USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1022 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 28 TYR OH : rot 180:sc= 0.692 USER MOD Set 1.2: A 47 SER OG : rot -141:sc= 1.76 USER MOD Set 2.1: A 19 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 20 HIS : no HD1:sc= -0.363 K(o=-0.36,f=-0.98) USER MOD Single : A 12 SER OG : rot 33:sc= 0.0392 USER MOD Single : A 21 MET CE :methyl -179:sc= -2.14 (180deg=-2.17) USER MOD Single : A 30 THR OG1 : rot -140:sc= -1.01 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.0711 X(o=-0.071,f=-6.1e-05) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.239 USER MOD Single : A 35 ASN : amide:sc= -6.65! C(o=-6.7!,f=-10!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 49:sc= 0.812 USER MOD Single : A 48 SER OG : rot -140:sc= -0.177 USER MOD Single : A 52 THR OG1 : rot -160:sc= -0.169 USER MOD Single : A 55 HIS : no HE2:sc= 0.023 K(o=0.023,f=-0.61) USER MOD Single : A 56 THR OG1 : rot 130:sc= -0.508 USER MOD Single : A 58 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.125) USER MOD Single : A 61 ASN : amide:sc= -0.475 X(o=-0.48,f=-0.12) USER MOD Single : A 63 LYS NZ :NH3+ -154:sc= -0.957 (180deg=-1.61) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 TYR OH : rot -130:sc= -1.26! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -135:sc= -0.28 (180deg=-0.759) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -1.26 X(o=-1.3,f=-0.91) USER MOD Single : A 89 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.196) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.496 X(o=-0.5,f=-0.14) USER MOD Single : A 100 MET CE :methyl 146:sc= -3.76! (180deg=-5.56!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl 145:sc= -1.38 (180deg=-4.79!) USER MOD Single : A 112 THR OG1 : rot -47:sc= 0.411 USER MOD Single : A 113 MET CE :methyl -136:sc= -1.67 (180deg=-5.29!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -1.97 K(o=-2,f=-0.68) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -170:sc= 0.972 (180deg=0.865) USER MOD Single : A 132 ASN : amide:sc= -0.696 K(o=-0.7,f=-0.011) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.738 USER MOD Single : A 139 LYS NZ :NH3+ -136:sc= 0.0357 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 2.939 -0.123 4.727 1.00 52.42 N ATOM 2 CA SER A 12 3.038 -1.327 3.911 1.00 33.31 C ATOM 3 C SER A 12 4.459 -1.515 3.389 1.00 10.21 C ATOM 4 O SER A 12 5.226 -0.558 3.287 1.00 71.43 O ATOM 5 CB SER A 12 2.057 -1.257 2.739 1.00 31.11 C ATOM 6 OG SER A 12 0.718 -1.196 3.198 1.00 54.41 O ATOM 0 HA SER A 12 2.784 -2.182 4.538 1.00 33.31 H new ATOM 0 HB2 SER A 12 2.276 -0.380 2.129 1.00 31.11 H new ATOM 0 HB3 SER A 12 2.186 -2.130 2.100 1.00 31.11 H new ATOM 0 HG SER A 12 0.686 -0.711 4.049 1.00 54.41 H new ATOM 12 N GLY A 13 4.803 -2.756 3.060 1.00 21.42 N ATOM 13 CA GLY A 13 6.131 -3.048 2.553 1.00 60.41 C ATOM 14 C GLY A 13 6.349 -4.530 2.319 1.00 64.01 C ATOM 15 O GLY A 13 6.817 -5.244 3.207 1.00 65.12 O ATOM 0 H GLY A 13 4.186 -3.565 3.135 1.00 21.42 H new ATOM 0 HA2 GLY A 13 6.286 -2.509 1.618 1.00 60.41 H new ATOM 0 HA3 GLY A 13 6.875 -2.682 3.260 1.00 60.41 H new ATOM 19 N LEU A 14 6.009 -4.995 1.122 1.00 52.30 N ATOM 20 CA LEU A 14 6.169 -6.402 0.774 1.00 73.32 C ATOM 21 C LEU A 14 6.135 -6.596 -0.739 1.00 30.43 C ATOM 22 O LEU A 14 5.862 -5.660 -1.490 1.00 3.45 O ATOM 23 CB LEU A 14 5.070 -7.239 1.431 1.00 14.34 C ATOM 24 CG LEU A 14 5.494 -8.074 2.640 1.00 62.34 C ATOM 25 CD1 LEU A 14 4.275 -8.618 3.368 1.00 53.41 C ATOM 26 CD2 LEU A 14 6.409 -9.210 2.207 1.00 25.51 C ATOM 0 H LEU A 14 5.621 -4.418 0.376 1.00 52.30 H new ATOM 0 HA LEU A 14 7.139 -6.734 1.143 1.00 73.32 H new ATOM 0 HB2 LEU A 14 4.267 -6.570 1.741 1.00 14.34 H new ATOM 0 HB3 LEU A 14 4.654 -7.910 0.679 1.00 14.34 H new ATOM 0 HG LEU A 14 6.044 -7.431 3.327 1.00 62.34 H new ATOM 0 HD11 LEU A 14 4.597 -9.209 4.225 1.00 53.41 H new ATOM 0 HD12 LEU A 14 3.656 -7.789 3.711 1.00 53.41 H new ATOM 0 HD13 LEU A 14 3.697 -9.246 2.690 1.00 53.41 H new ATOM 0 HD21 LEU A 14 6.701 -9.794 3.079 1.00 25.51 H new ATOM 0 HD22 LEU A 14 5.883 -9.852 1.500 1.00 25.51 H new ATOM 0 HD23 LEU A 14 7.299 -8.799 1.731 1.00 25.51 H new ATOM 38 N VAL A 15 6.412 -7.819 -1.180 1.00 31.54 N ATOM 39 CA VAL A 15 6.410 -8.138 -2.602 1.00 41.15 C ATOM 40 C VAL A 15 5.655 -9.434 -2.875 1.00 11.04 C ATOM 41 O VAL A 15 5.858 -10.451 -2.210 1.00 55.35 O ATOM 42 CB VAL A 15 7.844 -8.267 -3.151 1.00 33.04 C ATOM 43 CG1 VAL A 15 8.560 -9.442 -2.502 1.00 54.00 C ATOM 44 CG2 VAL A 15 7.824 -8.414 -4.665 1.00 35.15 C ATOM 0 H VAL A 15 6.641 -8.605 -0.572 1.00 31.54 H new ATOM 0 HA VAL A 15 5.907 -7.315 -3.109 1.00 41.15 H new ATOM 0 HB VAL A 15 8.392 -7.357 -2.905 1.00 33.04 H new ATOM 0 HG11 VAL A 15 9.571 -9.518 -2.902 1.00 54.00 H new ATOM 0 HG12 VAL A 15 8.607 -9.289 -1.424 1.00 54.00 H new ATOM 0 HG13 VAL A 15 8.016 -10.362 -2.715 1.00 54.00 H new ATOM 0 HG21 VAL A 15 8.845 -8.504 -5.035 1.00 35.15 H new ATOM 0 HG22 VAL A 15 7.260 -9.306 -4.937 1.00 35.15 H new ATOM 0 HG23 VAL A 15 7.353 -7.537 -5.109 1.00 35.15 H new ATOM 54 N PRO A 16 4.763 -9.400 -3.875 1.00 55.13 N ATOM 55 CA PRO A 16 3.959 -10.564 -4.260 1.00 22.34 C ATOM 56 C PRO A 16 4.798 -11.657 -4.914 1.00 11.21 C ATOM 57 O PRO A 16 4.806 -11.798 -6.137 1.00 12.41 O ATOM 58 CB PRO A 16 2.956 -9.988 -5.262 1.00 11.13 C ATOM 59 CG PRO A 16 3.630 -8.784 -5.823 1.00 64.13 C ATOM 60 CD PRO A 16 4.469 -8.222 -4.709 1.00 64.12 C ATOM 0 HA PRO A 16 3.493 -11.041 -3.397 1.00 22.34 H new ATOM 0 HB2 PRO A 16 2.719 -10.709 -6.044 1.00 11.13 H new ATOM 0 HB3 PRO A 16 2.017 -9.725 -4.775 1.00 11.13 H new ATOM 0 HG2 PRO A 16 4.247 -9.047 -6.682 1.00 64.13 H new ATOM 0 HG3 PRO A 16 2.899 -8.053 -6.168 1.00 64.13 H new ATOM 0 HD2 PRO A 16 5.381 -7.760 -5.087 1.00 64.12 H new ATOM 0 HD3 PRO A 16 3.932 -7.457 -4.148 1.00 64.12 H new ATOM 68 N ARG A 17 5.502 -12.428 -4.092 1.00 2.10 N ATOM 69 CA ARG A 17 6.345 -13.508 -4.592 1.00 11.44 C ATOM 70 C ARG A 17 6.269 -14.725 -3.675 1.00 74.33 C ATOM 71 O ARG A 17 5.734 -15.767 -4.053 1.00 52.22 O ATOM 72 CB ARG A 17 7.795 -13.037 -4.712 1.00 44.13 C ATOM 73 CG ARG A 17 7.981 -11.876 -5.676 1.00 31.11 C ATOM 74 CD ARG A 17 9.243 -12.039 -6.508 1.00 70.44 C ATOM 75 NE ARG A 17 9.190 -11.259 -7.742 1.00 1.25 N ATOM 76 CZ ARG A 17 10.260 -10.965 -8.472 1.00 1.34 C ATOM 77 NH1 ARG A 17 11.460 -11.385 -8.095 1.00 12.44 N ATOM 78 NH2 ARG A 17 10.131 -10.250 -9.582 1.00 2.51 N ATOM 0 H ARG A 17 5.506 -12.325 -3.077 1.00 2.10 H new ATOM 0 HA ARG A 17 5.980 -13.794 -5.578 1.00 11.44 H new ATOM 0 HB2 ARG A 17 8.155 -12.741 -3.727 1.00 44.13 H new ATOM 0 HB3 ARG A 17 8.414 -13.873 -5.039 1.00 44.13 H new ATOM 0 HG2 ARG A 17 7.116 -11.807 -6.335 1.00 31.11 H new ATOM 0 HG3 ARG A 17 8.031 -10.942 -5.117 1.00 31.11 H new ATOM 0 HD2 ARG A 17 10.107 -11.729 -5.920 1.00 70.44 H new ATOM 0 HD3 ARG A 17 9.384 -13.092 -6.751 1.00 70.44 H new ATOM 0 HE ARG A 17 8.282 -10.922 -8.060 1.00 1.25 H new ATOM 0 HH11 ARG A 17 11.563 -11.935 -7.242 1.00 12.44 H new ATOM 0 HH12 ARG A 17 12.280 -11.158 -8.658 1.00 12.44 H new ATOM 0 HH21 ARG A 17 9.210 -9.926 -9.875 1.00 2.51 H new ATOM 0 HH22 ARG A 17 10.953 -10.025 -10.142 1.00 2.51 H new ATOM 92 N GLY A 18 6.808 -14.586 -2.468 1.00 62.11 N ATOM 93 CA GLY A 18 6.791 -15.682 -1.517 1.00 64.21 C ATOM 94 C GLY A 18 6.233 -15.272 -0.169 1.00 1.40 C ATOM 95 O GLY A 18 5.020 -15.138 -0.006 1.00 63.23 O ATOM 0 H GLY A 18 7.256 -13.734 -2.132 1.00 62.11 H new ATOM 0 HA2 GLY A 18 6.194 -16.500 -1.920 1.00 64.21 H new ATOM 0 HA3 GLY A 18 7.804 -16.062 -1.387 1.00 64.21 H new ATOM 99 N SER A 19 7.120 -15.072 0.801 1.00 34.21 N ATOM 100 CA SER A 19 6.708 -14.680 2.144 1.00 41.11 C ATOM 101 C SER A 19 7.785 -13.833 2.816 1.00 35.34 C ATOM 102 O SER A 19 7.644 -12.617 2.944 1.00 1.43 O ATOM 103 CB SER A 19 6.413 -15.918 2.992 1.00 24.52 C ATOM 104 OG SER A 19 6.095 -15.559 4.325 1.00 33.55 O ATOM 0 H SER A 19 8.128 -15.175 0.682 1.00 34.21 H new ATOM 0 HA SER A 19 5.800 -14.083 2.060 1.00 41.11 H new ATOM 0 HB2 SER A 19 5.584 -16.473 2.554 1.00 24.52 H new ATOM 0 HB3 SER A 19 7.278 -16.581 2.987 1.00 24.52 H new ATOM 0 HG SER A 19 5.909 -16.368 4.846 1.00 33.55 H new ATOM 110 N HIS A 20 8.860 -14.486 3.245 1.00 22.30 N ATOM 111 CA HIS A 20 9.962 -13.795 3.904 1.00 1.44 C ATOM 112 C HIS A 20 11.243 -13.905 3.082 1.00 14.02 C ATOM 113 O HIS A 20 12.101 -14.741 3.363 1.00 44.53 O ATOM 114 CB HIS A 20 10.189 -14.369 5.303 1.00 61.51 C ATOM 115 CG HIS A 20 9.547 -13.566 6.392 1.00 24.30 C ATOM 116 ND1 HIS A 20 8.182 -13.489 6.565 1.00 14.22 N ATOM 117 CD2 HIS A 20 10.093 -12.804 7.369 1.00 52.15 C ATOM 118 CE1 HIS A 20 7.915 -12.712 7.600 1.00 75.11 C ATOM 119 NE2 HIS A 20 9.057 -12.284 8.105 1.00 22.05 N ATOM 0 H HIS A 20 8.991 -15.493 3.148 1.00 22.30 H new ATOM 0 HA HIS A 20 9.697 -12.741 3.991 1.00 1.44 H new ATOM 0 HB2 HIS A 20 9.801 -15.387 5.336 1.00 61.51 H new ATOM 0 HB3 HIS A 20 11.261 -14.430 5.492 1.00 61.51 H new ATOM 0 HD2 HIS A 20 11.146 -12.637 7.538 1.00 52.15 H new ATOM 0 HE1 HIS A 20 6.930 -12.469 7.970 1.00 75.11 H new ATOM 0 HE2 HIS A 20 9.154 -11.667 8.911 1.00 22.05 H new ATOM 127 N MET A 21 11.362 -13.057 2.066 1.00 45.10 N ATOM 128 CA MET A 21 12.538 -13.060 1.204 1.00 44.45 C ATOM 129 C MET A 21 12.890 -11.643 0.759 1.00 73.43 C ATOM 130 O MET A 21 14.030 -11.202 0.902 1.00 50.02 O ATOM 131 CB MET A 21 12.298 -13.946 -0.020 1.00 30.11 C ATOM 132 CG MET A 21 12.575 -15.419 0.233 1.00 31.21 C ATOM 133 SD MET A 21 11.261 -16.489 -0.383 1.00 54.20 S ATOM 134 CE MET A 21 10.242 -16.651 1.081 1.00 55.40 C ATOM 0 H MET A 21 10.659 -12.360 1.820 1.00 45.10 H new ATOM 0 HA MET A 21 13.375 -13.461 1.776 1.00 44.45 H new ATOM 0 HB2 MET A 21 11.264 -13.830 -0.346 1.00 30.11 H new ATOM 0 HB3 MET A 21 12.931 -13.601 -0.838 1.00 30.11 H new ATOM 0 HG2 MET A 21 13.516 -15.695 -0.243 1.00 31.21 H new ATOM 0 HG3 MET A 21 12.700 -15.583 1.303 1.00 31.21 H new ATOM 0 HE1 MET A 21 9.395 -17.301 0.864 1.00 55.40 H new ATOM 0 HE2 MET A 21 10.833 -17.082 1.890 1.00 55.40 H new ATOM 0 HE3 MET A 21 9.878 -15.669 1.381 1.00 55.40 H new ATOM 144 N VAL A 22 11.903 -10.936 0.218 1.00 13.44 N ATOM 145 CA VAL A 22 12.108 -9.569 -0.247 1.00 33.04 C ATOM 146 C VAL A 22 10.887 -8.702 0.040 1.00 74.25 C ATOM 147 O VAL A 22 9.764 -9.201 0.118 1.00 13.45 O ATOM 148 CB VAL A 22 12.409 -9.529 -1.756 1.00 64.25 C ATOM 149 CG1 VAL A 22 13.069 -8.212 -2.135 1.00 12.21 C ATOM 150 CG2 VAL A 22 13.285 -10.707 -2.156 1.00 23.24 C ATOM 0 H VAL A 22 10.954 -11.287 0.091 1.00 13.44 H new ATOM 0 HA VAL A 22 12.966 -9.175 0.297 1.00 33.04 H new ATOM 0 HB VAL A 22 11.466 -9.605 -2.298 1.00 64.25 H new ATOM 0 HG11 VAL A 22 13.274 -8.203 -3.205 1.00 12.21 H new ATOM 0 HG12 VAL A 22 12.403 -7.386 -1.886 1.00 12.21 H new ATOM 0 HG13 VAL A 22 14.004 -8.102 -1.586 1.00 12.21 H new ATOM 0 HG21 VAL A 22 13.488 -10.663 -3.226 1.00 23.24 H new ATOM 0 HG22 VAL A 22 14.225 -10.664 -1.606 1.00 23.24 H new ATOM 0 HG23 VAL A 22 12.770 -11.639 -1.922 1.00 23.24 H new ATOM 160 N ARG A 23 11.114 -7.402 0.194 1.00 51.14 N ATOM 161 CA ARG A 23 10.032 -6.465 0.472 1.00 41.12 C ATOM 162 C ARG A 23 10.347 -5.086 -0.099 1.00 43.53 C ATOM 163 O ARG A 23 11.506 -4.674 -0.150 1.00 5.21 O ATOM 164 CB ARG A 23 9.793 -6.362 1.979 1.00 30.13 C ATOM 165 CG ARG A 23 10.724 -5.385 2.678 1.00 23.45 C ATOM 166 CD ARG A 23 11.156 -5.905 4.041 1.00 72.21 C ATOM 167 NE ARG A 23 11.056 -4.879 5.075 1.00 11.20 N ATOM 168 CZ ARG A 23 11.288 -5.108 6.363 1.00 74.12 C ATOM 169 NH1 ARG A 23 11.631 -6.321 6.772 1.00 20.52 N ATOM 170 NH2 ARG A 23 11.176 -4.122 7.244 1.00 63.31 N ATOM 0 H ARG A 23 12.037 -6.973 0.131 1.00 51.14 H new ATOM 0 HA ARG A 23 9.128 -6.840 -0.008 1.00 41.12 H new ATOM 0 HB2 ARG A 23 8.761 -6.057 2.155 1.00 30.13 H new ATOM 0 HB3 ARG A 23 9.914 -7.349 2.426 1.00 30.13 H new ATOM 0 HG2 ARG A 23 11.604 -5.212 2.058 1.00 23.45 H new ATOM 0 HG3 ARG A 23 10.223 -4.424 2.796 1.00 23.45 H new ATOM 0 HD2 ARG A 23 10.537 -6.759 4.316 1.00 72.21 H new ATOM 0 HD3 ARG A 23 12.184 -6.263 3.983 1.00 72.21 H new ATOM 0 HE ARG A 23 10.794 -3.935 4.793 1.00 11.20 H new ATOM 0 HH11 ARG A 23 11.717 -7.081 6.097 1.00 20.52 H new ATOM 0 HH12 ARG A 23 11.809 -6.494 7.761 1.00 20.52 H new ATOM 0 HH21 ARG A 23 10.912 -3.187 6.933 1.00 63.31 H new ATOM 0 HH22 ARG A 23 11.354 -4.299 8.233 1.00 63.31 H new ATOM 184 N ARG A 24 9.308 -4.377 -0.528 1.00 41.15 N ATOM 185 CA ARG A 24 9.474 -3.045 -1.098 1.00 3.15 C ATOM 186 C ARG A 24 9.731 -2.014 -0.002 1.00 63.03 C ATOM 187 O ARG A 24 8.858 -1.211 0.325 1.00 21.24 O ATOM 188 CB ARG A 24 8.234 -2.652 -1.901 1.00 75.15 C ATOM 189 CG ARG A 24 8.338 -2.979 -3.382 1.00 64.31 C ATOM 190 CD ARG A 24 7.142 -3.786 -3.860 1.00 75.15 C ATOM 191 NE ARG A 24 5.917 -2.991 -3.878 1.00 51.43 N ATOM 192 CZ ARG A 24 4.826 -3.335 -4.554 1.00 23.53 C ATOM 193 NH1 ARG A 24 4.808 -4.456 -5.262 1.00 51.13 N ATOM 194 NH2 ARG A 24 3.751 -2.559 -4.521 1.00 32.03 N ATOM 0 H ARG A 24 8.342 -4.703 -0.492 1.00 41.15 H new ATOM 0 HA ARG A 24 10.337 -3.067 -1.764 1.00 3.15 H new ATOM 0 HB2 ARG A 24 7.365 -3.163 -1.485 1.00 75.15 H new ATOM 0 HB3 ARG A 24 8.061 -1.582 -1.785 1.00 75.15 H new ATOM 0 HG2 ARG A 24 8.407 -2.055 -3.956 1.00 64.31 H new ATOM 0 HG3 ARG A 24 9.254 -3.539 -3.568 1.00 64.31 H new ATOM 0 HD2 ARG A 24 7.340 -4.169 -4.861 1.00 75.15 H new ATOM 0 HD3 ARG A 24 7.004 -4.650 -3.209 1.00 75.15 H new ATOM 0 HE ARG A 24 5.898 -2.123 -3.342 