOM 1962 N ILE A 137 -3.138 -4.512 8.884 1.00 41.55 N ATOM 1963 CA ILE A 137 -2.449 -5.284 9.916 1.00 44.22 C ATOM 1964 C ILE A 137 -1.299 -4.476 10.524 1.00 35.44 C ATOM 1965 O ILE A 137 -0.957 -4.689 11.688 1.00 63.01 O ATOM 1966 CB ILE A 137 -1.948 -6.639 9.361 1.00 71.05 C ATOM 1967 CG1 ILE A 137 -0.953 -6.481 8.186 1.00 74.11 C ATOM 1968 CG2 ILE A 137 -3.164 -7.474 8.950 1.00 13.23 C ATOM 1969 CD1 ILE A 137 -0.367 -7.780 7.631 1.00 34.10 C ATOM 0 H ILE A 137 -2.663 -4.548 7.982 1.00 41.55 H new ATOM 0 HA ILE A 137 -3.165 -5.498 10.709 1.00 44.22 H new ATOM 0 HB ILE A 137 -1.390 -7.147 10.147 1.00 71.05 H new ATOM 0 HG12 ILE A 137 -1.458 -5.957 7.375 1.00 74.11 H new ATOM 0 HG13 ILE A 137 -0.131 -5.845 8.514 1.00 74.11 H new ATOM 0 HG21 ILE A 137 -2.830 -8.434 8.556 1.00 13.23 H new ATOM 0 HG22 ILE A 137 -3.801 -7.640 9.818 1.00 13.23 H new ATOM 0 HG23 ILE A 137 -3.727 -6.943 8.183 1.00 13.23 H new ATOM 0 HD11 ILE A 137 0.316 -7.551 6.813 1.00 34.10 H new ATOM 0 HD12 ILE A 137 0.175 -8.301 8.420 1.00 34.10 H new ATOM 0 HD13 ILE A 137 -1.173 -8.415 7.264 1.00 34.10 H new ATOM 1980 N GLY A 138 -0.702 -3.541 9.779 1.00 63.13 N ATOM 1981 CA GLY A 138 0.384 -2.725 10.284 1.00 44.31 C ATOM 1982 C GLY A 138 0.836 -1.676 9.279 1.00 60.22 C ATOM 1983 O GLY A 138 0.458 -1.667 8.112 1.00 42.43 O ATOM 0 H GLY A 138 -0.963 -3.336 8.814 1.00 63.13 H new ATOM 0 HA2 GLY A 138 0.067 -2.231 11.203 1.00 44.31 H new ATOM 0 HA3 GLY A 138 1.228 -3.366 10.541 1.00 44.31 H new ATOM 1987 N VAL A 139 1.666 -0.772 9.766 1.00 73.35 N ATOM 1988 CA VAL A 139 2.329 0.318 9.088 1.00 52.43 C ATOM 1989 C VAL A 139 3.662 0.535 9.790 1.00 20.24 C ATOM 1990 O VAL A 139 3.745 0.379 11.013 1.00 11.50 O ATOM 1991 CB VAL A 139 1.369 1.529 8.957 1.00 52.43 C ATOM 1992 CG1 VAL A 139 0.539 1.777 10.208 1.00 40.53 C ATOM 1993 CG2 VAL A 139 2.098 2.845 8.654 1.00 53.24 C ATOM 0 H VAL A 139 1.917 -0.789 10.755 1.00 73.35 H new ATOM 0 HA VAL A 139 2.578 0.110 8.047 1.00 52.43 H new ATOM 0 HB VAL A 139 0.725 1.248 8.124 1.00 52.43 H new ATOM 0 HG11 VAL A 139 -0.111 2.638 10.049 1.00 40.53 H new ATOM 0 HG12 VAL A 139 -0.069 0.898 10.421 1.00 40.53 H new ATOM 0 HG13 VAL A 139 1.201 1.973 11.051 1.00 40.53 H new ATOM 0 HG21 VAL A 139 1.371 3.653 8.574 1.00 53.24 H new ATOM 0 HG22 VAL A 139 2.800 3.066 9.458 1.00 53.24 H new ATOM 0 HG23 VAL A 139 2.642 2.752 7.714 1.00 53.24 H new ATOM 2003 N ALA A 140 4.718 0.797 9.018 1.00 53.31 N ATOM 2004 CA ALA A 140 6.071 0.962 9.533 1.00 51.55 C ATOM 2005 C ALA A 140 6.874 1.898 8.638 1.00 23.20 C ATOM 2006 O ALA A 140 6.320 2.548 7.748 1.00 15.40 O ATOM 2007 CB ALA A 140 6.764 -0.402 9.696 1.00 71.03 C ATOM 0 H ALA A 140 4.653 0.901 8.005 1.00 53.31 H new ATOM 0 HA ALA A 140 6.013 1.418 10.521 1.00 51.55 H new ATOM 0 HB1 ALA A 140 7.773 -0.254 10.082 1.00 71.03 H new ATOM 0 HB2 ALA A 140 6.196 -1.018 10.393 1.00 71.03 H new ATOM 0 HB3 ALA A 140 6.815 -0.902 8.729 1.00 71.03 H new ATOM 2013 N ARG A 141 8.184 1.957 8.873 1.00 2.14 N ATOM 2014 CA ARG A 141 9.152 2.401 7.889 1.00 41.25 C ATOM 2015 C ARG A 141 10.139 1.271 7.648 1.00 44.43 C ATOM 2016 O ARG A 141 10.341 0.437 8.537 1.00 13.22 O ATOM 2017 CB ARG A 141 9.851 3.700 8.311 1.00 44.23 C ATOM 2018 CG ARG A 141 10.873 3.615 9.460 1.00 74.12 C ATOM 2019 CD ARG A 141 10.251 3.471 10.860 1.00 53.24 C ATOM 2020 NE ARG A 141 11.195 3.861 11.928 1.00 53.22 N ATOM 2021 CZ ARG A 141 11.853 3.091 12.808 1.00 15.30 C ATOM 2022 NH1 ARG A 141 11.690 1.774 12.838 1.00 1.32 N ATOM 2023 NH2 ARG A 141 12.693 3.647 13.673 1.00 3.51 N ATOM 0 H ARG A 141 8.601 1.693 9.765 1.00 2.14 H new ATOM 0 HA ARG A 141 8.639 2.639 6.957 1.00 41.25 H new ATOM 0 HB2 ARG A 141 10.360 4.108 7.437 1.00 44.23 H new ATOM 0 HB3 ARG A 141 9.083 4.418 8.596 1.00 44.23 H new ATOM 0 HG2 ARG A 141 11.532 2.766 9.280 1.00 74.12 H new ATOM 0 HG3 ARG A 141 11.495 4.510 9.443 1.00 74.12 H new ATOM 0 HD2 ARG A 141 9.356 4.089 10.924 1.00 53.24 H new ATOM 0 HD3 ARG A 141 9.937 2.438 11.013 1.00 53.24 H new ATOM 0 HE ARG A 141 11.372 4.862 12.008 1.00 53.22 H new ATOM 0 HH11 ARG A 141 11.052 1.324 12.182 1.00 1.32 H new ATOM 0 HH12 ARG A 141 12.203 1.212 13.517 1.00 1.32 H new ATOM 0 HH21 ARG A 141 12.837 4.657 13.667 1.00 3.51 H new ATOM 0 HH22 ARG A 141 13.195 3.064 14.343 1.00 3.51 H new ATOM 2034 N ASP A 142 10.775 1.324 6.487 1.00 64.13 N ATOM 2035 CA ASP A 142 11.651 0.311 5.912 1.00 43.52 C ATOM 2036 C ASP A 142 11.005 -1.087 5.916 1.00 43.11 C ATOM 2037 O ASP A 142 9.841 -1.277 6.266 1.00 3.31 O ATOM 2038 CB ASP A 142 13.025 0.337 6.623 1.00 1.32 C ATOM 2039 CG ASP A 142 13.737 1.688 6.549 1.00 60.44 C ATOM 2040 OD1 ASP A 142 13.534 2.555 7.435 1.00 72.05 O ATOM 2041 OD2 ASP A 142 14.502 1.921 5.585 1.00 71.43 O ATOM 0 H ASP A 142 10.686 2.136 5.876 1.00 64.13 H new ATOM 0 HA ASP A 142 11.814 0.551 4.861 1.00 43.52 H new ATOM 0 HB2 ASP A 142 12.886 0.068 7.670 1.00 1.32 H new ATOM 0 HB3 ASP A 142 13.666 -0.425 6.180 1.00 1.32 H new ATOM 2045 N ASP A 143 11.770 -2.075 5.464 1.00 32.30 N ATOM 2046 CA ASP A 143 11.424 -3.486 5.266 1.00 1.23 C ATOM 2047 C ASP A 143 11.380 -4.308 6.566 1.00 53.21 C ATOM 2048 O ASP A 143 11.259 -5.532 6.524 1.00 22.22 O ATOM 2049 CB ASP A 143 12.422 -4.091 4.259 1.00 73.11 C ATOM 2050 CG ASP A 143 13.876 -3.807 