1.00 51.43 H new ATOM 0 HH11 ARG A 24 5.633 -5.056 -5.288 1.00 51.13 H new ATOM 0 HH12 ARG A 24 3.970 -4.718 -5.780 1.00 51.13 H new ATOM 0 HH21 ARG A 24 3.761 -1.697 -3.976 1.00 32.03 H new ATOM 0 HH22 ARG A 24 2.914 -2.824 -5.040 1.00 32.03 H new ATOM 208 N ALA A 25 10.935 -2.043 0.560 1.00 62.30 N ATOM 209 CA ALA A 25 11.308 -1.111 1.617 1.00 74.02 C ATOM 210 C ALA A 25 12.100 0.066 1.057 1.00 74.31 C ATOM 211 O ALA A 25 12.176 0.253 -0.158 1.00 25.45 O ATOM 212 CB ALA A 25 12.111 -1.826 2.693 1.00 61.43 C ATOM 0 H ALA A 25 11.669 -2.702 0.301 1.00 62.30 H new ATOM 0 HA ALA A 25 10.393 -0.720 2.062 1.00 74.02 H new ATOM 0 HB1 ALA A 25 12.382 -1.117 3.476 1.00 61.43 H new ATOM 0 HB2 ALA A 25 11.511 -2.628 3.122 1.00 61.43 H new ATOM 0 HB3 ALA A 25 13.016 -2.245 2.253 1.00 61.43 H new ATOM 218 N ARG A 26 12.686 0.856 1.949 1.00 2.55 N ATOM 219 CA ARG A 26 13.471 2.016 1.544 1.00 53.42 C ATOM 220 C ARG A 26 14.959 1.682 1.512 1.00 61.33 C ATOM 221 O ARG A 26 15.444 0.883 2.314 1.00 44.33 O ATOM 222 CB ARG A 26 13.221 3.187 2.497 1.00 73.51 C ATOM 223 CG ARG A 26 13.344 4.549 1.834 1.00 24.14 C ATOM 224 CD ARG A 26 11.983 5.193 1.627 1.00 13.21 C ATOM 225 NE ARG A 26 11.504 5.862 2.834 1.00 2.10 N ATOM 226 CZ ARG A 26 10.534 6.769 2.836 1.00 74.01 C ATOM 227 NH1 ARG A 26 9.941 7.113 1.701 1.00 40.01 N ATOM 228 NH2 ARG A 26 10.154 7.333 3.975 1.00 14.41 N ATOM 0 H ARG A 26 12.632 0.714 2.958 1.00 2.55 H new ATOM 0 HA ARG A 26 13.158 2.301 0.539 1.00 53.42 H new ATOM 0 HB2 ARG A 26 12.223 3.089 2.925 1.00 73.51 H new ATOM 0 HB3 ARG A 26 13.929 3.129 3.323 1.00 73.51 H new ATOM 0 HG2 ARG A 26 13.966 5.199 2.449 1.00 24.14 H new ATOM 0 HG3 ARG A 26 13.847 4.443 0.873 1.00 24.14 H new ATOM 0 HD2 ARG A 26 12.044 5.915 0.812 1.00 13.21 H new ATOM 0 HD3 ARG A 26 11.264 4.432 1.325 1.00 13.21 H new ATOM 0 HE ARG A 26 11.938 5.619 3.724 1.00 2.10 H new ATOM 0 HH11 ARG A 26 10.230 6.681 0.823 1.00 40.01 H new ATOM 0 HH12 ARG A 26 9.196 7.810 1.706 1.00 40.01 H new ATOM 0 HH21 ARG A 26 10.607 7.070 4.850 1.00 14.41 H new ATOM 0 HH22 ARG A 26 9.409 8.030 3.975 1.00 14.41 H new ATOM 242 N CYS A 27 15.679 2.297 0.579 1.00 14.02 N ATOM 243 CA CYS A 27 17.111 2.065 0.441 1.00 61.33 C ATOM 244 C CYS A 27 17.875 3.385 0.399 1.00 11.13 C ATOM 245 O CYS A 27 17.397 4.373 -0.159 1.00 4.32 O ATOM 246 CB CYS A 27 17.398 1.257 -0.827 1.00 12.03 C ATOM 247 SG CYS A 27 16.856 -0.480 -0.740 1.00 23.23 S ATOM 0 H CYS A 27 15.293 2.960 -0.093 1.00 14.02 H new ATOM 0 HA CYS A 27 17.447 1.499 1.310 1.00 61.33 H new ATOM 0 HB2 CYS A 27 16.905 1.739 -1.671 1.00 12.03 H new ATOM 0 HB3 CYS A 27 18.469 1.283 -1.027 1.00 12.03 H new ATOM 252 N TYR A 28 19.063 3.394 0.993 1.00 30.42 N ATOM 253 CA TYR A 28 19.892 4.592 1.026 1.00 3.43 C ATOM 254 C TYR A 28 21.345 4.259 0.698 1.00 55.40 C ATOM 255 O TYR A 28 21.830 3.158 0.957 1.00 72.01 O ATOM 256 CB TYR A 28 19.808 5.258 2.401 1.00 43.21 C ATOM 257 CG TYR A 28 20.381 4.415 3.518 1.00 51.30 C ATOM 258 CD1 TYR A 28 21.751 4.361 3.741 1.00 23.10 C ATOM 259 CD2 TYR A 28 19.552 3.673 4.350 1.00 70.44 C ATOM 260 CE1 TYR A 28 22.279 3.592 4.760 1.00 62.40 C ATOM 261 CE2 TYR A 28 20.071 2.902 5.372 1.00 72.12 C ATOM 262 CZ TYR A 28 21.435 2.864 5.573 1.00 51.41 C ATOM 263 OH TYR A 28 21.956 2.097 6.589 1.00 32.32 O ATOM 0 H TYR A 28 19.473 2.584 1.458 1.00 30.42 H new ATOM 0 HA TYR A 28 19.517 5.283 0.271 1.00 3.43 H new ATOM 0 HB2 TYR A 28 20.338 6.210 2.367 1.00 43.21 H new ATOM 0 HB3 TYR A 28 18.765 5.481 2.624 1.00 43.21 H new ATOM 0 HD1 TYR A 28 22.415 4.930 3.107 1.00 23.10 H new ATOM 0 HD2 TYR A 28 18.483 3.699 4.195 1.00 70.44 H new ATOM 0 HE1 TYR A 28 23.347 3.561 4.919 1.00 62.40 H new ATOM 0 HE2 TYR A 28 19.412 2.332 6.010 1.00 72.12 H new ATOM 0 HH TYR A 28 21.227 1.649 7.067 1.00 32.32 H new ATOM 273 N PRO A 29 22.056 5.235 0.114 1.00 64.42 N ATOM 274 CA PRO A 29 23.464 5.071 -0.262 1.00 72.11 C ATOM 275 C PRO A 29 24.383 4.993 0.952 1.00 11.11 C ATOM 276 O PRO A 29 24.547 5.970 1.684 1.00 44.15 O ATOM 277 CB PRO A 29 23.762 6.331 -1.079 1.00 32.15 C ATOM 278 CG PRO A 29 22.783 7.341 -0.587 1.00 71.24 C ATOM 279 CD PRO A 29 21.542 6.573 -0.224 1.00 64.52 C ATOM 0 HA PRO A 29 23.635 4.143 -0.807 1.00 72.11 H new ATOM 0 HB2 PRO A 29 24.788 6.667 -0.928 1.00 32.15 H new ATOM 0 HB3 PRO A 29 23.640 6.149 -2.147 1.00 32.15 H new ATOM 0 HG2 PRO A 29 23.176 7.877 0.277 1.00 71.24 H new ATOM 0 HG3 PRO A 29 22.571 8.085 -1.355 1.00 71.24 H new ATOM 0 HD2 PRO A 29 21.020 7.028 0.618 1.00 64.52 H new ATOM 0 HD3 PRO A 29 20.836 6.535 -1.054 1.00 64.52 H new ATOM 287 N THR A 30 24.981 3.825 1.162 1.00 62.51 N ATOM 288 CA THR A 30 25.883 3.619 2.288 1.00 44.10 C ATOM 289 C THR A 30 27.079 4.562 2.214 1.00 60.34 C ATOM 290 O THR A 30 27.174 5.521 2.979 1.00 21.35 O ATOM 291 CB THR A 30 26.392 2.166 2.342 1.00 1.24 C ATOM 292 OG1 THR A 30 25.558 1.325 1.539 1.00 71.45 O ATOM 293 CG2 THR A 30 26.410 1.652 3.774 1.00 11.42 C ATOM 0 H THR A 30 24.857 3.006 0.566 1.00 62.51 H new ATOM 0 HA THR A 30 25.313 3.830 3.192 1.00 44.10 H new ATOM 0 HB THR A 30 27.410 2.146 1.953 1.00 1.24 H new ATOM 0 HG1 THR A 30 25.420 0.469 1.996 1.00 71.45 H new ATOM 0 HG21 THR A 30 26.773 0.624 3.787 1.00 11.42 H new ATOM 0 HG22 THR A 30 27.069 2.277 4.377 1.00 11.42 H new ATOM 0 HG23 THR A 30 25.401 1.686 4.185 1.00 11.42 H new ATOM 301 N SER A 31 27.990 4.283 1.286 1.00 14.22 N ATOM 302 CA SER A 31 29.182 5.105 1.114 1.00 14.31 C ATOM 303 C SER A 31 29.130 5.867 -0.207 1.00 13.54 C ATOM 304 O SER A 31 28.226 5.667 -1.016 1.00 72.34 O ATOM 305 CB SER A 31 30.439 4.235 1.165 1.00 72.04 C ATOM 306 OG SER A 31 31.105 4.373 2.408 1.00 50.03 O ATOM 0 H SER A 31 27.925 3.494 0.642 1.00 14.22 H new ATOM 0 HA SER A 31 29.216 5.828 1.929 1.00 14.31 H new ATOM 0 HB2 SER A 31 30.169 3.191 1.008 1.00 72.04 H new ATOM 0 HB3 SER A 31 31.112 4.516 0.355 1.00 72.04 H new ATOM 0 HG SER A 31 31.904 3.806 2.416 1.00 50.03 H new ATOM 312 N ASN A 32 30.107 6.743 -0.416 1.00 2.53 N ATOM 313 CA ASN A 32 30.174 7.537 -1.637 1.00 53.24 C ATOM 314 C ASN A 32 30.478 6.654 -2.844 1.00 1.32 C ATOM 315 O ASN A 32 29.841 6.774 -3.890 1.00 31.12 O ATOM 316 CB ASN A 32 31.241 8.626 -1.506 1.00 32.34 C ATOM 317 CG ASN A 32 30.649 10.022 -1.536 1.00 24.25 C ATOM 318 OD1 ASN A 32 31.106 10.885 -2.285 1.00 13.40 O ATOM 319 ND2 ASN A 32 29.628 10.249 -0.718 1.00 2.23 N ATOM 0 H ASN A 32 30.863 6.921 0.245 1.00 2.53 H new ATOM 0 HA ASN A 32 29.202 8.007 -1.788 1.00 53.24 H new ATOM 0 HB2 ASN A 32 31.787 8.486 -0.573 1.00 32.34 H new ATOM 0 HB3 ASN A 32 31.963 8.523 -2.316 1.00 32.34 H new ATOM 0 HD21 ASN A 32 29.189 11.169 -0.693 1.00 2.23 H new ATOM 0 HD22 ASN A 32 29.282 9.503 -0.114 1.00 2.23 H new ATOM 326 N ALA A 33 31.456 5.768 -2.690 1.00 20.34 N ATOM 327 CA ALA A 33 31.843 4.863 -3.765 1.00 23.24 C ATOM 328 C ALA A 33 31.091 3.540 -3.667 1.00 11.13 C ATOM 329 O ALA A 33 30.421 3.123 -4.612 1.00 61.31 O ATOM 330 CB ALA A 33 33.345 4.621 -3.736 1.00 3.31 C ATOM 0 H ALA A 33 31.995 5.658 -1.831 1.00 20.34 H new ATOM 0 HA ALA A 33 31.579 5.332 -4.713 1.00 23.24 H new ATOM 0 HB1 ALA A 33 33.620 3.943 -4.544 1.00 3.31 H new ATOM 0 HB2 ALA A 33 33.869 5.568 -3.863 1.00 3.31 H new ATOM 0 HB3 ALA A 33 33.624 4.178 -2.780 1.00 3.31 H new ATOM 336 N THR A 34 31.206 2.883 -2.517 1.00 32.23 N ATOM 337 CA THR A 34 30.538 1.606 -2.296 1.00 1.31 C ATOM 338 C THR A 34 30.604 1.198 -0.829 1.00 24.32 C ATOM 339 O THR A 34 31.459 1.671 -0.081 1.00 62.52 O ATOM 340 CB THR A 34 31.161 0.491 -3.156 1.00 75.44 C ATOM 341 OG1 THR A 34 30.654 -0.784 -2.747 1.00 31.54 O ATOM 342 CG2 THR A 34 32.677 0.500 -3.041 1.00 3.33 C ATOM 0 H THR A 34 31.756 3.214 -1.724 1.00 32.23 H new ATOM 0 HA THR A 34 29.496 1.739 -2.586 1.00 1.31 H new ATOM 0 HB THR A 34 30.891 0.673 -4.196 1.00 75.44 H new ATOM 0 HG1 THR A 34 31.054 -1.488 -3.300 1.00 31.54 H new ATOM 0 HG21 THR A 34 33.093 -0.297 -3.657 1.00 3.33 H new ATOM 0 HG22 THR A 34 33.062 1.461 -3.381 1.00 3.33 H new ATOM 0 HG23 THR A 34 32.964 0.342 -2.001 1.00 3.33 H new ATOM 350 N ASN A 35 29.696 0.316 -0.423 1.00 65.45 N ATOM 351 CA ASN A 35 29.652 -0.157 0.956 1.00 45.05 C ATOM 352 C ASN A 35 30.626 -1.313 1.166 1.00 40.41 C ATOM 353 O ASN A 35 30.705 -2.230 0.348 1.00 41.00 O ATOM 354 CB ASN A 35 28.234 -0.598 1.320 1.00 15.14 C ATOM 355 CG ASN A 35 28.158 -1.216 2.703 1.00 32.11 C ATOM 356 OD1 ASN A 35 27.500 -2.237 2.903 1.00 31.25 O ATOM 357 ND2 ASN A 35 28.833 -0.598 3.665 1.00 13.22 N ATOM 0 H ASN A 35 28.981 -0.086 -1.029 1.00 65.45 H new ATOM 0 HA ASN A 35 29.948 0.666 1.606 1.00 45.05 H new ATOM 0 HB2 ASN A 35 27.565 0.262 1.272 1.00 15.14 H new ATOM 0 HB3 ASN A 35 27.880 -1.319 0.583 1.00 15.14 H new ATOM 0 HD21 ASN A 35 28.819 -0.967 4.616 1.00 13.22 H new ATOM 0 HD22 ASN A 35 29.365 0.246 3.453 1.00 13.22 H new ATOM 364 N THR A 36 31.366 -1.262 2.269 1.00 64.40 N ATOM 365 CA THR A 36 32.335 -2.304 2.587 1.00 1.34 C ATOM 366 C THR A 36 31.993 -2.989 3.905 1.00 15.13 C ATOM 367 O THR A 36 31.556 -2.342 4.858 1.00 31.30 O ATOM 368 CB THR A 36 33.764 -1.734 2.674 1.00 32.41 C ATOM 369 OG1 THR A 36 33.907 -0.631 1.773 1.00 52.20 O ATOM 370 CG2 THR A 36 34.793 -2.804 2.342 1.00 44.33 C ATOM 0 H THR A 36 31.313 -0.511 2.957 1.00 64.40 H new ATOM 0 HA THR A 36 32.291 -3.034 1.779 1.00 1.34 H new ATOM 0 HB THR A 36 33.934 -1.392 3.695 1.00 32.41 H new ATOM 0 HG1 THR A 36 34.817 -0.273 1.836 1.00 52.20 H new ATOM 0 HG21 THR A 36 35.795 -2.379 2.410 1.00 44.33 H new ATOM 0 HG22 THR A 36 34.700 -3.629 3.048 1.00 44.33 H new ATOM 0 HG23 THR A 36 34.622 -3.171 1.330 1.00 44.33 H new ATOM 378 N CYS A 37 32.194 -4.301 3.954 1.00 34.51 N ATOM 379 CA CYS A 37 31.906 -5.075 5.156 1.00 64.43 C ATOM 380 C CYS A 37 33.055 -6.028 5.477 1.00 53.23 C ATOM 381 O CYS A 37 33.412 -6.883 4.666 1.00 53.31 O ATOM 382 CB CYS A 37 30.608 -5.865 4.981 1.00 71.44 C ATOM 383 SG CYS A 37 30.265 -7.042 6.329 1.00 44.51 S ATOM 0 H CYS A 37 32.555 -4.851 3.175 1.00 34.51 H new ATOM 0 HA CYS A 37 31.790 -4.379 5.987 1.00 64.43 H new ATOM 0 HB2 CYS A 37 29.776 -5.164 4.905 1.00 71.44 H new ATOM 0 HB3 CYS A 37 30.652 -6.411 4.039 1.00 71.44 H new ATOM 388 N PHE A 38 33.629 -5.874 6.665 1.00 10.12 N ATOM 389 CA PHE A 38 34.737 -6.719 7.094 1.00 63.11 C ATOM 390 C PHE A 38 35.848 -6.732 6.048 1.00 41.42 C ATOM 391 O PHE A 38 36.343 -7.791 5.665 1.00 42.42 O ATOM 392 CB PHE A 38 34.248 -8.146 7.352 1.00 3.31 C ATOM 393 CG PHE A 38 33.713 -8.354 8.740 1.00 63.20 C ATOM 394 CD1 PHE A 38 33.176 -7.296 9.456 1.00 60.33 C ATOM 395 CD2 PHE A 38 33.747 -9.608 9.329 1.00 42.12 C ATOM 396 CE1 PHE A 38 32.684 -7.485 10.733 1.00 31.42 C ATOM 397 CE2 PHE A 38 33.256 -9.803 10.606 1.00 60.10 C ATOM 398 CZ PHE A 38 32.723 -8.740 11.309 1.00 72.54 C ATOM 0 H PHE A 38 33.345 -5.172 7.348 1.00 10.12 H new ATOM 0 HA PHE A 38 35.138 -6.306 8.020 1.00 63.11 H new ATOM 0 HB2 PHE A 38 33.469 -8.391 6.630 1.00 3.31 H new ATOM 0 HB3 PHE A 38 35.071 -8.840 7.180 1.00 3.31 H new ATOM 0 HD1 PHE A 38 33.142 -6.313 9.011 1.00 60.33 H new ATOM 0 HD2 PHE A 38 34.162 -10.443 8.784 1.00 42.12 H new ATOM 0 HE1 PHE A 38 32.269 -6.652 11.281 1.00 31.42 H new ATOM 0 HE2 PHE A 38 33.289 -10.785 11.054 1.00 60.10 H new ATOM 0 HZ PHE A 38 32.338 -8.890 12.307 1.00 72.54 H new ATOM 408 N GLY A 39 36.234 -5.545 5.589 1.00 4.20 N ATOM 409 CA GLY A 39 37.283 -5.441 4.591 1.00 11.22 C ATOM 410 C GLY A 39 36.775 -5.700 3.187 1.00 73.41 C ATOM 411 O GLY A 39 36.945 -4.870 2.294 1.00 23.13 O ATOM 0 H GLY A 39 35.839 -4.654 5.890 1.00 4.20 H new ATOM 0 HA2 GLY A 39 37.726 -4.446 4.636 1.00 11.22 H new ATOM 0 HA3 GLY A 39 38.075 -6.153 4.825 1.00 11.22 H new ATOM 415 N SER A 40 36.150 -6.857 2.990 1.00 52.23 N ATOM 416 CA SER A 40 35.620 -7.226 1.682 1.00 21.23 C ATOM 417 C SER A 40 34.458 -6.318 1.291 1.00 62.33 C ATOM 418 O SER A 40 33.458 -6.227 2.003 1.00 3.02 O ATOM 419 CB SER A 40 35.162 -8.686 1.688 1.00 0.10 C ATOM 420 OG SER A 40 36.267 -9.568 1.594 1.00 4.32 O ATOM 0 H SER A 40 35.998 -7.554 3.719 1.00 52.23 H new ATOM 0 HA SER A 40 36.416 -7.105 0.947 1.00 21.23 H new ATOM 0 HB2 SER A 40 34.605 -8.892 2.602 1.00 0.10 H new ATOM 0 HB3 SER A 40 34.482 -8.860 0.854 1.00 0.10 H new ATOM 0 HG SER A 40 35.948 -10.494 1.602 1.00 4.32 H new ATOM 426 N LYS A 41 34.598 -5.648 0.152 1.00 15.42 N ATOM 427 CA LYS A 41 33.561 -4.747 -0.338 1.00 12.15 C ATOM 428 C LYS A 41 32.332 -5.528 -0.792 1.00 12.31 C ATOM 429 O LYS A 41 32.449 -6.557 -1.459 1.00 11.23 O ATOM 430 CB LYS A 41 34.097 -3.900 -1.494 1.00 73.34 C ATOM 431 CG LYS A 41 35.401 -3.190 -1.175 1.00 70.43 C ATOM 432 CD LYS A 41 36.077 -2.673 -2.434 1.00 71.52 C ATOM 433 CE LYS A 41 35.539 -1.309 -2.835 1.00 53.44 C ATOM 434 NZ LYS A 41 36.574 -0.483 -3.517 1.00 54.22 N ATOM 0 H LYS A 41 35.420 -5.712 -0.449 1.00 15.42 H new ATOM 0 HA LYS A 41 33.269 -4.089 0.481 1.00 12.15 H new ATOM 0 HB2 LYS A 41 34.245 -4.540 -2.364 1.00 73.34 H new ATOM 0 HB3 LYS A 41 33.347 -3.158 -1.768 1.00 73.34 H new ATOM 0 HG2 LYS A 41 35.207 -2.359 -0.497 1.00 70.43 H new ATOM 0 HG3 LYS A 41 36.072 -3.875 -0.656 1.00 70.43 H new ATOM 0 HD2 LYS A 41 37.153 -2.607 -2.270 1.00 71.52 H new ATOM 0 HD3 LYS A 41 35.922 -3.380 -3.248 1.00 71.52 H new ATOM 0 HE2 LYS A 41 34.682 -1.437 -3.497 1.00 53.44 H new ATOM 0 HE3 LYS A 41 35.182 -0.785 -1.949 1.00 53.44 H new ATOM 0 HZ1 LYS A 41 36.168 0.439 -3.774 1.00 54.22 H new ATOM 0 HZ2 LYS A 41 37.381 -0.339 -2.877 1.00 54.22 H new ATOM 0 HZ3 LYS A 41 36.897 -0.971 -4.377 1.00 54.22 H new ATOM 448 N LEU A 42 31.154 -5.032 -0.428 1.00 61.14 N ATOM 449 CA LEU A 42 29.902 -5.683 -0.800 1.00 45.22 C ATOM 450 C LEU A 42 29.511 -5.332 -2.232 1.00 71.32 C ATOM 451 O LEU A 42 29.887 -4.289 -2.767 1.00 62.10 O ATOM 452 CB LEU A 42 28.786 -5.272 0.161 1.00 11.21 C ATOM 453 CG LEU A 42 29.091 -5.431 1.651 1.00 13.50 C ATOM 454 CD1 LEU A 42 29.633 -4.131 2.226 1.00 31.43 C ATOM 455 CD2 LEU A 42 27.845 -5.872 2.406 1.00 3.41 C ATOM 0 H LEU A 42 31.040 -4.182 0.124 1.00 61.14 H new ATOM 0 HA LEU A 42 30.048 -6.761 -0.737 1.00 45.22 H new ATOM 0 HB2 LEU A 42 28.536 -4.228 -0.029 1.00 11.21 H new ATOM 0 HB3 LEU A 42 27.898 -5.860 -0.072 1.00 11.21 H new ATOM 0 HG LEU A 42 29.853 -6.201 1.767 1.00 13.50 H new ATOM 0 HD11 LEU A 42 29.844 -4.263 3.287 1.00 31.43 H new ATOM 0 HD12 LEU A 42 30.550 -3.857 1.705 1.00 31.43 H new ATOM 0 HD13 LEU A 42 28.893 -3.341 2.099 1.00 31.43 H new ATOM 0 HD21 LEU A 42 28.080 -5.980 3.465 1.00 3.41 H new ATOM 0 HD22 LEU A 42 27.061 -5.124 2.283 1.00 3.41 H new ATOM 0 HD23 LEU A 42 27.500 -6.828 2.012 1.00 3.41 H new ATOM 467 N PRO A 43 28.735 -6.222 -2.869 1.00 22.44 N ATOM 468 CA PRO A 43 28.273 -6.028 -4.246 1.00 41.41 C ATOM 469 C PRO A 43 27.247 -4.905 -4.360 1.00 65.12 C ATOM 470 O PRO A 43 26.869 -4.506 -5.462 1.00 63.30 O ATOM 471 CB PRO A 43 27.635 -7.373 -4.600 1.00 32.24 C ATOM 472 CG PRO A 43 27.226 -7.954 -3.290 1.00 73.12 C ATOM 473 CD PRO A 43 28.249 -7.487 -2.292 1.00 70.22 C ATOM 0 HA PRO A 43 29.086 -5.739 -4.912 1.00 41.41 H new ATOM 0 HB2 PRO A 43 26.778 -7.243 -5.261 1.00 32.24 H new ATOM 0 HB3 PRO A 43 28.341 -8.022 -5.118 1.00 32.24 H new ATOM 0 HG2 PRO A 43 26.227 -7.620 -3.010 1.00 73.12 H new ATOM 0 HG3 PRO A 43 27.196 -9.043 -3.338 1.00 73.12 H new ATOM 0 HD2 PRO A 43 27.809 -7.336 -1.306 1.00 70.22 H new ATOM 0 HD3 PRO A 43 29.055 -8.211 -2.174 1.00 70.22 H new ATOM 481 N TYR A 44 26.801 -4.399 -3.216 1.00 24.11 N ATOM 482 CA TYR A 44 25.818 -3.323 -3.188 1.00 34.31 C ATOM 483 C TYR A 44 26.330 -2.138 -2.375 1.00 74.01 C ATOM 484 O TYR A 44 27.054 -2.310 -1.396 1.00 24.52 O ATOM 485 CB TYR A 44 24.498 -3.826 -2.601 1.00 74.22 C ATOM 486 CG TYR A 44 24.672 -4.707 -1.385 1.00 21.30 C ATOM 487 CD1 TYR A 44 24.893 -4.155 -0.129 1.00 32.30 C ATOM 488 CD2 TYR A 44 24.617 -6.091 -1.492 1.00 24.54 C ATOM 489 CE1 TYR A 44 25.054 -4.956 0.985 1.00 34.31 C ATOM 490 CE2 TYR A 44 24.776 -6.900 -0.383 1.00 34.11 C ATOM 491 CZ TYR A 44 24.994 -6.328 0.853 1.00 13.01 C ATOM 492 OH TYR A 44 25.153 -7.130 1.960 1.00 62.13 O ATOM 0 H TYR A 44 27.105 -4.717 -2.296 1.00 24.11 H new ATOM 0 HA TYR A 44 25.650 -2.992 -4.213 1.00 34.31 H new ATOM 0 HB2 TYR A 44 23.880 -2.969 -2.333 1.00 74.22 H new ATOM 0 HB3 TYR A 44 23.958 -4.382 -3.367 1.00 74.22 H new ATOM 0 HD1 TYR A 44 24.940 -3.081 -0.022 1.00 32.30 H new ATOM 0 HD2 TYR A 44 24.447 -6.542 -2.458 1.00 24.54 H new ATOM 0 HE1 TYR A 44 25.226 -4.511 1.954 1.00 34.31 H new ATOM 0 HE2 TYR A 44 24.730 -7.974 -0.484 1.00 34.11 H new ATOM 0 HH TYR A 44 24.578 -6.805 2.684 1.00 62.13 H new ATOM 502 N GLU A 45 25.946 -0.935 -2.790 1.00 13.44 N ATOM 503 CA GLU A 45 26.366 0.280 -2.100 1.00 73.25 C ATOM 504 C GLU A 45 25.185 0.940 -1.394 1.00 5.33 C ATOM 505 O GLU A 45 25.284 2.074 -0.923 1.00 42.44 O ATOM 506 CB GLU A 45 26.996 1.262 -3.090 1.00 4.02 C ATOM 507 CG GLU A 45 25.989 1.927 -4.013 1.00 64.44 C ATOM 508 CD GLU A 45 25.933 3.431 -3.829 1.00 35.41 C ATOM 509 OE1 GLU A 45 26.989 4.033 -3.543 1.00 73.10 O ATOM 510 OE2 GLU A 45 24.833 4.005 -3.970 1.00 50.11 O ATOM 0 H GLU A 45 25.346 -0.775 -3.599 1.00 13.44 H new ATOM 0 HA GLU A 45 27.108 0.004 -1.350 1.00 73.25 H new ATOM 0 HB2 GLU A 45 27.530 2.032 -2.534 1.00 4.02 H new ATOM 0 HB3 GLU A 45 27.735 0.733 -3.693 1.00 4.02 H new ATOM 0 HG2 GLU A 45 26.246 1.701 -5.048 1.00 64.44 H new ATOM 0 HG3 GLU A 45 25.001 1.505 -3.830 1.00 64.44 H new ATOM 517 N LEU A 46 24.069 0.223 -1.323 1.00 44.33 N ATOM 518 CA LEU A 46 22.869 0.739 -0.675 1.00 34.44 C ATOM 519 C LEU A 46 22.559 -0.044 0.598 1.00 53.52 C ATOM 520 O LEU A 46 23.182 -1.068 0.876 1.00 4.43 O ATOM 521 CB LEU A 46 21.678 0.669 -1.632 1.00 51.04 C ATOM 522 CG LEU A 46 21.758 1.565 -2.869 1.00 62.41 C ATOM 523 CD1 LEU A 46 20.489 1.444 -3.698 1.00 41.54 C ATOM 524 CD2 LEU A 46 21.998 3.012 -2.465 1.00 23.11 C ATOM 0 H LEU A 46 23.970 -0.717 -1.706 1.00 44.33 H new ATOM 0 HA LEU A 46 23.050 1.780 -0.406 1.00 34.44 H new ATOM 0 HB2 LEU A 46 21.563 -0.363 -1.962 1.00 51.04 H new ATOM 0 HB3 LEU A 46 20.776 0.929 -1.078 1.00 51.04 H new ATOM 0 HG LEU A 46 22.599 1.235 -3.479 1.00 62.41 H new ATOM 0 HD11 LEU A 46 20.564 2.088 -4.574 1.00 41.54 H new ATOM 0 HD12 LEU A 46 20.361 0.410 -4.018 1.00 41.54 H new ATOM 0 HD13 LEU A 46 19.632 1.747 -3.097 1.00 41.54 H new ATOM 0 HD21 LEU A 46 22.052 3.635 -3.358 1.00 23.11 H new ATOM 0 HD22 LEU A 46 21.178 3.354 -1.833 1.00 23.11 H new ATOM 0 HD23 LEU A 46 22.936 3.085 -1.914 1.00 23.11 H new ATOM 536 N SER A 47 21.590 0.445 1.365 1.00 11.14 N ATOM 537 CA SER A 47 21.198 -0.207 2.609 1.00 32.23 C ATOM 538 C SER A 47 19.772 0.174 2.997 1.00 43.12 C ATOM 539 O SER A 47 19.285 1.245 2.637 1.00 52.53 O ATOM 540 CB SER A 47 22.163 0.171 3.735 1.00 52.35 C ATOM 541 OG SER A 47 21.549 0.026 5.003 1.00 31.24 O ATOM 0 H SER A 47 21.062 1.290 1.147 1.00 11.14 H new ATOM 0 HA SER A 47 21.238 -1.285 2.453 1.00 32.23 H new ATOM 0 HB2 SER A 47 23.051 -0.459 3.684 1.00 52.35 H new ATOM 0 HB3 SER A 47 22.494 1.201 3.604 1.00 52.35 H new ATOM 0 HG SER A 47 21.824 0.765 5.586 1.00 31.24 H new ATOM 547 N SER A 48 19.109 -0.712 3.733 1.00 0.43 N ATOM 548 CA SER A 48 17.738 -0.471 4.167 1.00 32.03 C ATOM 549 C SER A 48 17.649 -0.433 5.690 1.00 53.31 C ATOM 550 O SER A 48 17.662 -1.472 6.351 1.00 72.23 O ATOM 551 CB SER A 48 16.809 -1.555 3.618 1.00 71.41 C ATOM 552 OG SER A 48 15.801 -1.887 4.557 1.00 53.02 O ATOM 0 H SER A 48 19.499 -1.603 4.041 1.00 0.43 H new ATOM 0 HA SER A 48 17.425 0.498 3.778 1.00 32.03 H new ATOM 0 HB2 SER A 48 16.348 -1.209 2.693 1.00 71.41 H new ATOM 0 HB3 SER A 48 17.389 -2.445 3.372 1.00 71.41 H new ATOM 0 HG SER A 48 15.654 -2.856 4.550 1.00 53.02 H new ATOM 558 N LEU A 49 17.558 0.773 6.241 1.00 62.24 N ATOM 559 CA LEU A 49 17.467 0.949 7.686 1.00 73.21 C ATOM 560 C LEU A 49 16.228 0.254 8.242 1.00 54.33 C ATOM 561 O LEU A 49 16.216 -0.191 9.389 1.00 15.14 O ATOM 562 CB LEU A 49 17.432 2.437 8.037 1.00 52.20 C ATOM 563 CG LEU A 49 17.937 2.810 9.431 1.00 34.14 C ATOM 564 CD1 LEU A 49 16.951 2.352 10.496 1.00 43.43 C ATOM 565 CD2 LEU A 49 19.311 2.206 9.680 1.00 43.51 C ATOM 0 H LEU A 49 17.545 1.643 5.709 1.00 62.24 H new ATOM 0 HA LEU A 49 18.349 0.496 8.139 1.00 73.21 H new ATOM 0 HB2 LEU A 49 18.026 2.978 7.300 1.00 52.20 H new ATOM 0 HB3 LEU A 49 16.405 2.789 7.938 1.00 52.20 H new ATOM 0 HG LEU A 49 18.023 3.895 9.487 1.00 34.14 H new ATOM 0 HD11 LEU A 49 17.327 2.626 11.482 1.00 43.43 H new ATOM 0 HD12 LEU A 49 15.987 2.832 10.329 1.00 43.43 H new ATOM 0 HD13 LEU A 49 16.832 1.270 10.441 1.00 43.43 H new ATOM 0 HD21 LEU A 49 19.655 2.482 10.677 1.00 43.51 H new ATOM 0 HD22 LEU A 49 19.250 1.120 9.605 1.00 43.51 H new ATOM 0 HD23 LEU A 49 20.014 2.582 8.937 1.00 43.51 H new ATOM 577 N ASP A 50 15.188 0.164 7.420 1.00 70.33 N ATOM 578 CA ASP A 50 13.945 -0.480 7.828 1.00 55.13 C ATOM 579 C ASP A 50 14.187 -1.936 8.213 1.00 42.21 C ATOM 580 O ASP A 50 13.443 -2.511 9.008 1.00 30.13 O ATOM 581 CB ASP A 50 12.912 -0.402 6.702 1.00 61.51 C ATOM 582 CG ASP A 50 11.511 -0.735 7.177 1.00 24.40 C ATOM 583 OD1 ASP A 50 11.317 -0.866 8.403 1.00 13.34 O ATOM 584 OD2 ASP A 50 10.610 -0.867 6.322 1.00 1.53 O ATOM 0 H ASP A 50 15.181 0.529 6.467 1.00 70.33 H new ATOM 0 HA ASP A 50 13.561 0.048 8.701 1.00 55.13 H new ATOM 0 HB2 ASP A 50 12.919 0.601 6.275 1.00 61.51 H new ATOM 0 HB3 ASP A 50 13.195 -1.089 5.905 1.00 61.51 H new ATOM 589 N LEU A 51 15.232 -2.527 7.644 1.00 52.25 N ATOM 590 CA LEU A 51 15.572 -3.917 7.926 1.00 5.23 C ATOM 591 C LEU A 51 15.796 -4.130 9.420 1.00 14.32 C ATOM 592 O LEU A 51 15.676 -5.247 9.924 1.00 2.03 O ATOM 593 CB LEU A 51 16.825 -4.324 7.149 1.00 44.31 C ATOM 594 CG LEU A 51 16.837 -5.748 6.592 1.00 1.13 C ATOM 595 CD1 LEU A 51 16.783 -6.763 7.723 1.00 33.31 C ATOM 596 CD2 LEU A 51 15.675 -5.954 5.631 1.00 24.43 C ATOM 0 H LEU A 51 15.858 -2.065 6.985 1.00 52.25 H new ATOM 0 HA LEU A 51 14.736 -4.541 7.609 1.00 5.23 H new ATOM 0 HB2 LEU A 51 16.955 -3.630 6.319 1.00 44.31 H new ATOM 0 HB3 LEU A 51 17.689 -4.204 7.803 1.00 44.31 H new ATOM 0 HG LEU A 51 17.767 -5.896 6.043 1.00 1.13 H new ATOM 0 HD11 LEU A 51 16.792 -7.771 7.308 1.00 33.31 H new ATOM 0 HD12 LEU A 51 17.648 -6.630 8.373 1.00 33.31 H new ATOM 0 HD13 LEU A 51 15.870 -6.617 8.300 1.00 33.31 H new ATOM 0 HD21 LEU A 51 15.699 -6.973 5.244 1.00 24.43 H new ATOM 0 HD22 LEU A 51 14.735 -5.787 6.156 1.00 24.43 H new ATOM 0 HD23 LEU A 51 15.758 -5.250 4.803 1.00 24.43 H new ATOM 608 N THR A 52 16.118 -3.050 10.125 1.00 4.30 N ATOM 609 CA THR A 52 16.357 -3.117 11.561 1.00 20.42 C ATOM 610 C THR A 52 15.304 -2.329 12.331 1.00 11.03 C ATOM 611 O THR A 52 14.374 -1.778 11.742 1.00 11.45 O ATOM 612 CB THR A 52 17.753 -2.578 11.925 1.00 64.23 C ATOM 613 OG1 THR A 52 18.114 -1.515 11.036 1.00 4.34 O ATOM 614 CG2 THR A 52 18.796 -3.683 11.851 1.00 22.31 C ATOM 0 H THR A 52 16.219 -2.118 9.724 1.00 4.30 H new ATOM 0 HA THR A 52 16.298 -4.169 11.842 1.00 20.42 H new ATOM 0 HB THR A 52 17.718 -2.201 12.947 1.00 64.23 H new ATOM 0 HG1 THR A 52 19.086 -1.391 11.052 1.00 4.34 H new ATOM 0 HG21 THR A 52 19.774 -3.278 12.112 1.00 22.31 H new ATOM 0 HG22 THR A 52 18.534 -4.478 12.549 1.00 22.31 H new ATOM 0 HG23 THR A 52 18.828 -4.085 10.839 1.00 22.31 H new ATOM 622 N ASP A 53 15.456 -2.279 13.650 1.00 43.00 N ATOM 623 CA ASP A 53 14.519 -1.556 14.501 1.00 13.31 C ATOM 624 C ASP A 53 15.147 -0.271 15.033 1.00 20.41 C ATOM 625 O ASP A 53 15.261 -0.079 16.244 1.00 51.12 O ATOM 626 CB ASP A 53 14.069 -2.439 15.666 1.00 12.31 C ATOM 627 CG ASP A 53 12.697 -2.057 16.186 1.00 52.32 C ATOM 628 OD1 ASP A 53 12.144 -1.042 15.712 1.00 75.34 O ATOM 629 OD2 ASP A 53 12.176 -2.773 17.066 1.00 11.32 O ATOM 0 H ASP A 53 16.220 -2.731 14.153 1.00 43.00 H new ATOM 0 HA ASP A 53 13.650 -1.292 13.899 1.00 13.31 H new ATOM 0 HB2 ASP A 53 14.055 -3.480 15.345 1.00 12.31 H new ATOM 0 HB3 ASP A 53 14.795 -2.365 16.476 1.00 12.31 H new ATOM 634 N PHE A 54 15.554 0.604 14.120 1.00 4.22 N ATOM 635 CA PHE A 54 16.173 1.870 14.497 1.00 25.53 C ATOM 636 C PHE A 54 15.398 3.049 13.917 1.00 63.45 C ATOM 637 O PHE A 54 14.311 2.880 13.364 1.00 60.54 O ATOM 638 CB PHE A 54 17.626 1.914 14.018 1.00 31.22 C ATOM 639 CG PHE A 54 18.462 0.778 14.535 1.00 44.33 C ATOM 640 CD1 PHE A 54 18.695 0.634 15.893 1.00 63.11 C ATOM 641 CD2 PHE A 54 19.015 -0.145 13.662 1.00 23.11 C ATOM 642 CE1 PHE A 54 19.465 -0.410 16.371 1.00 43.44 C ATOM 643 CE2 PHE A 54 19.786 -1.191 14.134 1.00 31.11 C ATOM 644 CZ PHE A 54 20.010 -1.324 15.490 1.00 2.13 C ATOM 0 H PHE A 54 15.467 0.460 13.114 1.00 4.22 H new ATOM 0 HA PHE A 54 16.154 1.946 15.584 1.00 25.53 H new ATOM 0 HB2 PHE A 54 17.642 1.899 12.928 1.00 31.22 H new ATOM 0 HB3 PHE A 54 18.075 2.857 14.331 1.00 31.22 H new ATOM 0 HD1 PHE A 54 18.270 1.345 16.586 1.00 63.11 H new ATOM 0 HD2 PHE A 54 18.842 -0.046 12.601 1.00 23.11 H new ATOM 0 HE1 PHE A 54 19.640 -0.511 17.432 1.00 43.44 H new ATOM 0 HE2 PHE A 54 20.213 -1.903 13.443 1.00 31.11 H new ATOM 0 HZ PHE A 54 20.610 -2.141 15.861 1.00 2.13 H new ATOM 654 N HIS A 55 15.966 4.244 14.047 1.00 75.23 N ATOM 655 CA HIS A 55 15.329 5.452 13.535 1.00 15.11 C ATOM 656 C HIS A 55 16.312 6.277 12.711 1.00 40.41 C ATOM 657 O HIS A 55 16.028 7.419 12.345 1.00 23.25 O ATOM 658 CB HIS A 55 14.781 6.293 14.689 1.00 73.32 C ATOM 659 CG HIS A 55 13.315 6.097 14.929 1.00 4.24 C ATOM 660 ND1 HIS A 55 12.730 4.853 15.035 1.00 14.42 N ATOM 661 CD2 HIS A 55 12.316 6.997 15.087 1.00 63.43 C ATOM 662 CE1 HIS A 55 11.433 4.996 15.245 1.00 2.24 C ATOM 663 NE2 HIS A 55 11.157 6.287 15.281 1.00 13.34 N ATOM 0 H HIS A 55 16.865 4.401 14.502 1.00 75.23 H new ATOM 0 HA HIS A 55 14.503 5.152 12.890 1.00 15.11 H new ATOM 0 HB2 HIS A 55 15.326 6.045 15.600 1.00 73.32 H new ATOM 0 HB3 HIS A 55 14.969 7.346 14.482 1.00 73.32 H new ATOM 0 HD1 HIS A 55 13.221 3.962 14.963 1.00 14.42 H new ATOM 0 HD2 HIS A 55 12.413 8.072 15.065 1.00 63.43 H new ATOM 0 HE1 HIS A 55 10.720 4.194 15.366 1.00 2.24 H new ATOM 671 N THR A 56 17.471 5.693 12.422 1.00 53.14 N ATOM 672 CA THR A 56 18.497 6.375 11.643 1.00 72.43 C ATOM 673 C THR A 56 19.742 5.507 11.495 1.00 55.12 C ATOM 674 O THR A 56 19.978 4.605 12.297 1.00 64.41 O ATOM 675 CB THR A 56 18.893 7.716 12.288 1.00 44.04 C ATOM 676 OG1 THR A 56 20.182 8.125 11.815 1.00 32.21 O ATOM 677 CG2 THR A 56 18.917 7.601 13.804 1.00 11.24 C ATOM 0 H THR A 56 17.722 4.749 12.716 1.00 53.14 H new ATOM 0 HA THR A 56 18.072 6.566 10.658 1.00 72.43 H new ATOM 0 HB THR A 56 18.150 8.462 12.008 1.00 44.04 H new ATOM 0 HG1 THR A 56 20.138 9.054 11.507 1.00 32.21 H new ATOM 0 HG21 THR A 56 19.199 8.561 14.237 1.00 11.24 H new ATOM 0 HG22 THR A 56 17.928 7.318 14.163 1.00 11.24 H new ATOM 0 HG23 THR A 56 19.641 6.842 14.100 1.00 11.24 H new ATOM 685 N GLU A 57 20.534 5.787 10.465 1.00 53.43 N ATOM 686 CA GLU A 57 21.755 5.031 10.213 1.00 52.21 C ATOM 687 C GLU A 57 22.677 5.067 11.428 1.00 30.42 C ATOM 688 O GLU A 57 23.260 4.051 11.810 1.00 40.53 O ATOM 689 CB