4.627 1.00 60.24 C ATOM 2051 OD1 ASP A 143 14.423 -2.767 4.200 1.00 0.23 O ATOM 2052 OD2 ASP A 143 14.509 -4.601 5.351 1.00 15.40 O ATOM 0 H ASP A 143 12.739 -1.896 5.201 1.00 32.30 H new ATOM 0 HA ASP A 143 10.407 -3.528 4.877 1.00 1.23 H new ATOM 0 HB2 ASP A 143 12.269 -5.169 4.205 1.00 73.11 H new ATOM 0 HB3 ASP A 143 12.218 -3.690 3.266 1.00 73.11 H new ATOM 2056 N SER A 144 11.457 -3.680 7.740 1.00 61.25 N ATOM 2057 CA SER A 144 11.677 -4.397 8.993 1.00 61.32 C ATOM 2058 C SER A 144 10.473 -5.206 9.512 1.00 32.00 C ATOM 2059 O SER A 144 10.640 -5.960 10.474 1.00 74.43 O ATOM 2060 CB SER A 144 12.171 -3.403 10.050 1.00 61.34 C ATOM 2061 OG SER A 144 13.393 -3.851 10.599 1.00 22.31 O ATOM 0 H SER A 144 11.369 -2.669 7.847 1.00 61.25 H new ATOM 0 HA SER A 144 12.431 -5.156 8.785 1.00 61.32 H new ATOM 0 HB2 SER A 144 12.303 -2.418 9.602 1.00 61.34 H new ATOM 0 HB3 SER A 144 11.426 -3.297 10.838 1.00 61.34 H new ATOM 0 HG SER A 144 13.704 -3.210 11.272 1.00 22.31 H new ATOM 2066 N GLU A 145 9.280 -5.075 8.915 1.00 40.44 N ATOM 2067 CA GLU A 145 8.070 -5.783 9.352 1.00 75.05 C ATOM 2068 C GLU A 145 7.535 -6.747 8.282 1.00 23.41 C ATOM 2069 O GLU A 145 6.467 -7.318 8.483 1.00 22.23 O ATOM 2070 CB GLU A 145 6.989 -4.809 9.882 1.00 12.41 C ATOM 2071 CG GLU A 145 7.425 -4.144 11.197 1.00 53.25 C ATOM 2072 CD GLU A 145 6.375 -3.247 11.865 1.00 23.33 C ATOM 2073 OE1 GLU A 145 5.163 -3.561 11.882 1.00 43.53 O ATOM 2074 OE2 GLU A 145 6.793 -2.251 12.509 1.00 52.12 O ATOM 0 H GLU A 145 9.127 -4.469 8.109 1.00 40.44 H new ATOM 0 HA GLU A 145 8.358 -6.409 10.196 1.00 75.05 H new ATOM 0 HB2 GLU A 145 6.791 -4.042 9.134 1.00 12.41 H new ATOM 0 HB3 GLU A 145 6.056 -5.350 10.039 1.00 12.41 H new ATOM 0 HG2 GLU A 145 7.711 -4.925 11.901 1.00 53.25 H new ATOM 0 HG3 GLU A 145 8.317 -3.548 11.004 1.00 53.25 H new ATOM 2079 N VAL A 146 8.251 -7.001 7.178 1.00 24.02 N ATOM 2080 CA VAL A 146 7.791 -7.972 6.178 1.00 20.30 C ATOM 2081 C VAL A 146 7.613 -9.358 6.817 1.00 55.23 C ATOM 2082 O VAL A 146 6.659 -10.056 6.492 1.00 3.24 O ATOM 2083 CB VAL A 146 8.726 -8.010 4.958 1.00 24.40 C ATOM 2084 CG1 VAL A 146 8.180 -8.936 3.870 1.00 15.13 C ATOM 2085 CG2 VAL A 146 8.916 -6.613 4.347 1.00 34.20 C ATOM 0 H VAL A 146 9.140 -6.553 6.957 1.00 24.02 H new ATOM 0 HA VAL A 146 6.816 -7.651 5.811 1.00 20.30 H new ATOM 0 HB VAL A 146 9.685 -8.384 5.317 1.00 24.40 H new ATOM 0 HG11 VAL A 146 8.863 -8.942 3.021 1.00 15.13 H new ATOM 0 HG12 VAL A 146 8.085 -9.947 4.266 1.00 15.13 H new ATOM 0 HG13 VAL A 146 7.202 -8.580 3.547 1.00 15.13 H new ATOM 0 HG21 VAL A 146 9.583 -6.680 3.487 1.00 34.20 H new ATOM 0 