GLU A 57 22.484 5.590 8.989 1.00 31.22 C ATOM 690 CG GLU A 57 21.581 5.798 7.785 1.00 11.22 C ATOM 691 CD GLU A 57 22.354 6.156 6.531 1.00 62.22 C ATOM 692 OE1 GLU A 57 23.569 5.872 6.481 1.00 2.21 O ATOM 693 OE2 GLU A 57 21.743 6.720 5.599 1.00 64.44 O ATOM 0 H GLU A 57 20.352 6.531 9.792 1.00 53.43 H new ATOM 0 HA GLU A 57 21.477 3.995 10.020 1.00 52.21 H new ATOM 0 HB2 GLU A 57 22.946 6.541 9.255 1.00 31.22 H new ATOM 0 HB3 GLU A 57 23.290 4.910 8.715 1.00 31.22 H new ATOM 0 HG2 GLU A 57 21.006 4.890 7.606 1.00 11.22 H new ATOM 0 HG3 GLU A 57 20.865 6.590 8.005 1.00 11.22 H new ATOM 700 N LYS A 58 22.805 6.243 12.032 1.00 13.04 N ATOM 701 CA LYS A 58 23.655 6.413 13.205 1.00 54.31 C ATOM 702 C LYS A 58 23.289 5.408 14.292 1.00 2.14 C ATOM 703 O LYS A 58 24.154 4.937 15.030 1.00 1.21 O ATOM 704 CB LYS A 58 23.528 7.838 13.749 1.00 4.02 C ATOM 705 CG LYS A 58 22.222 8.097 14.479 1.00 32.32 C ATOM 706 CD LYS A 58 21.764 9.536 14.310 1.00 21.22 C ATOM 707 CE LYS A 58 21.088 10.057 15.569 1.00 4.22 C ATOM 708 NZ LYS A 58 20.000 11.023 15.255 1.00 54.32 N ATOM 0 H LYS A 58 22.331 7.094 11.729 1.00 13.04 H new ATOM 0 HA LYS A 58 24.688 6.236 12.904 1.00 54.31 H new ATOM 0 HB2 LYS A 58 24.358 8.034 14.427 1.00 4.02 H new ATOM 0 HB3 LYS A 58 23.618 8.543 12.922 1.00 4.02 H new ATOM 0 HG2 LYS A 58 21.453 7.423 14.101 1.00 32.32 H new ATOM 0 HG3 LYS A 58 22.347 7.876 15.539 1.00 32.32 H new ATOM 0 HD2 LYS A 58 22.620 10.166 14.068 1.00 21.22 H new ATOM 0 HD3 LYS A 58 21.072 9.603 13.470 1.00 21.22 H new ATOM 0 HE2 LYS A 58 20.678 9.220 16.134 1.00 4.22 H new ATOM 0 HE3 LYS A 58 21.829 10.539 16.206 1.00 4.22 H new ATOM 0 HZ1 LYS A 58 19.922 11.720 16.023 1.00 54.32 H new ATOM 0 HZ2 LYS A 58 20.217 11.513 14.364 1.00 54.32 H new ATOM 0 HZ3 LYS A 58 19.099 10.512 15.158 1.00 54.32 H new ATOM 722 N GLU A 59 22.003 5.083 14.384 1.00 3.51 N ATOM 723 CA GLU A 59 21.525 4.133 15.382 1.00 43.34 C ATOM 724 C GLU A 59 21.997 2.719 15.056 1.00 50.11 C ATOM 725 O GLU A 59 22.354 1.950 15.949 1.00 3.24 O ATOM 726 CB GLU A 59 19.998 4.168 15.460 1.00 34.23 C ATOM 727 CG GLU A 59 19.467 4.959 16.644 1.00 53.33 C ATOM 728 CD GLU A 59 18.979 4.068 17.770 1.00 54.55 C ATOM 729 OE1 GLU A 59 19.626 3.033 18.031 1.00 53.13 O ATOM 730 OE2 GLU A 59 17.949 4.408 18.390 1.00 71.34 O ATOM 0 H GLU A 59 21.274 5.463 13.780 1.00 3.51 H new ATOM 0 HA GLU A 59 21.938 4.421 16.349 1.00 43.34 H new ATOM 0 HB2 GLU A 59 19.605 4.600 14.540 1.00 34.23 H new ATOM 0 HB3 GLU A 59 19.622 3.147 15.518 1.00 34.23 H new ATOM 0 HG2 GLU A 59 20.252 5.615 17.019 1.00 53.33 H new ATOM 0 HG3 GLU A 59 18.649 5.599 16.311 1.00 53.33 H new ATOM 737 N LEU A 60 21.995 2.383 13.771 1.00 72.42 N ATOM 738 CA LEU A 60 22.422 1.061 13.325 1.00 32.44 C ATOM 739 C LEU A 60 23.906 0.846 13.602 1.00 4.01 C ATOM 740 O LEU A 60 24.305 -0.188 14.136 1.00 20.11 O ATOM 741 CB LEU A 60 22.140 0.888 11.832 1.00 53.31 C ATOM 742 CG LEU A 60 21.902 -0.545 11.355 1.00 41.13 C ATOM 743 CD1 LEU A 60 21.574 -0.566 9.870 1.00 41.31 C ATOM 744 CD2 LEU A 60 23.118 -1.413 11.646 1.00 13.54 C ATOM 0 H LEU A 60 21.703 3.007 13.019 1.00 72.42 H new ATOM 0 HA LEU A 60 21.855 0.316 13.884 1.00 32.44 H new ATOM 0 HB2 LEU A 60 21.264 1.485 11.577 1.00 53.31 H new ATOM 0 HB3 LEU A 60 22.981 1.300 11.274 1.00 53.31 H new ATOM 0 HG LEU A 60 21.050 -0.952 11.900 1.00 41.13 H new ATOM 0 HD11 LEU A 60 21.408 -1.594 9.549 1.00 41.31 H new ATOM 0 HD12 LEU A 60 20.674 0.021 9.688 1.00 41.31 H new ATOM 0 HD13 LEU A 60 22.405 -0.140 9.308 1.00 41.31 H new ATOM 0 HD21 LEU A 60 22.931 -2.429 11.300 1.00 13.54 H new ATOM 0 HD22 LEU A 60 23.987 -1.007 11.128 1.00 13.54 H new ATOM 0 HD23 LEU A 60 23.308 -1.425 12.719 1.00 13.54 H new ATOM 756 N ASN A 61 24.720 1.832 13.237 1.00 73.32 N ATOM 757 CA ASN A 61 26.161 1.751 13.447 1.00 14.33 C ATOM 758 C ASN A 61 26.501 1.871 14.930 1.00 44.44 C ATOM 759 O ASN A 61 27.477 1.288 15.402 1.00 44.31 O ATOM 760 CB ASN A 61 26.874 2.850 12.658 1.00 45.52 C ATOM 761 CG ASN A 61 28.179 2.372 12.050 1.00 74.42 C ATOM 762 OD1 ASN A 61 29.210 3.033 12.166 1.00 24.13 O ATOM 763 ND2 ASN A 61 28.138 1.216 11.396 1.00 15.33 N ATOM 0 H ASN A 61 24.406 2.696 12.795 1.00 73.32 H new ATOM 0 HA ASN A 61 26.502 0.779 13.092 1.00 14.33 H new ATOM 0 HB2 ASN A 61 26.217 3.209 11.866 1.00 45.52 H new ATOM 0 HB3 ASN A 61 27.071 3.696 13.316 1.00 45.52 H new ATOM 0 HD21 ASN A 61 28.984 0.843 10.965 1.00 15.33 H new ATOM 0 HD22 ASN A 61 27.260 0.701 11.325 1.00 15.33 H new ATOM 770 N ASP A 62 25.690 2.631 15.658 1.00 61.43 N ATOM 771 CA ASP A 62 25.904 2.826 17.087 1.00 51.21 C ATOM 772 C ASP A 62 25.538 1.568 17.868 1.00 2.03 C ATOM 773 O ASP A 62 26.129 1.276 18.909 1.00 54.44 O ATOM 774 CB ASP A 62 25.079 4.012 17.590 1.00 21.21 C ATOM 775 CG ASP A 62 25.105 4.136 19.101 1.00 61.41 C ATOM 776 OD1 ASP A 62 26.151 4.549 19.644 1.00 73.10 O ATOM 777 OD2 ASP A 62 24.080 3.818 19.740 1.00 2.33 O ATOM 0 H ASP A 62 24.879 3.122 15.282 1.00 61.43 H new ATOM 0 HA ASP A 62 26.962 3.035 17.246 1.00 51.21 H new ATOM 0 HB2 ASP A 62 25.462 4.931 17.146 1.00 21.21 H new ATOM 0 HB3 ASP A 62 24.048 3.902 17.255 1.00 21.21 H new ATOM 782 N LYS A 63 24.560 0.826 17.361 1.00 71.03 N ATOM 783 CA LYS A 63 24.114 -0.401 18.010 1.00 63.34 C ATOM 784 C LYS A 63 25.178 -1.490 17.904 1.00 11.44 C ATOM 785 O LYS A 63 25.284 -2.355 18.775 1.00 54.14 O ATOM 786 CB LYS A 63 22.807 -0.889 17.382 1.00 53.14 C ATOM 787 CG LYS A 63 22.567 -2.379 17.555 1.00 41.31 C ATOM 788 CD LYS A 63 23.108 -3.171 16.377 1.00 62.32 C ATOM 789 CE LYS A 63 22.979 -4.669 16.606 1.00 34.32 C ATOM 790 NZ LYS A 63 23.230 -5.037 18.027 1.00 5.42 N ATOM 0 H LYS A 63 24.060 1.053 16.501 1.00 71.03 H new ATOM 0 HA LYS A 63 23.944 -0.183 19.064 1.00 63.34 H new ATOM 0 HB2 LYS A 63 21.975 -0.342 17.825 1.00 53.14 H new ATOM 0 HB3 LYS A 63 22.814 -0.652 16.318 1.00 53.14 H new ATOM 0 HG2 LYS A 63 23.043 -2.721 18.474 1.00 41.31 H new ATOM 0 HG3 LYS A 63 21.498 -2.567 17.661 1.00 41.31 H new ATOM 0 HD2 LYS A 63 22.569 -2.893 15.472 1.00 62.32 H new ATOM 0 HD3 LYS A 63 24.155 -2.915 16.216 1.00 62.32 H new ATOM 0 HE2 LYS A 63 21.980 -4.996 16.317 1.00 34.32 H new ATOM 0 HE3 LYS A 63 23.685 -5.197 15.964 1.00 34.32 H new ATOM 0 HZ1 LYS A 63 23.566 -6.020 18.077 1.00 5.42 H new ATOM 0 HZ2 LYS A 63 23.951 -4.403 18.428 1.00 5.42 H new ATOM 0 HZ3 LYS A 63 22.348 -4.945 18.570 1.00 5.42 H new ATOM 804 N LEU A 64 25.965 -1.440 16.835 1.00 14.12 N ATOM 805 CA LEU A 64 27.022 -2.421 16.617 1.00 30.00 C ATOM 806 C LEU A 64 27.902 -2.557 17.855 1.00 24.11 C ATOM 807 O LEU A 64 28.379 -3.646 18.173 1.00 2.30 O ATOM 808 CB LEU A 64 27.875 -2.021 15.412 1.00 61.21 C ATOM 809 CG LEU A 64 27.586 -2.766 14.108 1.00 21.12 C ATOM 810 CD1 LEU A 64 26.918 -1.842 13.102 1.00 1.31 C ATOM 811 CD2 LEU A 64 28.868 -3.348 13.531 1.00 22.21 C ATOM 0 H LEU A 64 25.891 -0.731 16.106 1.00 14.12 H new ATOM 0 HA LEU A 64 26.554 -3.385 16.419 1.00 30.00 H new ATOM 0 HB2 LEU A 64 27.740 -0.954 15.235 1.00 61.21 H new ATOM 0 HB3 LEU A 64 28.924 -2.172 15.668 1.00 61.21 H new ATOM 0 HG LEU A 64 26.903 -3.587 14.325 1.00 21.12 H new ATOM 0 HD11 LEU A 64 26.720 -2.390 12.181 1.00 1.31 H new ATOM 0 HD12 LEU A 64 25.979 -1.474 13.514 1.00 1.31 H new ATOM 0 HD13 LEU A 64 27.576 -0.999 12.889 1.00 1.31 H new ATOM 0 HD21 LEU A 64 28.643 -3.875 12.603 1.00 22.21 H new ATOM 0 HD22 LEU A 64 29.575 -2.543 13.329 1.00 22.21 H new ATOM 0 HD23 LEU A 64 29.306 -4.044 14.246 1.00 22.21 H new ATOM 823 N ASN A 65 28.112 -1.444 18.551 1.00 32.42 N ATOM 824 CA ASN A 65 28.934 -1.440 19.756 1.00 13.10 C ATOM 825 C ASN A 65 28.356 -2.377 20.812 1.00 61.40 C ATOM 826 O ASN A 65 29.095 -2.995 21.579 1.00 72.41 O ATOM 827 CB ASN A 65 29.040 -0.022 20.320 1.00 2.34 C ATOM 828 CG ASN A 65 30.248 0.724 19.786 1.00 54.12 C ATOM 829 OD1 ASN A 65 31.359 0.575 20.294 1.00 33.35 O ATOM 830 ND2 ASN A 65 30.034 1.533 18.755 1.00 41.14 N ATOM 0 H ASN A 65 27.725 -0.534 18.301 1.00 32.42 H new ATOM 0 HA ASN A 65 29.930 -1.794 19.488 1.00 13.10 H new ATOM 0 HB2 ASN A 65 28.135 0.533 20.073 1.00 2.34 H new ATOM 0 HB3 ASN A 65 29.097 -0.070 21.407 1.00 2.34 H new ATOM 0 HD21 ASN A 65 30.808 2.062 18.352 1.00 41.14 H new ATOM 0 HD22 ASN A 65 29.096 1.626 18.366 1.00 41.14 H new ATOM 837 N ASP A 66 27.032 -2.478 20.845 1.00 70.43 N ATOM 838 CA ASP A 66 26.355 -3.342 21.805 1.00 15.21 C ATOM 839 C ASP A 66 26.768 -4.798 21.613 1.00 1.42 C ATOM 840 O ASP A 66 27.208 -5.458 22.555 1.00 51.22 O ATOM 841 CB ASP A 66 24.838 -3.207 21.663 1.00 14.43 C ATOM 842 CG ASP A 66 24.151 -2.963 22.993 1.00 43.01 C ATOM 843 OD1 ASP A 66 24.353 -3.772 23.922 1.00 23.55 O ATOM 844 OD2 ASP A 66 23.413 -1.962 23.104 1.00 32.43 O ATOM 0 H ASP A 66 26.406 -1.972 20.218 1.00 70.43 H new ATOM 0 HA ASP A 66 26.648 -3.029 22.807 1.00 15.21 H new ATOM 0 HB2 ASP A 66 24.611 -2.385 20.984 1.00 14.43 H new ATOM 0 HB3 ASP A 66 24.436 -4.114 21.211 1.00 14.43 H new ATOM 849 N TYR A 67 26.623 -5.292 20.389 1.00 41.22 N ATOM 850 CA TYR A 67 26.978 -6.671 20.074 1.00 2.51 C ATOM 851 C TYR A 67 28.492 -6.859 20.083 1.00 41.34 C ATOM 852 O TYR A 67 28.992 -7.947 20.368 1.00 4.12 O ATOM 853 CB TYR A 67 26.411 -7.066 18.710 1.00 64.53 C ATOM 854 CG TYR A 67 27.457 -7.148 17.620 1.00 32.13 C ATOM 855 CD1 TYR A 67 28.188 -8.312 17.418 1.00 71.30 C ATOM 856 CD2 TYR A 67 27.714 -6.061 16.794 1.00 22.12 C ATOM 857 CE1 TYR A 67 29.145 -8.391 16.424 1.00 35.44 C ATOM 858 CE2 TYR A 67 28.668 -6.132 15.797 1.00 12.33 C ATOM 859 CZ TYR A 67 29.380 -7.299 15.616 1.00 4.35 C ATOM 860 OH TYR A 67 30.332 -7.372 14.625 1.00 22.54 O ATOM 0 H TYR A 67 26.262 -4.758 19.598 1.00 41.22 H new ATOM 0 HA TYR A 67 26.546 -7.315 20.840 1.00 2.51 H new ATOM 0 HB2 TYR A 67 25.914 -8.032 18.798 1.00 64.53 H new ATOM 0 HB3 TYR A 67 25.650 -6.342 18.418 1.00 64.53 H new ATOM 0 HD1 TYR A 67 28.005 -9.170 18.048 1.00 71.30 H new ATOM 0 HD2 TYR A 67 27.159 -5.145 16.933 1.00 22.12 H new ATOM 0 HE1 TYR A 67 29.706 -9.303 16.281 1.00 35.44 H new ATOM 0 HE2 TYR A 67 28.855 -5.278 15.163 1.00 12.33 H new ATOM 0 HH TYR A 67 30.929 -6.598 14.688 1.00 22.54 H new ATOM 870 N TYR A 68 29.216 -5.790 19.768 1.00 70.32 N ATOM 871 CA TYR A 68 30.673 -5.836 19.737 1.00 70.41 C ATOM 872 C TYR A 68 31.225 -6.474 21.008 1.00 20.12 C ATOM 873 O TYR A 68 32.193 -7.233 20.966 1.00 40.34 O ATOM 874 CB TYR A 68 31.245 -4.428 19.570 1.00 42.33 C ATOM 875 CG TYR A 68 31.975 -4.222 18.261 1.00 12.14 C ATOM 876 CD1 TYR A 68 31.288 -4.214 17.054 1.00 52.51 C ATOM 877 CD2 TYR A 68 33.351 -4.035 18.233 1.00 4.22 C ATOM 878 CE1 TYR A 68 31.951 -4.027 15.856 1.00 15.43 C ATOM 879 CE2 TYR A 68 34.022 -3.846 17.040 1.00 2.44 C ATOM 880 CZ TYR A 68 33.318 -3.843 15.855 1.00 55.13 C ATOM 881 OH TYR A 68 33.981 -3.655 14.664 1.00 2.10 O ATOM 0 H TYR A 68 28.818 -4.882 19.531 1.00 70.32 H new ATOM 0 HA TYR A 68 30.974 -6.446 18.886 1.00 70.41 H new ATOM 0 HB2 TYR A 68 30.433 -3.704 19.641 1.00 42.33 H new ATOM 0 HB3 TYR A 68 31.929 -4.223 20.394 1.00 42.33 H new ATOM 0 HD1 TYR A 68 30.217 -4.356 17.052 1.00 52.51 H new ATOM 0 HD2 TYR A 68 33.906 -4.037 19.160 1.00 4.22 H new ATOM 0 HE1 TYR A 68 31.402 -4.025 14.926 1.00 15.43 H new ATOM 0 HE2 TYR A 68 35.092 -3.701 17.036 1.00 2.44 H new ATOM 0 HH TYR A 68 34.939 -3.539 14.837 1.00 2.10 H new ATOM 891 N ALA A 69 30.601 -6.160 22.139 1.00 72.32 N ATOM 892 CA ALA A 69 31.027 -6.704 23.423 1.00 55.34 C ATOM 893 C ALA A 69 31.078 -8.227 23.384 1.00 62.32 C ATOM 894 O ALA A 69 31.893 -8.849 24.068 1.00 54.32 O ATOM 895 CB ALA A 69 30.095 -6.233 24.530 1.00 60.32 C ATOM 0 H ALA A 69 29.799 -5.532 22.192 1.00 72.32 H new ATOM 0 HA ALA A 69 32.033 -6.338 23.629 1.00 55.34 H new ATOM 0 HB1 ALA A 69 30.424 -6.646 25.483 1.00 60.32 H new ATOM 0 HB2 ALA A 69 30.112 -5.144 24.581 1.00 60.32 H new ATOM 0 HB3 ALA A 69 29.080 -6.571 24.319 1.00 60.32 H new ATOM 901 N LEU A 70 30.204 -8.824 22.581 1.00 42.12 N ATOM 902 CA LEU A 70 30.150 -10.276 22.453 1.00 33.14 C ATOM 903 C LEU A 70 31.456 -10.822 21.886 1.00 72.25 C ATOM 904 O LEU A 70 31.714 -12.025 21.940 1.00 45.24 O ATOM 905 CB LEU A 70 28.980 -10.686 21.557 1.00 51.41 C ATOM 906 CG LEU A 70 28.802 -12.187 21.329 1.00 21.14 C ATOM 907 CD1 LEU A 70 27.340 -12.579 21.471 1.00 74.00 C ATOM 908 CD2 LEU A 70 29.333 -12.586 19.960 1.00 52.40 C ATOM 0 H LEU A 70 29.523 -8.325 22.009 1.00 42.12 H new ATOM 0 HA LEU A 70 30.003 -10.698 23.447 1.00 33.14 H new ATOM 0 HB2 LEU A 70 28.061 -10.294 21.992 1.00 51.41 H new ATOM 0 HB3 LEU A 70 29.105 -10.204 20.587 1.00 51.41 H new ATOM 0 HG LEU A 70 29.375 -12.720 22.088 1.00 21.14 H new ATOM 0 HD11 LEU A 70 27.233 -13.651 21.305 1.00 74.00 H new ATOM 0 HD12 LEU A 70 26.992 -12.330 22.474 1.00 74.00 H new ATOM 0 HD13 LEU A 70 26.745 -12.037 20.736 1.00 74.00 H new ATOM 0 HD21 LEU A 70 29.198 -13.658 19.816 1.00 52.40 H new ATOM 0 HD22 LEU A 70 28.789 -12.044 19.187 1.00 52.40 H new ATOM 0 HD23 LEU A 70 30.393 -12.342 19.896 1.00 52.40 H new ATOM 920 N LYS A 71 32.278 -9.930 21.343 1.00 74.44 N ATOM 921 CA LYS A 71 33.559 -10.321 20.768 1.00 43.14 C ATOM 922 C LYS A 71 34.308 -11.267 21.700 1.00 24.32 C ATOM 923 O LYS A 71 35.038 -12.151 21.249 1.00 33.22 O ATOM 924 CB LYS A 71 34.414 -9.083 20.486 1.00 12.22 C ATOM 925 CG LYS A 71 34.811 -8.320 21.738 1.00 34.35 C ATOM 926 CD LYS A 71 35.750 -7.170 21.417 1.00 54.23 C ATOM 927 CE LYS A 71 35.057 -5.825 21.573 1.00 51.32 C ATOM 928 NZ LYS A 71 34.632 -5.580 22.979 1.00 54.43 N ATOM 0 H LYS A 71 32.079 -8.931 21.289 1.00 74.44 H new ATOM 0 HA LYS A 71 33.364 -10.842 19.831 1.00 43.14 H new ATOM 0 HB2 LYS A 71 35.316 -9.388 19.955 1.00 12.22 H new ATOM 0 HB3 LYS A 71 33.864 -8.415 19.823 1.00 12.22 H new ATOM 0 HG2 LYS A 71 33.917 -7.935 22.229 1.00 34.35 H new ATOM 0 HG3 LYS A 71 35.293 -8.999 22.441 1.00 34.35 H new ATOM 0 HD2 LYS A 71 36.617 -7.212 22.076 1.00 54.23 H new ATOM 0 HD3 LYS A 71 36.119 -7.274 20.397 1.00 54.23 H new ATOM 0 HE2 LYS A 71 35.731 -5.030 21.254 1.00 51.32 H new ATOM 0 HE3 LYS A 71 34.186 -5.787 20.918 1.00 51.32 H new ATOM 0 HZ1 LYS A 71 33.661 -5.208 22.988 1.00 54.43 H new ATOM 0 HZ2 LYS A 71 34.666 -6.472 23.512 1.00 54.43 H new ATOM 0 HZ3 LYS A 71 35.272 -4.889 23.420 1.00 54.43 H new ATOM 942 N HIS A 72 34.123 -11.077 23.003 1.00 71.23 N ATOM 943 CA HIS A 72 34.780 -11.916 23.999 1.00 51.10 C ATOM 944 C HIS A 72 34.566 -13.395 23.690 1.00 3.33 C ATOM 945 O HIS A 72 35.482 -14.206 23.826 1.00 70.31 O ATOM 946 CB HIS A 72 34.251 -11.593 25.397 1.00 62.12 C ATOM 947 CG HIS A 72 35.328 -11.470 26.431 1.00 72.32 C ATOM 948 ND1 HIS A 72 35.734 -12.523 27.223 1.00 33.24 N ATOM 949 CD2 HIS A 72 36.085 -10.411 26.799 1.00 41.52 C ATOM 950 CE1 HIS A 72 36.693 -12.116 28.035 1.00 12.14 C ATOM 951 NE2 HIS A 72 36.925 -10.838 27.798 1.00 42.44 N ATOM 0 H HIS A 72 33.524 -10.350 23.393 1.00 71.23 H new ATOM 0 HA HIS A 72 35.849 -11.707 23.966 1.00 51.10 H new ATOM 0 HB2 HIS A 72 33.689 -10.660 25.357 1.00 62.12 H new ATOM 0 HB3 HIS A 72 33.553 -12.373 25.702 1.00 62.12 H new ATOM 0 HD2 HIS A 72 36.038 -9.415 26.384 1.00 41.52 H new ATOM 0 HE1 HIS A 72 37.201 -12.725 28.768 1.00 12.14 H new ATOM 0 HE2 HIS A 72 37.616 -10.262 28.279 1.00 42.44 H new ATOM 959 N VAL A 73 33.351 -13.738 23.275 1.00 21.23 N ATOM 960 CA VAL A 73 33.017 -15.119 22.947 1.00 22.01 C ATOM 961 C VAL A 73 33.178 -15.383 21.454 1.00 31.43 C ATOM 962 O VAL A 73 32.393 -14.917 20.628 1.00 64.10 O ATOM 963 CB VAL A 73 31.575 -15.463 23.366 1.00 43.52 C ATOM 964 CG1 VAL A 73 31.215 -16.875 22.932 1.00 62.23 C ATOM 965 CG2 VAL A 73 31.404 -15.298 24.868 1.00 14.43 C ATOM 0 H VAL A 73 32.582 -13.079 23.158 1.00 21.23 H new ATOM 0 HA VAL A 73 33.709 -15.753 23.502 1.00 22.01 H new ATOM 0 HB VAL A 73 30.895 -14.772 22.868 1.00 43.52 H new ATOM 0 HG11 VAL A 73 30.193 -17.100 23.237 1.00 62.23 H new ATOM 0 HG12 VAL A 73 31.296 -16.954 21.848 1.00 62.23 H new ATOM 0 HG13 VAL A 73 31.897 -17.585 23.400 1.00 62.23 H new ATOM 0 HG21 VAL A 73 30.380 -15.545 25.147 1.00 14.43 H new ATOM 0 HG22 VAL A 73 32.092 -15.964 25.388 1.00 14.43 H new ATOM 0 HG23 VAL A 73 31.617 -14.266 25.147 1.00 14.43 H new ATOM 975 N PRO A 74 34.219 -16.150 21.098 1.00 30.51 N ATOM 976 CA PRO A 74 34.507 -16.496 19.703 1.00 40.32 C ATOM 977 C PRO A 74 33.475 -17.454 19.118 1.00 41.12 C ATOM 978 O PRO A 74 33.227 -17.455 17.912 1.00 54.31 O ATOM 979 CB PRO A 74 35.879 -17.170 19.780 1.00 2.22 C ATOM 980 CG PRO A 74 35.960 -17.706 21.168 1.00 42.31 C ATOM 981 CD PRO A 74 35.195 -16.740 22.030 1.00 73.30 C ATOM 0 HA PRO A 74 34.483 -15.621 19.053 1.00 40.32 H new ATOM 0 HB2 PRO A 74 35.971 -17.967 19.042 1.00 2.22 H new ATOM 0 HB3 PRO A 74 36.681 -16.459 19.583 1.00 2.22 H new ATOM 0 HG2 PRO A 74 35.530 -18.706 21.226 1.00 42.31 H new ATOM 0 HG3 PRO A 74 36.996 -17.785 21.496 1.00 42.31 H new ATOM 0 HD2 PRO A 74 34.703 -17.246 22.861 1.00 73.30 H new ATOM 0 HD3 PRO A 74 35.848 -15.981 22.461 1.00 73.30 H new ATOM 989 N LYS A 75 32.876 -18.269 19.979 1.00 10.23 N ATOM 990 CA LYS A 75 31.869 -19.232 19.549 1.00 11.51 C ATOM 991 C LYS A 75 30.708 -18.530 18.851 1.00 45.41 C ATOM 992 O LYS A 75 30.231 -18.983 17.810 1.00 4.40 O ATOM 993 CB LYS A 75 31.350 -20.028 20.748 1.00 31.03 C ATOM 994 CG LYS A 75 32.370 -20.995 21.324 1.00 60.24 C ATOM 995 CD LYS A 75 32.522 -22.230 20.451 1.00 41.32 C ATOM 996 CE LYS A 75 33.933 -22.349 19.894 1.00 13.45 C ATOM 997 NZ LYS A 75 33.944 -22.961 18.537 1.00 32.11 N ATOM 0 H LYS A 75 33.071 -18.282 20.980 1.00 10.23 H new ATOM 0 HA LYS A 75 32.336 -19.916 18.841 1.00 11.51 H new ATOM 0 HB2 LYS A 75 31.040 -19.333 21.528 1.00 31.03 H new ATOM 0 HB3 LYS A 75 30.463 -20.585 20.447 1.00 31.03 H new ATOM 0 HG2 LYS A 75 33.334 -20.495 21.419 1.00 60.24 H new ATOM 0 HG3 LYS A 75 32.065 -21.293 22.327 1.00 60.24 H new ATOM 0 HD2 LYS A 75 32.283 -23.120 21.033 1.00 41.32 H new ATOM 0 HD3 LYS A 75 31.808 -22.186 19.629 1.00 41.32 H new ATOM 0 HE2 LYS A 75 34.391 -21.361 19.850 1.00 13.45 H new ATOM 0 HE3 LYS A 75 34.540 -22.952 20.569 1.00 13.45 H new ATOM 0 HZ1 LYS A 75 34.923 -23.024 18.193 1.00 32.11 H new ATOM 0 HZ2 LYS A 75 33.531 -23.914 18.583 1.00 32.11 H new ATOM 0 HZ3 LYS A 75 33.386 -22.372 17.886 1.00 32.11 H new ATOM 1011 N CYS A 76 30.259 -17.421 19.429 1.00 4.23 N ATOM 1012 CA CYS A 76 29.156 -16.655 18.863 1.00 73.23 C ATOM 1013 C CYS A 76 29.675 -15.535 17.966 1.00 72.03 C ATOM 1014 O CYS A 76 29.057 -15.199 16.955 1.00 5.11 O ATOM 1015 CB CYS A 76 28.288 -16.069 19.978 1.00 20.43 C ATOM 1016 SG CYS A 76 26.522 -16.498 19.849 1.00 1.25 S ATOM 0 H CYS A 76 30.643 -17.033 20.290 1.00 4.23 H new ATOM 0 HA CYS A 76 28.551 -17.331 18.258 1.00 73.23 H new ATOM 0 HB2 CYS A 76 28.666 -16.417 20.939 1.00 20.43 H new ATOM 0 HB3 CYS A 76 28.389 -14.984 19.970 1.00 20.43 H new ATOM 1021 N TRP A 77 30.812 -14.962 18.343 1.00 60.22 N ATOM 1022 CA TRP A 77 31.415 -13.880 17.573 1.00 55.05 C ATOM 1023 C TRP A 77 31.607 -14.289 16.117 1.00 74.55 C ATOM 1024 O TRP A 77 31.112 -13.627 15.205 1.00 11.54 O ATOM 1025 CB TRP A 77 32.758 -13.478 18.184 1.00 52.03 C ATOM 1026 CG TRP A 77 33.702 -12.867 17.193 1.00 61.11 C ATOM 1027 CD1 TRP A 77 34.978 -13.271 16.919 1.00 34.44 C ATOM 1028 CD2 TRP A 77 33.446 -11.741 16.346 1.00 34.42 C ATOM 1029 NE1 TRP A 77 35.530 -12.465 15.954 1.00 55.34 N ATOM 1030 CE2 TRP A 77 34.610 -11.519 15.585 1.00 73.02 C ATOM 1031 CE3 TRP A 77 32.346 -10.901 16.156 1.00 75.05 C ATOM 1032 CZ2 TRP A 77 34.703 -10.491 14.651 1.00 54.15 C ATOM 1033 CZ3 TRP A 77 32.439 -9.881 15.228 1.00 5.11 C ATOM 1034 CH2 TRP A 77 33.611 -9.683 14.484 1.00 35.35 C ATOM 0 H TRP A 77 31.335 -15.228 19.177 1.00 60.22 H new ATOM 0 HA TRP A 77 30.739 -13.025 17.605 1.00 55.05 H new ATOM 0 HB2 TRP A 77 32.583 -12.769 18.993 1.00 52.03 H new ATOM 0 HB3 TRP A 77 33.226 -14.358 18.626 1.00 52.03 H new ATOM 0 HD1 TRP A 77 35.479 -14.103 17.392 1.00 34.44 H new ATOM 0 HE1 TRP A 77 36.472 -12.556 15.574 1.00 55.34 H new ATOM 0 HE3 TRP A 77 31.439 -11.046 16.724 1.00 75.05 H new ATOM 0 HZ2 TRP A 77 35.605 -10.336 14.078 1.00 54.15 H new ATOM 0 HZ3 TRP A 77 31.595 -9.225 15.073 1.00 5.11 H new ATOM 0 HH2 TRP A 77 33.653 -8.878 13.766 1.00 35.35 H new ATOM 1045 N ALA A 78 32.328 -15.386 15.905 1.00 53.43 N ATOM 1046 CA ALA A 78 32.583 -15.884 14.559 1.00 74.11 C ATOM 1047 C ALA A 78 31.297 -16.374 13.902 1.00 34.44 C ATOM 1048 O ALA A 78 31.260 -16.625 12.698 1.00 12.01 O ATOM 1049 CB ALA A 78 33.617 -16.999 14.596 1.00 31.43 C ATOM 0 H ALA A 78 32.745 -15.946 16.648 1.00 53.43 H new ATOM 0 HA ALA A 78 32.974 -15.060 13.962 1.00 74.11 H new ATOM 0 HB1 ALA A 78 33.798 -17.361 13.584 1.00 31.43 H new ATOM 0 HB2 ALA A 78 34.548 -16.618 15.017 1.00 31.43 H new ATOM 0 HB3 ALA A 78 33.248 -17.817 15.214 1.00 31.43 H new ATOM 1055 N ALA A 79 30.244 -16.510 14.702 1.00 13.21 N ATOM 1056 CA ALA A 79 28.956 -16.969 14.198 1.00 75.12 C ATOM 1057 C ALA A 79 28.243 -15.865 13.424 1.00 4.43 C ATOM 1058 O ALA A 79 27.510 -16.134 12.472 1.00 23.34 O ATOM 1059 CB ALA A 79 28.084 -17.459 15.345 1.00 61.02 C ATOM 0 H ALA A 79 30.258 -16.309 15.702 1.00 13.21 H new ATOM 0 HA ALA A 79 29.137 -17.798 13.514 1.00 75.12 H new ATOM 0 HB1 ALA A 79 27.125 -17.799 14.954 1.00 61.02 H new ATOM 0 HB2 ALA A 79 28.582 -18.285 15.853 1.00 61.02 H new ATOM 0 HB3 ALA A 79 27.920 -16.645 16.051 1.00 61.02 H new ATOM 1065 N ILE A 80 28.463 -14.622 13.839 1.00 2.34 N ATOM 1066 CA ILE A 80 27.842 -13.477 13.185 1.00 63.14 C ATOM 1067 C ILE A 80 28.813 -12.801 12.222 1.00 10.03 C ATOM 1068 O ILE A 80 28.561 -11.694 11.748 1.00 2.54 O ATOM 1069 CB ILE A 80 27.349 -12.440 14.211 1.00 21.42 C ATOM 1070 CG1 ILE A 80 26.273 -11.548 13.590 1.00 11.53 C ATOM 1071 CG2 ILE A 80 28.513 -11.602 14.718 1.00 11.12 C ATOM 1072 CD1 ILE A 80 25.859 -10.394 14.477 1.00 42.10 C ATOM 0 H ILE A 80 29.067 -14.382 14.625 1.00 2.34 H new ATOM 0 HA ILE A 80 26.986 -13.858 12.628 1.00 63.14 H new ATOM 0 HB ILE A 80 26.911 -12.968 15.058 1.00 21.42 H new ATOM 0 HG12 ILE A 80 26.641 -11.154 12.643 1.00 11.53 H new ATOM 0 HG13 ILE A 80 25.396 -12.154 13.363 1.00 11.53 H new ATOM 0 HG21 ILE A 80 28.149 -10.874 15.442 1.00 11.12 H new ATOM 0 HG22 ILE A 80 29.248 -12.251 15.194 1.00 11.12 H new ATOM 0 HG23 ILE A 80 28.977 -11.080 13.881 1.00 11.12 H new ATOM 0 HD11 ILE A 80 25.093 -9.804 13.973 1.00 42.10 H new ATOM 0 HD12 ILE A 80 25.460 -10.781 15.415 1.00 42.10 H new ATOM 0 HD13 ILE A 80 26.725 -9.765 14.683 1.00 42.10 H new ATOM 1084 N GLN A 81 29.922 -13.476 11.937 1.00 33.23 N ATOM 1085 CA GLN A 81 30.930 -12.941 11.030 1.00 12.41 C ATOM 1086 C GLN A 81 30.335 -12.674 9.651 1.00 13.35 C ATOM 1087 O GLN A 81 30.325 -11.545 9.161 1.00 51.33 O ATOM 1088 CB GLN A 81 32.107 -13.911 10.912 1.00 54.44 C ATOM 1089 CG GLN A 81 33.429 -13.323 11.378 1.00 51.25 C ATOM 1090 CD GLN A 81 34.380 -14.376 11.911 1.00 41.23 C ATOM 1091 OE1 GLN A 81 34.549 -15.438 11.310 1.00 11.44 O ATOM 1092 NE2 GLN A 81 35.008 -14.087 13.044 1.00 4.14 N ATOM 0 H GLN A 81 30.145 -14.394 12.321 1.00 33.23 H new ATOM 0 HA GLN A 81 31.287 -11.996 11.440 1.00 12.41 H new ATOM 0 HB2 GLN A 81 31.890 -14.805 11.497 1.00 54.44 H new ATOM 0 HB3 GLN A 81 32.205 -14.226 9.873 1.00 54.44 H new ATOM 0 HG2 GLN A 81 33.902 -12.799 10.548 1.00 51.25 H new ATOM 0 HG3 GLN A 81 33.239 -12.583 12.156 1.00 51.25 H new ATOM 0 HE21 GLN A 81 34.838 -13.195 13.508 1.00 4.14 H new ATOM 0 HE22 GLN A 81 35.661 -14.757 13.450 1.00 4.14 H new ATOM 1101 N PRO A 82 29.826 -13.736 9.010 1.00 65.40 N ATOM 1102 CA PRO A 82 29.220 -13.642 7.679 1.00 51.12 C ATOM 1103 C PRO A 82 27.891 -12.895 7.699 1.00 35.22 C ATOM 1104 O PRO A 82 27.528 -12.226 6.731 1.00 31.42 O ATOM 1105 CB PRO A 82 29.006 -15.105 7.282 1.00 14.30 C ATOM 1106 CG PRO A 82 28.902 -15.837 8.575 1.00 14.34 C ATOM 1107 CD PRO A 82 29.804 -15.112 9.535 1.00 3.01 C ATOM 0 HA PRO A 82 29.848 -13.085 6.984 1.00 51.12 H new ATOM 0 HB2 PRO A 82 28.102 -15.225 6.685 1.00 14.30 H new ATOM 0 HB3 PRO A 82 29.836 -15.478 6.682 1.00 14.30 H new ATOM 0 HG2 PRO A 82 27.874 -15.846 8.937 1.00 14.34 H new ATOM 0 HG3 PRO A 82 29.209 -16.877 8.461 1.00 14.34 H new ATOM 0 HD2 PRO A 82 29.418 -15.147 10.554 1.00 3.01 H new ATOM 0 HD3 PRO A 82 30.802 -15.550 9.557 1.00 3.01 H new ATOM 1115 N PHE A 83 27.168 -13.013 8.808 1.00 32.21 N ATOM 1116 CA PHE A 83 25.878 -12.349 8.954 1.00 33.41 C ATOM 1117 C PHE A 83 26.061 -10.874 9.297 1.00 11.11 C ATOM 1118 O PHE A 83 25.135 -10.073 9.159 1.00 3.04 O ATOM 1119 CB PHE A 83 25.046 -13.037 10.039 1.00 61.32 C ATOM 1120 CG PHE A 83 23.680 -12.438 10.217 1.00 23.31 C ATOM 1121 CD1 PHE A 83 22.918 -12.079 9.117 1.00 31.13 C ATOM 1122 CD2 PHE A 83 23.159 -12.235 11.484 1.00 34.05 C ATOM 1123 CE1 PHE A 83 21.661 -11.527 9.279 1.00 63.02 C ATOM 1124 CE2 PHE A 83 21.902 -11.684 11.652 1.00 2.32 C ATOM 1125 CZ PHE A 83 21.152 -11.330 10.548 1.00 62.23 C ATOM 0 H PHE A 83 27.454 -13.562 9.619 1.00 32.21 H new ATOM 0 HA PHE A 83 25.352 -12.420 8.002 1.00 33.41 H new ATOM 0 HB2 PHE A 83 24.941 -14.093 9.790 1.00 61.32 H new ATOM 0 HB3 PHE A 83 25.583 -12.984 10.986 1.00 61.32 H new ATOM 0 HD1 PHE A 83 23.310 -12.232 8.122 1.00 31.13 H new ATOM 0 HD2 PHE A 83 23.741 -12.510 12.351 1.00 34.05 H new ATOM 0 HE1 PHE A 83 21.077 -11.250 8.414 1.00 63.02 H new ATOM 0 HE2 PHE A 83 21.507 -11.531 12.646 1.00 2.32 H new ATOM 0 HZ PHE A 83 20.170 -10.900 10.676 1.00 62.23 H new ATOM 1135 N LEU A 84 27.261 -10.522 9.745 1.00 50.42 N ATOM 1136 CA LEU A 84 27.567 -9.142 10.109 1.00 63.53 C ATOM 1137 C LEU A 84 27.245 -8.192 8.960 1.00 3.10 C ATOM 1138 O LEU A 84 27.055 -6.993 9.167 1.00 71.02 O ATOM 1139 CB LEU A 84 29.041 -9.012 10.496 1.00 43.20 C ATOM 1140 CG LEU A 84 29.331 -8.239 11.783 1.00 2.11 C ATOM 1141 CD1 LEU A 84 29.120 -6.748 11.570 1.00 72.05 C ATOM 1142 CD2 LEU A 84 28.455 -8.746 12.919 1.00 73.32 C ATOM 0 H LEU A 84 28.038 -11.172 9.865 1.00 50.42 H new ATOM 0 HA LEU A 84 26.948 -8.871 10.964 1.00 63.53 H new ATOM 0 HB2 LEU A 84 29.460 -10.013 10.595 1.00 43.20 H new ATOM 0 HB3 LEU A 84 29.570 -8.525 9.676 1.00 43.20 H new ATOM 0 HG LEU A 84 30.374 -8.402 12.054 1.00 2.11 H new ATOM 0 HD11 LEU A 84 29.331 -6.215 12.497 1.00 72.05 H new ATOM 0 HD12 LEU A 84 29.790 -6.394 10.787 1.00 72.05 H new ATOM 0 HD13 LEU A 84 28.087 -6.565 11.274 1.00 72.05 H new ATOM 0 HD21 LEU A 84 28.675 -8.184 13.827 1.00 73.32 H new ATOM 0 HD22 LEU A 84 27.405 -8.614 12.656 1.00 73.32 H new ATOM 0 HD23 LEU A 84 28.656 -9.804 13.089 1.00 73.32 H new ATOM 1154 N CYS A 85 27.184 -8.735 7.749 1.00 71.21 N ATOM 1155 CA CYS A 85 26.883 -7.937 6.567 1.00 41.04 C ATOM 1156 C CYS A 85 25.400 -8.022 6.216 1.00 44.22 C ATOM 1157 O CYS A 85 24.786 -7.028 5.829 1.00 34.34 O ATOM 1158 CB CYS A 85 27.727 -8.407 5.380 1.00 32.00 C ATOM 1159 SG CYS A 85 29.480 -8.694 5.782 1.00 63.21 S ATOM 0 H CYS A 85 27.339 -9.725 7.560 1.00 71.21 H new ATOM 0 HA CYS A 85 27.127 -6.898 6.789 1.00 41.04 H new ATOM 0 HB2 CYS A 85 27.300 -9.329 