HG22 VAL A 146 7.950 -6.221 4.028 1.00 34.20 H new ATOM 0 HG23 VAL A 146 9.350 -5.946 5.092 1.00 34.20 H new ATOM 2095 N ASP A 147 8.438 -9.699 7.810 1.00 2.34 N ATOM 2096 CA ASP A 147 8.297 -10.880 8.667 1.00 15.50 C ATOM 2097 C ASP A 147 6.879 -11.069 9.224 1.00 1.44 C ATOM 2098 O ASP A 147 6.403 -12.197 9.315 1.00 75.05 O ATOM 2099 CB ASP A 147 9.300 -10.739 9.813 1.00 60.41 C ATOM 2100 CG ASP A 147 9.017 -11.661 10.997 1.00 0.21 C ATOM 2101 OD1 ASP A 147 9.385 -12.850 10.949 1.00 74.14 O ATOM 2102 OD2 ASP A 147 8.534 -11.128 12.025 1.00 63.25 O ATOM 0 H ASP A 147 9.255 -9.138 8.049 1.00 2.34 H new ATOM 0 HA ASP A 147 8.493 -11.766 8.064 1.00 15.50 H new ATOM 0 HB2 ASP A 147 10.301 -10.946 9.435 1.00 60.41 H new ATOM 0 HB3 ASP A 147 9.298 -9.706 10.160 1.00 60.41 H new ATOM 2106 N LYS A 148 6.168 -9.988 9.572 1.00 1.44 N ATOM 2107 CA LYS A 148 4.777 -10.082 10.025 1.00 41.53 C ATOM 2108 C LYS A 148 3.778 -9.787 8.901 1.00 1.41 C ATOM 2109 O LYS A 148 2.587 -10.010 9.105 1.00 12.51 O ATOM 2110 CB LYS A 148 4.530 -9.190 11.254 1.00 21.14 C ATOM 2111 CG LYS A 148 4.740 -7.700 10.966 1.00 1.30 C ATOM 2112 CD LYS A 148 3.932 -6.745 11.847 1.00 23.42 C ATOM 2113 CE LYS A 148 4.604 -6.482 13.194 1.00 2.20 C ATOM 2114 NZ LYS A 148 4.108 -5.217 13.774 1.00 51.42 N ATOM 0 H LYS A 148 6.536 -9.037 9.548 1.00 1.44 H new ATOM 0 HA LYS A 148 4.608 -11.116 10.326 1.00 41.53 H new ATOM 0 HB2 LYS A 148 3.511 -9.345 11.610 1.00 21.14 H new ATOM 0 HB3 LYS A 148 5.199 -9.496 12.058 1.00 21.14 H new ATOM 0 HG2 LYS A 148 5.799 -7.469 11.084 1.00 1.30 H new ATOM 0 HG3 LYS A 148 4.487 -7.509 9.923 1.00 1.30 H new ATOM 0 HD2 LYS A 148 3.795 -5.800 11.322 1.00 23.42 H new ATOM 0 HD3 LYS A 148 2.939 -7.163 12.015 1.00 23.42 H new ATOM 0 HE2 LYS A 148 4.402 -7.307 13.877 1.00 2.20 H new ATOM 0 HE3 LYS A 148 5.685 -6.432 13.066 1.00 2.20 H new ATOM 0 HZ1 LYS A 148 4.585 -5.041 14.681 1.00 51.42 H new ATOM 0 HZ2 LYS A 148 4.308 -4.433 13.120 1.00 51.42 H new ATOM 0 HZ3 LYS A 148 3.082 -5.285 13.930 1.00 51.42 H new ATOM 2124 N TRP A 149 4.215 -9.264 7.759 1.00 51.22 N ATOM 2125 CA TRP A 149 3.382 -8.925 6.611 1.00 52.34 C ATOM 2126 C TRP A 149 3.519 -9.962 5.481 1.00 4.24 C ATOM 2127 O TRP A 149 3.289 -9.632 4.319 1.00 35.20 O ATOM 2128 CB TRP A 149 3.736 -7.536 6.081 1.00 52.23 C ATOM 2129 CG TRP A 149 3.663 -6.403 7.042 1.00 33.00 C ATOM 2130 CD1 TRP A 149 2.881 -6.350 8.137 1.00 35.44 C ATOM 2131 CD2 TRP A 149 4.366 -5.135 6.984 1.00 40.41 C ATOM 2132 NE1 TRP A 149 3.085 -5.154 8.776 1.00 34.33 N ATOM 2133 CE2 TRP A 149 3.935 -4.328 8.073 1.00 21.31 C ATOM 2134 CE3 TRP A 149 5.324 -4.589 6.111 1.00 