4.987 1.00 32.00 H new ATOM 0 HB3 CYS A 85 27.664 -7.663 4.586 1.00 32.00 H new ATOM 1164 N ALA A 86 24.833 -9.216 6.354 1.00 52.41 N ATOM 1165 CA ALA A 86 23.423 -9.430 6.054 1.00 34.22 C ATOM 1166 C ALA A 86 22.547 -9.073 7.250 1.00 14.41 C ATOM 1167 O ALA A 86 21.336 -9.297 7.235 1.00 42.20 O ATOM 1168 CB ALA A 86 23.185 -10.874 5.637 1.00 45.13 C ATOM 0 H ALA A 86 25.328 -10.049 6.671 1.00 52.41 H new ATOM 0 HA ALA A 86 23.150 -8.774 5.227 1.00 34.22 H new ATOM 0 HB1 ALA A 86 22.128 -11.019 5.416 1.00 45.13 H new ATOM 0 HB2 ALA A 86 23.776 -11.098 4.749 1.00 45.13 H new ATOM 0 HB3 ALA A 86 23.481 -11.540 6.447 1.00 45.13 H new ATOM 1174 N VAL A 87 23.166 -8.516 8.286 1.00 10.21 N ATOM 1175 CA VAL A 87 22.442 -8.127 9.491 1.00 43.24 C ATOM 1176 C VAL A 87 22.342 -6.610 9.606 1.00 41.13 C ATOM 1177 O VAL A 87 21.336 -6.077 10.074 1.00 74.21 O ATOM 1178 CB VAL A 87 23.120 -8.683 10.757 1.00 62.01 C ATOM 1179 CG1 VAL A 87 24.457 -7.996 10.993 1.00 71.44 C ATOM 1180 CG2 VAL A 87 22.208 -8.521 11.964 1.00 62.34 C ATOM 0 H VAL A 87 24.167 -8.324 8.315 1.00 10.21 H new ATOM 0 HA VAL A 87 21.440 -8.549 9.409 1.00 43.24 H new ATOM 0 HB VAL A 87 23.306 -9.747 10.611 1.00 62.01 H new ATOM 0 HG11 VAL A 87 24.921 -8.402 11.892 1.00 71.44 H new ATOM 0 HG12 VAL A 87 25.111 -8.168 10.138 1.00 71.44 H new ATOM 0 HG13 VAL A 87 24.299 -6.925 11.119 1.00 71.44 H new ATOM 0 HG21 VAL A 87 22.703 -8.919 12.850 1.00 62.34 H new ATOM 0 HG22 VAL A 87 21.989 -7.464 12.115 1.00 62.34 H new ATOM 0 HG23 VAL A 87 21.278 -9.064 11.793 1.00 62.34 H new ATOM 1190 N PHE A 88 23.392 -5.919 9.175 1.00 41.30 N ATOM 1191 CA PHE A 88 23.423 -4.462 9.230 1.00 41.21 C ATOM 1192 C PHE A 88 23.365 -3.863 7.827 1.00 23.34 C ATOM 1193 O PHE A 88 22.699 -2.854 7.597 1.00 0.13 O ATOM 1194 CB PHE A 88 24.686 -3.984 9.949 1.00 65.12 C ATOM 1195 CG PHE A 88 24.884 -4.616 11.297 1.00 63.01 C ATOM 1196 CD1 PHE A 88 23.830 -4.719 12.190 1.00 74.54 C ATOM 1197 CD2 PHE A 88 26.125 -5.107 11.671 1.00 34.13 C ATOM 1198 CE1 PHE A 88 24.009 -5.300 13.431 1.00 43.20 C ATOM 1199 CE2 PHE A 88 26.310 -5.689 12.911 1.00 1.03 C ATOM 1200 CZ PHE A 88 25.251 -5.786 13.792 1.00 73.32 C ATOM 0 H PHE A 88 24.233 -6.344 8.784 1.00 41.30 H new ATOM 0 HA PHE A 88 22.548 -4.126 9.786 1.00 41.21 H new ATOM 0 HB2 PHE A 88 25.553 -4.199 9.325 1.00 65.12 H new ATOM 0 HB3 PHE A 88 24.639 -2.901 10.067 1.00 65.12 H new ATOM 0 HD1 PHE A 88 22.857 -4.341 11.913 1.00 74.54 H new ATOM 0 HD2 PHE A 88 26.957 -5.034 10.986 1.00 34.13 H new ATOM 0 HE1 PHE A 88 23.179 -5.374 14.118 1.00 43.20 H new ATOM 0 HE2 PHE A 88 27.282 -6.068 13.191 1.00 1.03 H new ATOM 0 HZ PHE A 88 25.393 -6.241 14.761 1.00 73.32 H new ATOM 1210 N LYS A 89 24.069 -4.493 6.893 1.00 50.14 N ATOM 1211 CA LYS A 89 24.099 -4.025 5.512 1.00 71.31 C ATOM 1212 C LYS A 89 23.410 -5.022 4.585 1.00 50.41 C ATOM 1213 O LYS A 89 24.053 -5.751 3.830 1.00 23.54 O ATOM 1214 CB LYS A 89 25.544 -3.805 5.058 1.00 55.43 C ATOM 1215 CG LYS A 89 26.242 -2.666 5.781 1.00 35.24 C ATOM 1216 CD LYS A 89 26.993 -3.161 7.005 1.00 24.34 C ATOM 1217 CE LYS A 89 26.936 -2.151 8.141 1.00 20.22 C ATOM 1218 NZ LYS A 89 27.335 -0.789 7.692 1.00 4.43 N ATOM 0 H LYS A 89 24.627 -5.329 7.067 1.00 50.14 H new ATOM 0 HA LYS A 89 23.561 -3.078 5.463 1.00 71.31 H new ATOM 0 HB2 LYS A 89 26.109 -4.724 5.214 1.00 55.43 H new ATOM 0 HB3 LYS A 89 25.553 -3.604 3.987 1.00 55.43 H new ATOM 0 HG2 LYS A 89 26.937 -2.174 5.101 1.00 35.24 H new ATOM 0 HG3 LYS A 89 25.507 -1.919 6.081 1.00 35.24 H new ATOM 0 HD2 LYS A 89 26.566 -4.108 7.337 1.00 24.34 H new ATOM 0 HD3 LYS A 89 28.033 -3.355 6.741 1.00 24.34 H new ATOM 0 HE2 LYS A 89 25.925 -2.118 8.547 1.00 20.22 H new ATOM 0 HE3 LYS A 89 27.593 -2.475 8.948 1.00 20.22 H new ATOM 0 HZ1 LYS A 89 27.562 -0.203 8.521 1.00 4.43 H new ATOM 0 HZ2 LYS A 89 28.170 -0.857 7.076 1.00 4.43 H new ATOM 0 HZ3 LYS A 89 26.551 -0.354 7.165 1.00 4.43 H new ATOM 1232 N PRO A 90 22.070 -5.054 4.640 1.00 42.52 N ATOM 1233 CA PRO A 90 21.265 -5.955 3.810 1.00 42.21 C ATOM 1234 C PRO A 90 21.293 -5.566 2.336 1.00 43.41 C ATOM 1235 O PRO A 90 21.099 -4.401 1.986 1.00 34.25 O ATOM 1236 CB PRO A 90 19.853 -5.794 4.379 1.00 61.14 C ATOM 1237 CG PRO A 90 19.845 -4.438 4.996 1.00 63.24 C ATOM 1238 CD PRO A 90 21.238 -4.212 5.516 1.00 51.23 C ATOM 0 HA PRO A 90 21.638 -6.979 3.840 1.00 42.21 H new ATOM 0 HB2 PRO A 90 19.099 -5.877 3.596 1.00 61.14 H new ATOM 0 HB3 PRO A 90 19.633 -6.566 5.117 1.00 61.14 H new ATOM 0 HG2 PRO A 90 19.574 -3.678 4.264 1.00 63.24 H new ATOM 0 HG3 PRO A 90 19.113 -4.380 5.802 1.00 63.24 H new ATOM 0 HD2 PRO A 90 21.524 -3.162 5.454 1.00 51.23 H new ATOM 0 HD3 PRO A 90 21.329 -4.507 6.561 1.00 51.23 H new ATOM 1246 N LYS A 91 21.536 -6.547 1.474 1.00 23.31 N ATOM 1247 CA LYS A 91 21.588 -6.309 0.037 1.00 43.34 C ATOM 1248 C LYS A 91 20.365 -5.525 -0.430 1.00 22.45 C ATOM 1249 O LYS A 91 19.269 -6.075 -0.541 1.00 50.04 O ATOM 1250 CB LYS A 91 21.675 -7.637 -0.719 1.00 12.22 C ATOM 1251 CG LYS A 91 21.768 -7.474 -2.226 1.00 63.31 C ATOM 1252 CD LYS A 91 22.575 -8.595 -2.859 1.00 25.42 C ATOM 1253 CE LYS A 91 22.089 -8.906 -4.266 1.00 65.51 C ATOM 1254 NZ LYS A 91 22.738 -10.127 -4.820 1.00 23.22 N ATOM 0 H LYS A 91 21.700 -7.516 1.746 1.00 23.31 H new ATOM 0 HA LYS A 91 22.479 -5.718 -0.175 1.00 43.34 H new ATOM 0 HB2 LYS A 91 22.546 -8.189 -0.367 1.00 12.22 H new ATOM 0 HB3 LYS A 91 20.798 -8.239 -0.481 1.00 12.22 H new ATOM 0 HG2 LYS A 91 20.766 -7.460 -2.654 1.00 63.31 H new ATOM 0 HG3 LYS A 91 22.229 -6.515 -2.461 1.00 63.31 H new ATOM 0 HD2 LYS A 91 23.628 -8.314 -2.890 1.00 25.42 H new ATOM 0 HD3 LYS A 91 22.502 -9.490 -2.242 1.00 25.42 H new ATOM 0 HE2 LYS A 91 21.008 -9.043 -4.255 1.00 65.51 H new ATOM 0 HE3 LYS A 91 22.296 -8.057 -4.918 1.00 65.51 H new ATOM 0 HZ1 LYS A 91 22.380 -10.305 -5.780 1.00 23.22 H new ATOM 0 HZ2 LYS A 91 23.768 -9.987 -4.855 1.00 23.22 H new ATOM 0 HZ3 LYS A 91 22.520 -10.942 -4.212 1.00 23.22 H new ATOM 1268 N CYS A 92 20.560 -4.239 -0.701 1.00 62.45 N ATOM 1269 CA CYS A 92 19.474 -3.380 -1.157 1.00 31.33 C ATOM 1270 C CYS A 92 19.554 -3.154 -2.664 1.00 22.33 C ATOM 1271 O CYS A 92 20.532 -2.602 -3.167 1.00 12.43 O ATOM 1272 CB CYS A 92 19.517 -2.037 -0.425 1.00 64.14 C ATOM 1273 SG CYS A 92 17.966 -1.603 0.424 1.00 55.50 S ATOM 0 H CYS A 92 21.461 -3.769 -0.613 1.00 62.45 H new ATOM 0 HA CYS A 92 18.531 -3.879 -0.933 1.00 31.33 H new ATOM 0 HB2 CYS A 92 20.325 -2.060 0.306 1.00 64.14 H new ATOM 0 HB3 CYS A 92 19.758 -1.252 -1.142 1.00 64.14 H new ATOM 1278 N GLU A 93 18.519 -3.586 -3.377 1.00 51.33 N ATOM 1279 CA GLU A 93 18.473 -3.431 -4.827 1.00 1.35 C ATOM 1280 C GLU A 93 17.068 -3.057 -5.290 1.00 0.24 C ATOM 1281 O GLU A 93 16.093 -3.231 -4.558 1.00 24.33 O ATOM 1282 CB GLU A 93 18.922 -4.722 -5.514 1.00 50.32 C ATOM 1283 CG GLU A 93 17.995 -5.899 -5.263 1.00 72.14 C ATOM 1284 CD GLU A 93 18.054 -6.935 -6.369 1.00 45.34 C ATOM 1285 OE1 GLU A 93 19.059 -7.672 -6.439 1.00 24.54 O ATOM 1286 OE2 GLU A 93 17.095 -7.007 -7.166 1.00 21.01 O ATOM 0 H GLU A 93 17.702 -4.046 -2.975 1.00 51.33 H new ATOM 0 HA GLU A 93 19.154 -2.626 -5.103 1.00 1.35 H new ATOM 0 HB2 GLU A 93 18.991 -4.547 -6.588 1.00 50.32 H new ATOM 0 HB3 GLU A 93 19.923 -4.979 -5.168 1.00 50.32 H new ATOM 0 HG2 GLU A 93 18.259 -6.369 -4.316 1.00 72.14 H new ATOM 0 HG3 GLU A 93 16.972 -5.536 -5.164 1.00 72.14 H new ATOM 1293 N LYS A 94 16.972 -2.541 -6.510 1.00 55.32 N ATOM 1294 CA LYS A 94 15.687 -2.142 -7.073 1.00 42.14 C ATOM 1295 C LYS A 94 15.211 -3.152 -8.112 1.00 63.42 C ATOM 1296 O LYS A 94 15.823 -3.303 -9.171 1.00 15.14 O ATOM 1297 CB LYS A 94 15.794 -0.754 -7.709 1.00 5.34 C ATOM 1298 CG LYS A 94 15.064 0.328 -6.933 1.00 13.42 C ATOM 1299 CD LYS A 94 14.987 1.625 -7.721 1.00 63.03 C ATOM 1300 CE LYS A 94 16.372 2.176 -8.024 1.00 65.41 C ATOM 1301 NZ LYS A 94 16.328 3.617 -8.394 1.00 14.43 N ATOM 0 H LYS A 94 17.769 -2.389 -7.129 1.00 55.32 H new ATOM 0 HA LYS A 94 14.959 -2.109 -6.263 1.00 42.14 H new ATOM 0 HB2 LYS A 94 16.846 -0.482 -7.793 1.00 5.34 H new ATOM 0 HB3 LYS A 94 15.394 -0.796 -8.722 1.00 5.34 H new ATOM 0 HG2 LYS A 94 14.057 -0.013 -6.692 1.00 13.42 H new ATOM 0 HG3 LYS A 94 15.575 0.506 -5.987 1.00 13.42 H new ATOM 0 HD2 LYS A 94 14.450 1.454 -8.654 1.00 63.03 H new ATOM 0 HD3 LYS A 94 14.417 2.362 -7.156 1.00 63.03 H new ATOM 0 HE2 LYS A 94 17.014 2.044 -7.153 1.00 65.41 H new ATOM 0 HE3 LYS A 94 16.819 1.606 -8.838 1.00 65.41 H new ATOM 0 HZ1 LYS A 94 17.292 3.954 -8.593 1.00 14.43 H new ATOM 0 HZ2 LYS A 94 15.737 3.740 -9.241 1.00 14.43 H new ATOM 0 HZ3 LYS A 94 15.925 4.165 -7.607 1.00 14.43 H new ATOM 1315 N ILE A 95 14.118 -3.841 -7.804 1.00 14.14 N ATOM 1316 CA ILE A 95 13.559 -4.835 -8.712 1.00 43.41 C ATOM 1317 C ILE A 95 12.475 -4.225 -9.594 1.00 71.32 C ATOM 1318 O ILE A 95 11.472 -3.715 -9.098 1.00 54.43 O ATOM 1319 CB ILE A 95 12.968 -6.031 -7.943 1.00 52.13 C ATOM 1320 CG1 ILE A 95 14.087 -6.872 -7.325 1.00 51.42 C ATOM 1321 CG2 ILE A 95 12.108 -6.881 -8.867 1.00 13.25 C ATOM 1322 CD1 ILE A 95 14.537 -6.375 -5.969 1.00 42.12 C ATOM 0 H ILE A 95 13.601 -3.729 -6.932 1.00 14.14 H new ATOM 0 HA ILE A 95 14.379 -5.187 -9.339 1.00 43.41 H new ATOM 0 HB ILE A 95 12.338 -5.651 -7.138 1.00 52.13 H new ATOM 0 HG12 ILE A 95 13.746 -7.903 -7.230 1.00 51.42 H new ATOM 0 HG13 ILE A 95 14.941 -6.880 -8.002 1.00 51.42 H new ATOM 0 HG21 ILE A 95 11.697 -7.723 -8.309 1.00 13.25 H new ATOM 0 HG22 ILE A 95 11.293 -6.276 -9.264 1.00 13.25 H new ATOM 0 HG23 ILE A 95 12.717 -7.254 -9.690 1.00 13.25 H new ATOM 0 HD11 ILE A 95 15.332 -7.018 -5.591 1.00 42.12 H new ATOM 0 HD12 ILE A 95 14.909 -5.354 -6.061 1.00 42.12 H new ATOM 0 HD13 ILE A 95 13.695 -6.394 -5.277 1.00 42.12 H new ATOM 1334 N ASN A 96 12.684 -4.285 -10.905 1.00 53.24 N ATOM 1335 CA ASN A 96 11.723 -3.740 -11.858 1.00 1.21 C ATOM 1336 C ASN A 96 11.471 -2.259 -11.590 1.00 24.13 C ATOM 1337 O ASN A 96 10.406 -1.732 -11.908 1.00 22.11 O ATOM 1338 CB ASN A 96 10.405 -4.514 -11.785 1.00 25.05 C ATOM 1339 CG ASN A 96 9.574 -4.360 -13.043 1.00 72.43 C ATOM 1340 OD1 ASN A 96 9.822 -5.025 -14.049 1.00 73.24 O ATOM 1341 ND2 ASN A 96 8.581 -3.480 -12.992 1.00 72.24 N ATOM 0 H ASN A 96 13.510 -4.705 -11.332 1.00 53.24 H new ATOM 0 HA ASN A 96 12.143 -3.844 -12.859 1.00 1.21 H new ATOM 0 HB2 ASN A 96 10.616 -5.570 -11.619 1.00 25.05 H new ATOM 0 HB3 ASN A 96 9.829 -4.166 -10.928 1.00 25.05 H new ATOM 0 HD21 ASN A 96 7.987 -3.333 -13.808 1.00 72.24 H new ATOM 0 HD22 ASN A 96 8.412 -2.951 -12.137 1.00 72.24 H new ATOM 1348 N GLY A 97 12.461 -1.593 -11.002 1.00 51.12 N ATOM 1349 CA GLY A 97 12.328 -0.179 -10.702 1.00 34.55 C ATOM 1350 C GLY A 97 11.668 0.068 -9.359 1.00 45.12 C ATOM 1351 O GLY A 97 11.288 1.196 -9.047 1.00 35.43 O ATOM 0 H GLY A 97 13.352 -2.007 -10.728 1.00 51.12 H new ATOM 0 HA2 GLY A 97 13.314 0.286 -10.710 1.00 34.55 H new ATOM 0 HA3 GLY A 97 11.743 0.302 -11.485 1.00 34.55 H new ATOM 1355 N GLU A 98 11.532 -0.989 -8.564 1.00 44.15 N ATOM 1356 CA GLU A 98 10.912 -0.880 -7.249 1.00 70.13 C ATOM 1357 C GLU A 98 11.934 -1.129 -6.144 1.00 34.25 C ATOM 1358 O GLU A 98 12.544 -2.196 -6.076 1.00 74.51 O ATOM 1359 CB GLU A 98 9.755 -1.873 -7.123 1.00 30.50 C ATOM 1360 CG GLU A 98 8.702 -1.722 -8.208 1.00 32.33 C ATOM 1361 CD GLU A 98 7.760 -2.909 -8.275 1.00 54.54 C ATOM 1362 OE1 GLU A 98 6.791 -2.944 -7.488 1.00 4.42 O ATOM 1363 OE2 GLU A 98 7.991 -3.802 -9.117 1.00 1.10 O ATOM 0 H GLU A 98 11.843 -1.930 -8.808 1.00 44.15 H new ATOM 0 HA GLU A 98 10.525 0.133 -7.140 1.00 70.13 H new ATOM 0 HB2 GLU A 98 10.153 -2.887 -7.153 1.00 30.50 H new ATOM 0 HB3 GLU A 98 9.282 -1.745 -6.149 1.00 30.50 H new ATOM 0 HG2 GLU A 98 8.125 -0.815 -8.026 1.00 32.33 H new ATOM 0 HG3 GLU A 98 9.194 -1.599 -9.173 1.00 32.33 H new ATOM 1370 N ASP A 99 12.115 -0.137 -5.279 1.00 51.34 N ATOM 1371 CA ASP A 99 13.062 -0.247 -4.176 1.00 12.01 C ATOM 1372 C ASP A 99 12.701 -1.416 -3.265 1.00 14.24 C ATOM 1373 O ASP A 99 11.659 -1.406 -2.610 1.00 74.00 O ATOM 1374 CB ASP A 99 13.093 1.053 -3.371 1.00 20.04 C ATOM 1375 CG ASP A 99 13.937 2.124 -4.033 1.00 4.04 C ATOM 1376 OD1 ASP A 99 13.430 2.792 -4.957 1.00 73.14 O ATOM 1377 OD2 ASP A 99 15.106 2.294 -3.627 1.00 24.25 O ATOM 0 H ASP A 99 11.618 0.753 -5.321 1.00 51.34 H new ATOM 0 HA ASP A 99 14.052 -0.429 -4.595 1.00 12.01 H new ATOM 0 HB2 ASP A 99 12.076 1.423 -3.245 1.00 20.04 H new ATOM 0 HB3 ASP A 99 13.485 0.850 -2.374 1.00 20.04 H new ATOM 1382 N MET A 100 13.568 -2.422 -3.229 1.00 5.32 N ATOM 1383 CA MET A 100 13.340 -3.598 -2.398 1.00 24.05 C ATOM 1384 C MET A 100 14.521 -3.840 -1.462 1.00 15.53 C ATOM 1385 O MET A 100 15.533 -3.143 -1.531 1.00 64.33 O ATOM 1386 CB MET A 100 13.109 -4.831 -3.273 1.00 55.35 C ATOM 1387 CG MET A 100 11.886 -4.718 -4.169 1.00 75.41 C ATOM 1388 SD MET A 100 10.636 -5.964 -3.797 1.00 53.34 S ATOM 1389 CE MET A 100 11.099 -7.261 -4.943 1.00 13.43 C ATOM 0 H MET A 100 14.435 -2.446 -3.766 1.00 5.32 H new ATOM 0 HA MET A 100 12.451 -3.418 -1.794 1.00 24.05 H new ATOM 0 HB2 MET A 100 13.990 -4.997 -3.893 1.00 55.35 H new ATOM 0 HB3 MET A 100 13.001 -5.706 -2.632 1.00 55.35 H new ATOM 0 HG2 MET A 100 11.449 -3.726 -4.058 1.00 75.41 H new ATOM 0 HG3 MET A 100 12.193 -4.816 -5.210 1.00 75.41 H new ATOM 0 HE1 MET A 100 10.895 -8.233 -4.494 1.00 13.43 H new ATOM 0 HE2 MET A 100 10.522 -7.158 -5.862 1.00 13.43 H new ATOM 0 HE3 MET A 100 12.162 -7.182 -5.171 1.00 13.43 H new ATOM 1399 N VAL A 101 14.383 -4.830 -0.586 1.00 73.11 N ATOM 1400 CA VAL A 101 15.438 -5.164 0.363 1.00 11.32 C ATOM 1401 C VAL A 101 15.555 -6.673 0.547 1.00 10.40 C ATOM 1402 O VAL A 101 14.576 -7.404 0.399 1.00 71.31 O ATOM 1403 CB VAL A 101 15.187 -4.508 1.734 1.00 21.54 C ATOM 1404 CG1 VAL A 101 14.759 -3.059 1.563 1.00 12.04 C ATOM 1405 CG2 VAL A 101 14.144 -5.292 2.516 1.00 31.51 C ATOM 0 H VAL A 101 13.550 -5.415 -0.514 1.00 73.11 H new ATOM 0 HA VAL A 101 16.370 -4.779 -0.051 1.00 11.32 H new ATOM 0 HB VAL A 101 16.119 -4.522 2.300 1.00 21.54 H new ATOM 0 HG11 VAL A 101 14.586 -2.613 2.542 1.00 12.04 H new ATOM 0 HG12 VAL A 101 15.543 -2.507 1.046 1.00 12.04 H new ATOM 0 HG13 VAL A 101 13.840 -3.018 0.978 1.00 12.04 H new ATOM 0 HG21 VAL A 101 13.979 -4.815 3.482 1.00 31.51 H new ATOM 0 HG22 VAL A 101 13.209 -5.312 1.956 1.00 31.51 H new ATOM 0 HG23 VAL A 101 14.496 -6.312 2.671 1.00 31.51 H new ATOM 1415 N TYR A 102 16.759 -7.132 0.871 1.00 15.20 N ATOM 1416 CA TYR A 102 17.005 -8.555 1.074 1.00 53.45 C ATOM 1417 C TYR A 102 17.233 -8.863 2.550 1.00 34.21 C ATOM 1418 O TYR A 102 17.904 -8.111 3.258 1.00 53.23 O ATOM 1419 CB TYR A 102 18.215 -9.006 0.254 1.00 52.10 C ATOM 1420 CG TYR A 102 17.873 -9.393 -1.167 1.00 62.41 C ATOM 1421 CD1 TYR A 102 17.118 -10.528 -1.436 1.00 52.14 C ATOM 1422 CD2 TYR A 102 18.305 -8.624 -2.241 1.00 24.15 C ATOM 1423 CE1 TYR A 102 16.804 -10.886 -2.733 1.00 42.12 C ATOM 1424 CE2 TYR A 102 17.995 -8.974 -3.541 1.00 2.34 C ATOM 1425 CZ TYR A 102 17.245 -10.106 -3.782 1.00 11.32 C ATOM 1426 OH TYR A 102 16.933 -10.458 -5.075 1.00 24.21 O ATOM 0 H TYR A 102 17.579 -6.540 0.999 1.00 15.20 H new ATOM 0 HA TYR A 102 16.123 -9.102 0.740 1.00 53.45 H new ATOM 0 HB2 TYR A 102 18.951 -8.202 0.236 1.00 52.10 H new ATOM 0 HB3 TYR A 102 18.683 -9.856 0.750 1.00 52.10 H new ATOM 0 HD1 TYR A 102 16.771 -11.141 -0.617 1.00 52.14 H new ATOM 0 HD2 TYR A 102 18.893 -7.737 -2.056 1.00 24.15 H new ATOM 0 HE1 TYR A 102 16.216 -11.772 -2.925 1.00 42.12 H new ATOM 0 HE2 TYR A 102 18.338 -8.365 -4.364 1.00 2.34 H new ATOM 0 HH TYR A 102 17.318 -9.803 -5.694 1.00 24.21 H new ATOM 1436 N LEU A 103 16.670 -9.976 3.009 1.00 52.33 N ATOM 1437 CA LEU A 103 16.811 -10.387 4.401 1.00 10.33 C ATOM 1438 C LEU A 103 17.518 -11.734 4.502 1.00 22.43 C ATOM 1439 O LEU A 103 17.570 -12.509 3.547 1.00 72.21 O ATOM 1440 CB LEU A 103 15.438 -10.467 5.072 1.00 44.33 C ATOM 1441 CG LEU A 103 14.295 -10.987 4.200 1.00 51.11 C ATOM 1442 CD1 LEU A 103 14.498 -12.459 3.875 1.00 45.51 C ATOM 1443 CD2 LEU A 103 12.957 -10.772 4.892 1.00 54.35 C ATOM 0 H LEU A 103 16.112 -10.610 2.437 1.00 52.33 H new ATOM 0 HA LEU A 103 17.416 -9.640 4.915 1.00 10.33 H new ATOM 0 HB2 LEU A 103 15.521 -11.109 5.949 1.00 44.33 H new ATOM 0 HB3 LEU A 103 15.172 -9.472 5.430 1.00 44.33 H new ATOM 0 HG LEU A 103 14.293 -10.427 3.265 1.00 51.11 H new ATOM 0 HD11 LEU A 103 13.675 -12.811 3.254 1.00 45.51 H new ATOM 0 HD12 LEU A 103 15.438 -12.587 3.338 1.00 45.51 H new ATOM 0 HD13 LEU A 103 14.527 -13.035 4.800 1.00 45.51 H new ATOM 0 HD21 LEU A 103 12.155 -11.148 4.257 1.00 54.35 H new ATOM 0 HD22 LEU A 103 12.949 -11.306 5.842 1.00 54.35 H new ATOM 0 HD23 LEU A 103 12.808 -9.708 5.073 1.00 54.35 H new ATOM 1455 N PRO A 104 18.075 -12.023 5.688 1.00 61.32 N ATOM 1456 CA PRO A 104 18.787 -13.279 5.943 1.00 71.21 C ATOM 1457 C PRO A 104 17.848 -14.480 5.981 1.00 62.23 C ATOM 1458 O PRO A 104 16.667 -14.347 6.299 1.00 12.15 O ATOM 1459 CB PRO A 104 19.422 -13.054 7.317 1.00 4.21 C ATOM 1460 CG PRO A 104 18.554 -12.037 7.974 1.00 43.42 C ATOM 1461 CD PRO A 104 18.052 -11.147 6.871 1.00 42.43 C ATOM 0 HA PRO A 104 19.507 -13.506 5.157 1.00 71.21 H new ATOM 0 HB2 PRO A 104 19.455 -13.978 7.894 1.00 4.21 H new ATOM 0 HB3 PRO A 104 20.448 -12.699 7.225 1.00 4.21 H new ATOM 0 HG2 PRO A 104 17.726 -12.512 8.500 1.00 43.42 H new ATOM 0 HG3 PRO A 104 19.114 -11.464 8.713 1.00 43.42 H new ATOM 0 HD2 PRO A 104 17.047 -10.778 7.078 1.00 42.43 H new ATOM 0 HD3 PRO A 104 18.691 -10.274 6.737 1.00 42.43 H new ATOM 1469 N SER A 105 18.382 -15.653 5.654 1.00 53.03 N ATOM 1470 CA SER A 105 17.590 -16.878 5.647 1.00 1.42 C ATOM 1471 C SER A 105 17.895 -17.728 6.876 1.00 25.52 C ATOM 1472 O SER A 105 18.743 -17.374 7.696 1.00 41.43 O ATOM 1473 CB SER A 105 17.866 -17.681 4.375 1.00 31.40 C ATOM 1474 OG SER A 105 16.780 -17.591 3.469 1.00 0.30 O ATOM 0 H SER A 105 19.359 -15.781 5.391 1.00 53.03 H new ATOM 0 HA SER A 105 16.536 -16.601 5.671 1.00 1.42 H new ATOM 0 HB2 SER A 105 18.773 -17.311 3.898 1.00 31.40 H new ATOM 0 HB3 SER A 105 18.044 -18.725 4.632 1.00 31.40 H new ATOM 0 HG SER A 105 16.982 -18.111 2.664 1.00 0.30 H new ATOM 1480 N TYR A 106 17.199 -18.853 6.997 1.00 12.12 N ATOM 1481 CA TYR A 106 17.393 -19.754 8.127 1.00 74.32 C ATOM 1482 C TYR A 106 18.868 -20.101 8.300 1.00 2.35 C ATOM 1483 O TYR A 106 19.346 -20.283 9.420 1.00 71.44 O ATOM 1484 CB TYR A 106 16.577 -21.033 7.931 1.00 34.24 C ATOM 1485 CG TYR A 106 17.172 -21.982 6.916 1.00 21.32 C ATOM 1486 CD1 TYR A 106 17.231 -21.644 5.570 1.00 4.41 C ATOM 1487 CD2 TYR A 106 17.677 -23.218 7.304 1.00 54.24 C ATOM 1488 CE1 TYR A 106 17.774 -22.508 4.639 1.00 31.12 C ATOM 1489 CE2 TYR A 106 18.222 -24.088 6.380 1.00 63.02 C ATOM 1490 CZ TYR A 106 18.268 -23.729 5.049 1.00 42.11 C ATOM 1491 OH TYR A 106 18.811 -24.592 4.125 1.00 73.31 O ATOM 0 H TYR A 106 16.495 -19.163 6.327 1.00 12.12 H new ATOM 0 HA TYR A 106 17.050 -19.245 9.028 1.00 74.32 H new ATOM 0 HB2 TYR A 106 16.488 -21.547 8.888 1.00 34.24 H new ATOM 0 HB3 TYR A 106 15.568 -20.766 7.618 1.00 34.24 H new ATOM 0 HD1 TYR A 106 16.845 -20.689 5.246 1.00 4.41 H new ATOM 0 HD2 TYR A 106 17.643 -23.503 8.345 1.00 54.24 H new ATOM 0 HE1 TYR A 106 17.812 -22.229 3.596 1.00 31.12 H new ATOM 0 HE2 TYR A 106 18.610 -25.044 6.698 1.00 63.02 H new ATOM 0 HH TYR A 106 19.114 -25.407 4.577 1.00 73.31 H new ATOM 1501 N GLU A 107 19.584 -20.188 7.184 1.00 62.32 N ATOM 1502 CA GLU A 107 21.006 -20.513 7.212 1.00 15.20 C ATOM 1503 C GLU A 107 21.801 -19.411 7.906 1.00 24.44 C ATOM 1504 O GLU A 107 22.520 -19.665 8.873 1.00 72.42 O ATOM 1505 CB GLU A 107 21.533 -20.719 5.790 1.00 34.15 C ATOM 1506 CG GLU A 107 22.458 -21.916 5.652 1.00 21.32 C ATOM 1507 CD GLU A 107 22.002 -22.885 4.579 1.00 71.41 C ATOM 1508 OE1 GLU A 107 21.468 -22.421 3.550 1.00 73.43 O ATOM 1509 OE2 GLU A 107 22.179 -24.107 4.768 1.00 54.02 O ATOM 0 H GLU A 107 19.204 -20.038 6.249 1.00 62.32 H new ATOM 0 HA GLU A 107 21.131 -21.438 7.775 1.00 15.20 H new ATOM 0 HB2 GLU A 107 20.688 -20.843 5.113 1.00 34.15 H new ATOM 0 HB3 GLU A 107 22.065 -19.821 5.475 1.00 34.15 H new ATOM 0 HG2 GLU A 107 23.464 -21.568 5.418 1.00 21.32 H new ATOM 0 HG3 GLU A 107 22.515 -22.438 6.607 1.00 21.32 H new ATOM 1516 N MET A 108 21.668 -18.188 7.406 1.00 52.43 N ATOM 1517 CA MET A 108 22.374 -17.047 7.978 1.00 53.00 C ATOM 1518 C MET A 108 22.128 -16.953 9.480 1.00 34.45 C ATOM 1519 O MET A 108 23.052 -16.710 10.257 1.00 33.22 O ATOM 1520 CB MET A 108 21.931 -15.751 7.295 1.00 21.33 C ATOM 1521 CG MET A 108 22.469 -15.594 5.882 1.00 22.53 C ATOM 1522 SD MET A 108 24.205 -15.106 5.850 1.00 33.52 S ATOM 1523 CE MET A 108 24.156 -13.760 4.670 1.00 60.11 C ATOM 0 H MET A 108 21.078 -17.961 6.606 1.00 52.43 H new ATOM 0 HA MET A 108 23.441 -17.191 7.811 1.00 53.00 H new ATOM 0 HB2 MET A 108 20.842 -15.719 7.266 1.00 21.33 H new ATOM 0 HB3 MET A 108 22.259 -14.903 7.896 1.00 21.33 H new ATOM 0 HG2 MET A 108 22.350 -16.535 5.345 1.00 22.53 H new ATOM 0 HG3 MET A 108 21.876 -14.848 5.352 1.00 22.53 H new ATOM 0 HE1 MET A 108 24.876 -12.995 4.960 1.00 60.11 H new ATOM 0 HE2 MET A 108 24.406 -14.136 3.678 1.00 60.11 H new ATOM 0 HE3 MET A 108 23.155 -13.328 4.652 1.00 60.11 H new ATOM 1533 N CYS A 109 20.877 -17.148 9.884 1.00 55.31 N ATOM 1534 CA CYS A 109 20.508 -17.085 11.293 1.00 4.41 C ATOM 1535 C CYS A 109 20.940 -18.352 12.025 1.00 35.12 C ATOM 1536 O CYS A 109 21.109 -18.350 13.245 1.00 45.45 O ATOM 1537 CB CYS A 109 18.998 -16.887 11.439 1.00 43.21 C ATOM 1538 SG CYS A 109 18.412 -15.237 10.936 1.00 44.11 S ATOM 0 H CYS A 109 20.101 -17.351 9.254 1.00 55.31 H new ATOM 0 HA CYS A 109 21.023 -16.235 11.740 1.00 4.41 H new ATOM 0 HB2 CYS A 109 18.484 -17.641 10.842 1.00 43.21 H new ATOM 0 HB3 CYS A 109 18.719 -17.059 12.479 1.00 43.21 H new ATOM 1543 N ARG A 110 21.115 -19.433 11.272 1.00 33.12 N ATOM 1544 CA ARG A 110 21.525 -20.708 11.849 1.00 51.31 C ATOM 1545 C ARG A 110 22.989 -20.665 12.277 1.00 51.40 C ATOM 1546 O ARG A 110 23.380 -21.310 13.250 1.00 4.32 O ATOM 1547 CB ARG A 110 21.310 -21.840 10.843 1.00 52.21 C ATOM 1548 CG ARG A 110 21.894 -23.170 11.289 1.00 71.30 C ATOM 1549 CD ARG A 110 20.991 -24.332 10.904 1.00 1.04 C ATOM 1550 NE ARG A 110 19.883 -24.498 11.842 1.00 44.25 N ATOM 1551 CZ ARG A 110 18.872 -25.335 11.643 1.00 74.34 C ATOM 1552 NH1 ARG A 110 18.828 -26.079 10.546 1.00 23.30 N ATOM 1553 NH2 ARG A 110 17.901 -25.430 12.542 1.00 74.10 N ATOM 0 H ARG A 110 20.979 -19.452 10.261 1.00 33.12 H new ATOM 0 HA ARG A 110 20.912 -20.893 12.731 1.00 51.31 H new ATOM 0 HB2 ARG A 110 20.241 -21.962 10.669 1.00 52.21 H new ATOM 0 HB3 ARG A 110 21.757 -21.558 9.890 1.00 52.21 H new ATOM 0 HG2 ARG A 110 22.877 -23.307 10.838 1.00 71.30 H new ATOM 0 HG3 ARG A 110 22.037 -23.162 12.369 1.00 71.30 H new ATOM 0 HD2 ARG A 110 20.596 -24.167 9.902 1.00 1.04 H new ATOM 0 HD3 ARG A 110 21.577 -25.250 10.869 1.00 1.04 H new ATOM 0 HE ARG A 110 19.887 -23.940 12.696 1.00 44.25 H new ATOM 0 HH11 ARG A 110 19.572 -26.009 9.852 1.00 23.30 H new ATOM 0 HH12 ARG A 110 18.050 -26.721 10.396 1.00 23.30 H new ATOM 0 HH21 ARG A 110 17.931 -24.860 13.387 1.00 74.10 H new ATOM 0 HH22 ARG A 110 17.125 -26.073 12.388 1.00 74.10 H new ATOM 1567 N ILE A 111 23.792 -19.901 11.544 1.00 62.54 N ATOM 1568 CA ILE A 111 25.212 -19.774 11.848 1.00 70.31 C ATOM 1569 C ILE A 111 25.430 -19.408 13.312 1.00 53.20 C ATOM 1570 O ILE A 111 26.419 -19.811 13.925 1.00 42.35 O ATOM 1571 CB ILE A 111 25.885 -18.712 10.959 1.00 63.22 C ATOM 1572 CG1 ILE A 111 25.560 -18.968 9.486 1.00 64.22 C ATOM 1573 CG2 ILE A 111 27.390 -18.711 11.182 1.00 22.05 C ATOM 1574 CD1 ILE A 111 25.835 -20.389 9.044 1.00 2.34 C ATOM 0 H ILE A 111 23.484 -19.361 10.736 1.00 62.54 H new ATOM 0 HA ILE A 111 25.666 -20.744 11.647 1.00 70.31 H new ATOM 0 HB ILE A 111 25.496 -17.731 11.233 1.00 63.22 H new ATOM 0 HG12 ILE A 111 24.509 -18.738 9.309 1.00 64.22 H new ATOM 0 HG13 ILE A 111 26.144 -18.285 8.869 1.00 64.22 H new ATOM 0 HG21 ILE A 111 27.851 -17.955 10.547 1.00 22.05 H new ATOM 0 HG22 ILE A 111 27.603 -18.486 12.227 1.00 22.05 H new ATOM 0 HG23 ILE A 111 27.795 -19.692 10.932 1.00 22.05 H new ATOM 0 HD11 ILE A 111 25.582 -20.498 7.989 1.00 2.34 H new ATOM 0 HD12 ILE A 111 26.891 -20.617 9.189 1.00 2.34 H new ATOM 0 HD13 ILE A 111 25.231 -21.077 9.635 1.00 2.34 H new ATOM 1586 N THR A 112 24.497 -18.642 13.870 1.00 43.53 N ATOM 1587 CA THR A 112 24.586 -18.221 15.262 1.00 1.22 C ATOM 1588 C THR A 112 23.869 -19.204 16.180 1.00 13.33 C ATOM 1589 O THR A 112 24.120 -19.239 17.385 1.00 55.44 O ATOM 1590 CB THR A 112 23.987 -16.816 15.464 1.00 72.20 C ATOM 1591 OG1 THR A 112 22.557 -16.881 15.411 1.00 64.25 O ATOM 1592 CG2 THR A 112 24.496 -15.853 14.402 1.00 32.02 C ATOM 0 H THR A 112 23.671 -18.301 13.378 1.00 43.53 H new ATOM 0 HA THR A 112 25.645 -18.196 15.518 1.00 1.22 H new ATOM 0 HB THR A 112 24.298 -16.450 16.442 1.00 72.20 H new ATOM 0 HG1 THR A 112 22.282 -17.417 14.638 1.00 64.25 H new ATOM 0 HG21 THR A 112 24.059 -14.868 14.565 1.00 32.02 H new ATOM 0 HG22 THR A 112 25.582 -15.784 14.464 1.00 32.02 H new ATOM 0 HG23 THR A 112 24.212 -16.217 13.415 1.00 32.02 H new ATOM 1600 N MET A 113 22.976 -20.001 15.604 1.00 73.24 N ATOM 1601 CA MET A 113 22.223 -20.987 16.371 1.00 3.33 C ATOM 1602 C MET A 113 23.136 -22.107 16.861 1.00 52.24 C ATOM 1603 O MET A 113 22.937 -22.651 17.946 1.00 2.12 O ATOM 1604 CB MET A 113 21.091 -21.569 15.523 1.00 21.21 C ATOM 1605 CG MET A 113 19.810 -20.752 15.575 1.00 5.01 C ATOM 1606 SD MET A 113 18.465 -21.510 14.644 1.00 12.53 S ATOM 1607 CE MET A 113 18.403 -20.441 13.208 1.00 64.31 C ATOM 0 H MET A 113 22.756 -19.984 14.608 1.00 73.24 H new ATOM 0 HA MET A 113 21.795 -20.486 17.239 1.00 3.33 H new ATOM 0 HB2 MET A 113 21.424 -21.641 14.488 1.00 21.21 H new ATOM 0 HB3 MET A 113 20.879 -22.583 15.861 1.00 21.21 H new ATOM 0 HG2 MET A 113 19.504 -20.629 16.614 1.00 5.01 H new ATOM 0 HG3 MET A 113 20.003 -19.755 15.180 1.00 5.01 H new ATOM 0 HE1 MET A 113 17.365 -20.203 12.976 1.00 64.31 H new ATOM 0 HE2 MET A 113 18.948 -19.520 13.416 1.00 64.31 H new ATOM 0 HE3 MET A 113 18.858 -20.948 12.357 1.00 64.31 H new ATOM 1617 N GLU A 114 24.135 -22.446 16.052 1.00 4.43 N ATOM 1618 CA GLU A 114 25.077 -23.502 16.404 1.00 11.02 C ATOM 1619 C GLU A 114 25.699 -23.242 17.773 1.00 24.20 C ATOM 1620 O GLU A 114 25.538 -24.019 18.714 1.00 33.32 O ATOM 1621 CB GLU A 114 26.175 -23.611 15.345 1.00 44.55 C ATOM 1622 CG GLU A 114 25.999 -24.791 14.404 1.00 50.43 C ATOM 1623 CD GLU A 114 26.970 -25.918 14.694 1.00 62.31 C ATOM 1624 OE1 GLU A 114 28.172 -25.758 14.393 1.00 13.31 O ATOM 1625 OE2 GLU A 114 26.529 -26.961 15.221 1.00 5.22 O ATOM 0 H GLU A 114 24.313 -22.005 15.149 1.00 4.43 H new ATOM 0 HA GLU A 114 24.529 -24.443 16.446 1.00 11.02 H new ATOM 0 HB2 GLU A 114 26.197 -22.691 14.760 1.00 44.55 H new ATOM 0 HB3 GLU A 114 27.141 -23.695 15.843 1.00 44.55 H new ATOM 0 HG2 GLU A 