54.21 C ATOM 2135 CZ2 TRP A 149 4.382 -3.010 8.247 1.00 1.23 C ATOM 2136 CZ3 TRP A 149 5.788 -3.274 6.273 1.00 22.12 C ATOM 2137 CH2 TRP A 149 5.281 -2.471 7.310 1.00 72.03 C ATOM 0 H TRP A 149 5.201 -9.056 7.602 1.00 51.22 H new ATOM 0 HA TRP A 149 2.347 -8.928 6.952 1.00 52.34 H new ATOM 0 HB2 TRP A 149 4.749 -7.575 5.681 1.00 52.23 H new ATOM 0 HB3 TRP A 149 3.072 -7.314 5.246 1.00 52.23 H new ATOM 0 HD1 TRP A 149 2.202 -7.125 8.460 1.00 35.44 H new ATOM 0 HE1 TRP A 149 2.657 -4.905 9.668 1.00 34.33 H new ATOM 0 HE3 TRP A 149 5.709 -5.192 5.302 1.00 54.21 H new ATOM 0 HZ2 TRP A 149 4.042 -2.420 9.085 1.00 1.23 H new ATOM 0 HZ3 TRP A 149 6.535 -2.879 5.601 1.00 22.12 H new ATOM 0 HH2 TRP A 149 5.583 -1.437 7.387 1.00 72.03 H new ATOM 2147 N SER A 150 3.993 -11.172 5.772 1.00 55.25 N ATOM 2148 CA SER A 150 4.077 -12.262 4.803 1.00 55.13 C ATOM 2149 C SER A 150 3.791 -13.609 5.491 1.00 71.34 C ATOM 2150 O SER A 150 4.100 -14.672 4.935 1.00 24.21 O ATOM 2151 CB SER A 150 5.448 -12.188 4.106 1.00 60.45 C ATOM 2152 OG SER A 150 5.424 -12.774 2.811 1.00 24.11 O ATOM 0 H SER A 150 4.334 -11.426 6.699 1.00 55.25 H new ATOM 0 HA SER A 150 3.315 -12.167 4.029 1.00 55.13 H new ATOM 0 HB2 SER A 150 5.757 -11.146 4.026 1.00 60.45 H new ATOM 0 HB3 SER A 150 6.193 -12.695 4.719 1.00 60.45 H new ATOM 0 HG SER A 150 4.997 -13.655 2.858 1.00 24.11 H new ATOM 2157 N LYS A 151 3.210 -13.578 6.695 1.00 31.31 N ATOM 2158 CA LYS A 151 2.710 -14.742 7.420 1.00 64.23 C ATOM 2159 C LYS A 151 1.477 -15.295 6.720 1.00 63.45 C ATOM 2160 O LYS A 151 1.146 -16.472 6.979 1.00 60.04 O ATOM 2161 CB LYS A 151 2.419 -14.400 8.886 1.00 2.11 C ATOM 2162 CG LYS A 151 3.571 -13.667 9.589 1.00 40.24 C ATOM 2163 CD LYS A 151 3.607 -13.888 11.110 1.00 63.24 C ATOM 2164 CE LYS A 151 2.305 -13.540 11.843 1.00 24.23 C ATOM 2165 NZ LYS A 151 2.180 -12.106 12.167 1.00 11.50 N ATOM 0 H LYS A 151 3.072 -12.707 7.207 1.00 31.31 H new ATOM 0 HA LYS A 151 3.481 -15.513 7.421 1.00 64.23 H new ATOM 0 HB2 LYS A 151 1.523 -13.781 8.935 1.00 2.11 H new ATOM 0 HB3 LYS A 151 2.201 -15.320 9.428 1.00 2.11 H new ATOM 0 HG2 LYS A 151 4.517 -13.999 9.160 1.00 40.24 H new ATOM 0 HG3 LYS A 151 3.487 -12.599 9.388 1.00 40.24 H new ATOM 0 HD2 LYS A 151 3.849 -14.933 11.305 1.00 63.24 H new ATOM 0 HD3 LYS A 151 4.415 -13.290 11.531 1.00 63.24 H new ATOM 0 HE2 LYS A 151 1.458 -13.841 11.226 1.00 24.23 H new ATOM 0 HE3 LYS A 151 2.250 -14.119 12.765 1.00 24.23 H new ATOM 0 HZ1 LYS A 151 1.280 -11.939 12.660 1.00 11.50 H new ATOM 0 HZ2 LYS A 151 2.969 -11.818 12.780 1.00 11.50 H new ATOM 0 HZ3 LYS A 151 2.202 -11.549 11.289 1.00 11.50 H new