114 24.979 -25.166 14.484 1.00 50.43 H new ATOM 0 HG3 GLU A 114 26.135 -24.455 13.376 1.00 50.43 H new ATOM 1632 N PRO A 115 26.430 -22.123 17.888 1.00 53.14 N ATOM 1633 CA PRO A 115 27.092 -21.734 19.136 1.00 14.04 C ATOM 1634 C PRO A 115 26.097 -21.312 20.213 1.00 60.34 C ATOM 1635 O PRO A 115 26.164 -21.777 21.351 1.00 4.10 O ATOM 1636 CB PRO A 115 27.965 -20.547 18.720 1.00 35.45 C ATOM 1637 CG PRO A 115 27.288 -19.982 17.519 1.00 23.33 C ATOM 1638 CD PRO A 115 26.665 -21.151 16.807 1.00 11.40 C ATOM 0 HA PRO A 115 27.652 -22.560 19.574 1.00 14.04 H new ATOM 0 HB2 PRO A 115 28.036 -19.809 19.519 1.00 35.45 H new ATOM 0 HB3 PRO A 115 28.982 -20.865 18.489 1.00 35.45 H new ATOM 0 HG2 PRO A 115 26.532 -19.251 17.805 1.00 23.33 H new ATOM 0 HG3 PRO A 115 28.001 -19.468 16.875 1.00 23.33 H new ATOM 0 HD2 PRO A 115 25.736 -20.870 16.310 1.00 11.40 H new ATOM 0 HD3 PRO A 115 27.327 -21.554 16.041 1.00 11.40 H new ATOM 1646 N CYS A 116 25.174 -20.430 19.846 1.00 50.34 N ATOM 1647 CA CYS A 116 24.165 -19.945 20.779 1.00 13.13 C ATOM 1648 C CYS A 116 22.763 -20.327 20.312 1.00 22.33 C ATOM 1649 O CYS A 116 22.065 -19.527 19.690 1.00 42.22 O ATOM 1650 CB CYS A 116 24.267 -18.426 20.930 1.00 2.21 C ATOM 1651 SG CYS A 116 25.964 -17.818 21.194 1.00 11.40 S ATOM 0 H CYS A 116 25.104 -20.036 18.908 1.00 50.34 H new ATOM 0 HA CYS A 116 24.347 -20.413 21.747 1.00 13.13 H new ATOM 0 HB2 CYS A 116 23.858 -17.954 20.036 1.00 2.21 H new ATOM 0 HB3 CYS A 116 23.645 -18.112 21.769 1.00 2.21 H new ATOM 1656 N ARG A 117 22.359 -21.556 20.618 1.00 55.14 N ATOM 1657 CA ARG A 117 21.041 -22.045 20.229 1.00 63.12 C ATOM 1658 C ARG A 117 19.971 -21.553 21.198 1.00 54.31 C ATOM 1659 O ARG A 117 18.789 -21.495 20.856 1.00 41.13 O ATOM 1660 CB ARG A 117 21.036 -23.574 20.180 1.00 72.13 C ATOM 1661 CG ARG A 117 19.641 -24.178 20.164 1.00 50.13 C ATOM 1662 CD ARG A 117 19.680 -25.662 19.835 1.00 22.24 C ATOM 1663 NE ARG A 117 18.343 -26.215 19.640 1.00 73.02 N ATOM 1664 CZ ARG A 117 18.092 -27.516 19.543 1.00 41.12 C ATOM 1665 NH1 ARG A 117 19.083 -28.393 19.623 1.00 21.12 N ATOM 1666 NH2 ARG A 117 16.848 -27.942 19.365 1.00 0.24 N ATOM 0 H ARG A 117 22.924 -22.231 21.133 1.00 55.14 H new ATOM 0 HA ARG A 117 20.814 -21.655 19.237 1.00 63.12 H new ATOM 0 HB2 ARG A 117 21.575 -23.902 19.291 1.00 72.13 H new ATOM 0 HB3 ARG A 117 21.579 -23.959 21.043 1.00 72.13 H new ATOM 0 HG2 ARG A 117 19.169 -24.032 21.136 1.00 50.13 H new ATOM 0 HG3 ARG A 117 19.026 -23.657 19.430 1.00 50.13 H new ATOM 0 HD2 ARG A 117 20.272 -25.818 18.933 1.00 22.24 H new ATOM 0 HD3 ARG A 117 20.180 -26.199 20.641 1.00 22.24 H new ATOM 0 HE ARG A 117 17.558 -25.567 19.575 1.00 73.02 H new ATOM 0 HH11 ARG A 117 20.041 -28.069 19.759 1.00 21.12 H new ATOM 0 HH12 ARG A 117 18.888 -29.391 19.548 1.00 21.12 H new ATOM 0 HH21 ARG A 117 16.083 -27.270 19.302 1.00 0.24 H new ATOM 0 HH22 ARG A 117 16.657 -28.941 19.291 1.00 0.24 H new ATOM 1680 N ILE A 118 20.392 -21.200 22.408 1.00 40.24 N ATOM 1681 CA ILE A 118 19.469 -20.712 23.425 1.00 25.13 C ATOM 1682 C ILE A 118 18.635 -19.549 22.899 1.00 5.12 C ATOM 1683 O ILE A 118 17.532 -19.293 23.383 1.00 73.44 O ATOM 1684 CB ILE A 118 20.218 -20.260 24.693 1.00 33.54 C ATOM 1685 CG1 ILE A 118 21.033 -21.419 25.271 1.00 34.41 C ATOM 1686 CG2 ILE A 118 19.236 -19.729 25.727 1.00 74.41 C ATOM 1687 CD1 ILE A 118 20.200 -22.640 25.597 1.00 45.03 C ATOM 0 H ILE A 118 21.366 -21.243 22.708 1.00 40.24 H new ATOM 0 HA ILE A 118 18.810 -21.542 23.678 1.00 25.13 H new ATOM 0 HB ILE A 118 20.904 -19.456 24.425 1.00 33.54 H new ATOM 0 HG12 ILE A 118 21.809 -21.698 24.558 1.00 34.41 H new ATOM 0 HG13 ILE A 118 21.538 -21.082 26.176 1.00 34.41 H new ATOM 0 HG21 ILE A 118 19.780 -19.414 26.617 1.00 74.41 H new ATOM 0 HG22 ILE A 118 18.695 -18.879 25.312 1.00 74.41 H new ATOM 0 HG23 ILE A 118 18.528 -20.514 25.994 1.00 74.41 H new ATOM 0 HD11 ILE A 118 20.843 -23.421 26.002 1.00 45.03 H new ATOM 0 HD12 ILE A 118 19.441 -22.376 26.333 1.00 45.03 H new ATOM 0 HD13 ILE A 118 19.716 -23.003 24.690 1.00 45.03 H new ATOM 1699 N LEU A 119 19.169 -18.848 21.905 1.00 1.32 N ATOM 1700 CA LEU A 119 18.473 -17.712 21.311 1.00 44.43 C ATOM 1701 C LEU A 119 17.659 -18.146 20.096 1.00 25.31 C ATOM 1702 O LEU A 119 17.479 -17.379 19.150 1.00 65.31 O ATOM 1703 CB LEU A 119 19.476 -16.629 20.906 1.00 32.23 C ATOM 1704 CG LEU A 119 19.864 -15.632 21.998 1.00 14.34 C ATOM 1705 CD1 LEU A 119 18.709 -14.687 22.293 1.00 50.23 C ATOM 1706 CD2 LEU A 119 20.291 -16.364 23.262 1.00 3.10 C ATOM 0 H LEU A 119 20.081 -19.046 21.494 1.00 1.32 H new ATOM 0 HA LEU A 119 17.790 -17.306 22.057 1.00 44.43 H new ATOM 0 HB2 LEU A 119 20.383 -17.117 20.549 1.00 32.23 H new ATOM 0 HB3 LEU A 119 19.061 -16.073 20.065 1.00 32.23 H new ATOM 0 HG LEU A 119 20.708 -15.042 21.641 1.00 14.34 H new ATOM 0 HD11 LEU A 119 19.004 -13.985 23.073 1.00 50.23 H new ATOM 0 HD12 LEU A 119 18.449 -14.137 21.389 1.00 50.23 H new ATOM 0 HD13 LEU A 119 17.846 -15.261 22.629 1.00 50.23 H new ATOM 0 HD21 LEU A 119 20.564 -15.638 24.028 1.00 3.10 H new ATOM 0 HD22 LEU A 119 19.467 -16.980 23.622 1.00 3.10 H new ATOM 0 HD23 LEU A 119 21.149 -16.999 23.042 1.00 3.10 H new ATOM 1718 N TYR A 120 17.168 -19.380 20.131 1.00 43.04 N ATOM 1719 CA TYR A 120 16.373 -19.917 19.033 1.00 63.04 C ATOM 1720 C TYR A 120 15.043 -19.180 18.912 1.00 32.31 C ATOM 1721 O TYR A 120 14.329 -19.323 17.920 1.00 22.23 O ATOM 1722 CB TYR A 120 16.124 -21.412 19.239 1.00 23.02 C ATOM 1723 CG TYR A 120 15.217 -21.719 20.409 1.00 52.20 C ATOM 1724 CD1 TYR A 120 15.706 -21.729 21.709 1.00 30.33 C ATOM 1725 CD2 TYR A 120 13.869 -21.997 20.214 1.00 64.13 C ATOM 1726 CE1 TYR A 120 14.881 -22.010 22.781 1.00 55.12 C ATOM 1727 CE2 TYR A 120 13.036 -22.277 21.279 1.00 22.35 C ATOM 1728 CZ TYR A 120 13.546 -22.283 22.561 1.00 45.11 C ATOM 1729 OH TYR A 120 12.721 -22.561 23.626 1.00 74.42 O ATOM 0 H TYR A 120 17.307 -20.027 20.907 1.00 43.04 H new ATOM 0 HA TYR A 120 16.933 -19.773 18.109 1.00 63.04 H new ATOM 0 HB2 TYR A 120 15.686 -21.827 18.332 1.00 23.02 H new ATOM 0 HB3 TYR A 120 17.080 -21.914 19.390 1.00 23.02 H new ATOM 0 HD1 TYR A 120 16.750 -21.513 21.885 1.00 30.33 H new ATOM 0 HD2 TYR A 120 13.466 -21.994 19.212 1.00 64.13 H new ATOM 0 HE1 TYR A 120 15.278 -22.016 23.785 1.00 55.12 H new ATOM 0 HE2 TYR A 120 11.991 -22.490 21.109 1.00 22.35 H new ATOM 0 HH TYR A 120 11.812 -22.730 23.300 1.00 74.42 H new ATOM 1739 N ASN A 121 14.717 -18.391 19.930 1.00 13.24 N ATOM 1740 CA ASN A 121 13.472 -17.630 19.940 1.00 23.50 C ATOM 1741 C ASN A 121 13.456 -16.628 21.090 1.00 42.10 C ATOM 1742 O ASN A 121 12.920 -15.526 20.961 1.00 24.54 O ATOM 1743 CB ASN A 121 12.274 -18.575 20.055 1.00 1.03 C ATOM 1744 CG ASN A 121 11.799 -18.734 21.487 1.00 55.44 C ATOM 1745 OD1 ASN A 121 10.744 -18.221 21.863 1.00 44.24 O ATOM 1746 ND2 ASN A 121 12.576 -19.447 22.293 1.00 44.43 N ATOM 0 H ASN A 121 15.297 -18.261 20.759 1.00 13.24 H new ATOM 0 HA ASN A 121 13.404 -17.080 19.002 1.00 23.50 H new ATOM 0 HB2 ASN A 121 11.455 -18.196 19.443 1.00 1.03 H new ATOM 0 HB3 ASN A 121 12.545 -19.552 19.654 1.00 1.03 H new ATOM 0 HD21 ASN A 121 12.307 -19.588 23.267 1.00 44.43 H new ATOM 0 HD22 ASN A 121 13.442 -19.854 21.939 1.00 44.43 H new ATOM 1753 N THR A 122 14.048 -17.017 22.215 1.00 10.32 N ATOM 1754 CA THR A 122 14.102 -16.153 23.388 1.00 34.42 C ATOM 1755 C THR A 122 14.563 -14.749 23.017 1.00 41.14 C ATOM 1756 O THR A 122 15.305 -14.562 22.052 1.00 64.32 O ATOM 1757 CB THR A 122 15.046 -16.724 24.463 1.00 30.10 C ATOM 1758 OG1 THR A 122 14.721 -16.172 25.744 1.00 60.23 O ATOM 1759 CG2 THR A 122 16.497 -16.417 24.126 1.00 24.14 C ATOM 0 H THR A 122 14.497 -17.925 22.339 1.00 10.32 H new ATOM 0 HA THR A 122 13.091 -16.105 23.791 1.00 34.42 H new ATOM 0 HB THR A 122 14.917 -17.806 24.491 1.00 30.10 H new ATOM 0 HG1 THR A 122 15.325 -16.541 26.422 1.00 60.23 H new ATOM 0 HG21 THR A 122 17.145 -16.830 24.899 1.00 24.14 H new ATOM 0 HG22 THR A 122 16.749 -16.863 23.164 1.00 24.14 H new ATOM 0 HG23 THR A 122 16.638 -15.337 24.073 1.00 24.14 H new ATOM 1767 N THR A 123 14.120 -13.761 23.789 1.00 74.54 N ATOM 1768 CA THR A 123 14.487 -12.373 23.540 1.00 32.21 C ATOM 1769 C THR A 123 15.612 -11.928 24.467 1.00 42.22 C ATOM 1770 O THR A 123 15.628 -10.791 24.939 1.00 40.33 O ATOM 1771 CB THR A 123 13.282 -11.432 23.725 1.00 12.40 C ATOM 1772 OG1 THR A 123 12.865 -11.433 25.095 1.00 51.21 O ATOM 1773 CG2 THR A 123 12.122 -11.856 22.836 1.00 3.34 C ATOM 0 H THR A 123 13.506 -13.897 24.592 1.00 74.54 H new ATOM 0 HA THR A 123 14.828 -12.316 22.506 1.00 32.21 H new ATOM 0 HB THR A 123 13.588 -10.426 23.440 1.00 12.40 H new ATOM 0 HG1 THR A 123 12.100 -10.831 25.204 1.00 51.21 H new ATOM 0 HG21 THR A 123 11.283 -11.176 22.984 1.00 3.34 H new ATOM 0 HG22 THR A 123 12.434 -11.825 21.792 1.00 3.34 H new ATOM 0 HG23 THR A 123 11.818 -12.870 23.094 1.00 3.34 H new ATOM 1781 N PHE A 124 16.553 -12.830 24.723 1.00 22.34 N ATOM 1782 CA PHE A 124 17.683 -12.530 25.595 1.00 44.14 C ATOM 1783 C PHE A 124 18.700 -11.643 24.881 1.00 72.42 C ATOM 1784 O PHE A 124 19.477 -10.933 25.519 1.00 53.42 O ATOM 1785 CB PHE A 124 18.355 -13.824 26.058 1.00 2.04 C ATOM 1786 CG PHE A 124 19.453 -13.604 27.060 1.00 72.12 C ATOM 1787 CD1 PHE A 124 19.289 -12.705 28.101 1.00 14.30 C ATOM 1788 CD2 PHE A 124 20.648 -14.297 26.960 1.00 5.04 C ATOM 1789 CE1 PHE A 124 20.297 -12.500 29.023 1.00 4.13 C ATOM 1790 CE2 PHE A 124 21.661 -14.097 27.880 1.00 12.31 C ATOM 1791 CZ PHE A 124 21.484 -13.198 28.913 1.00 4.45 C ATOM 0 H PHE A 124 16.556 -13.775 24.339 1.00 22.34 H new ATOM 0 HA PHE A 124 17.306 -11.993 26.465 1.00 44.14 H new ATOM 0 HB2 PHE A 124 17.601 -14.479 26.495 1.00 2.04 H new ATOM 0 HB3 PHE A 124 18.764 -14.342 25.191 1.00 2.04 H new ATOM 0 HD1 PHE A 124 18.362 -12.158 28.193 1.00 14.30 H new ATOM 0 HD2 PHE A 124 20.790 -15.002 26.154 1.00 5.04 H new ATOM 0 HE1 PHE A 124 20.157 -11.795 29.829 1.00 4.13 H new ATOM 0 HE2 PHE A 124 22.589 -14.643 27.791 1.00 12.31 H new ATOM 0 HZ PHE A 124 22.273 -13.041 29.634 1.00 4.45 H new ATOM 1801 N PHE A 125 18.688 -11.692 23.553 1.00 45.31 N ATOM 1802 CA PHE A 125 19.610 -10.895 22.751 1.00 13.21 C ATOM 1803 C PHE A 125 19.038 -10.639 21.360 1.00 40.43 C ATOM 1804 O PHE A 125 19.577 -11.086 20.347 1.00 2.03 O ATOM 1805 CB PHE A 125 20.962 -11.601 22.637 1.00 62.31 C ATOM 1806 CG PHE A 125 21.818 -11.459 23.863 1.00 62.02 C ATOM 1807 CD1 PHE A 125 22.060 -10.211 24.414 1.00 21.11 C ATOM 1808 CD2 PHE A 125 22.381 -12.573 24.464 1.00 64.33 C ATOM 1809 CE1 PHE A 125 22.847 -10.077 25.542 1.00 0.35 C ATOM 1810 CE2 PHE A 125 23.169 -12.445 25.592 1.00 32.13 C ATOM 1811 CZ PHE A 125 23.403 -11.195 26.132 1.00 71.34 C ATOM 0 H PHE A 125 18.051 -12.274 23.010 1.00 45.31 H new ATOM 0 HA PHE A 125 19.750 -9.936 23.249 1.00 13.21 H new ATOM 0 HB2 PHE A 125 20.794 -12.660 22.441 1.00 62.31 H new ATOM 0 HB3 PHE A 125 21.501 -11.200 21.779 1.00 62.31 H new ATOM 0 HD1 PHE A 125 21.629 -9.333 23.957 1.00 21.11 H new ATOM 0 HD2 PHE A 125 22.202 -13.553 24.046 1.00 64.33 H new ATOM 0 HE1 PHE A 125 23.027 -9.098 25.962 1.00 0.35 H new ATOM 0 HE2 PHE A 125 23.602 -13.322 26.051 1.00 32.13 H new ATOM 0 HZ PHE A 125 24.019 -11.092 27.013 1.00 71.34 H new ATOM 1821 N PRO A 126 17.919 -9.901 21.307 1.00 32.21 N ATOM 1822 CA PRO A 126 17.249 -9.568 20.047 1.00 73.35 C ATOM 1823 C PRO A 126 18.054 -8.584 19.204 1.00 34.25 C ATOM 1824 O PRO A 126 18.272 -8.804 18.013 1.00 24.30 O ATOM 1825 CB PRO A 126 15.933 -8.932 20.502 1.00 42.45 C ATOM 1826 CG PRO A 126 16.223 -8.394 21.860 1.00 13.23 C ATOM 1827 CD PRO A 126 17.222 -9.335 22.474 1.00 34.32 C ATOM 0 HA PRO A 126 17.117 -10.444 19.412 1.00 73.35 H new ATOM 0 HB2 PRO A 126 15.619 -8.141 19.821 1.00 42.45 H new ATOM 0 HB3 PRO A 126 15.128 -9.666 20.530 1.00 42.45 H new ATOM 0 HG2 PRO A 126 16.625 -7.382 21.801 1.00 13.23 H new ATOM 0 HG3 PRO A 126 15.315 -8.342 22.461 1.00 13.23 H new ATOM 0 HD2 PRO A 126 17.910 -8.813 23.139 1.00 34.32 H new ATOM 0 HD3 PRO A 126 16.734 -10.110 23.065 1.00 34.32 H new ATOM 1835 N LYS A 127 18.493 -7.498 19.831 1.00 51.11 N ATOM 1836 CA LYS A 127 19.276 -6.480 19.140 1.00 14.23 C ATOM 1837 C LYS A 127 20.577 -7.066 18.602 1.00 31.11 C ATOM 1838 O LYS A 127 21.041 -6.689 17.526 1.00 40.20 O ATOM 1839 CB LYS A 127 19.581 -5.314 20.084 1.00 33.52 C ATOM 1840 CG LYS A 127 20.093 -5.752 21.445 1.00 32.34 C ATOM 1841 CD LYS A 127 21.015 -4.710 22.056 1.00 71.31 C ATOM 1842 CE LYS A 127 20.295 -3.389 22.275 1.00 52.52 C ATOM 1843 NZ LYS A 127 20.678 -2.756 23.567 1.00 14.33 N ATOM 0 H LYS A 127 18.320 -7.300 20.817 1.00 51.11 H new ATOM 0 HA LYS A 127 18.688 -6.114 18.298 1.00 14.23 H new ATOM 0 HB2 LYS A 127 20.322 -4.664 19.618 1.00 33.52 H new ATOM 0 HB3 LYS A 127 18.677 -4.721 20.219 1.00 33.52 H new ATOM 0 HG2 LYS A 127 19.250 -5.929 22.112 1.00 32.34 H new ATOM 0 HG3 LYS A 127 20.626 -6.698 21.347 1.00 32.34 H new ATOM 0 HD2 LYS A 127 21.401 -5.077 23.007 1.00 71.31 H new ATOM 0 HD3 LYS A 127 21.873 -4.554 21.402 1.00 71.31 H new ATOM 0 HE2 LYS A 127 20.526 -2.709 21.455 1.00 52.52 H new ATOM 0 HE3 LYS A 127 19.218 -3.555 22.257 1.00 52.52 H new ATOM 0 HZ1 LYS A 127 20.048 -1.951 23.760 1.00 14.33 H new ATOM 0 HZ2 LYS A 127 20.594 -3.453 24.334 1.00 14.33 H new ATOM 0 HZ3 LYS A 127 21.661 -2.420 23.511 1.00 14.33 H new ATOM 1857 N PHE A 128 21.160 -7.991 19.357 1.00 63.43 N ATOM 1858 CA PHE A 128 22.408 -8.630 18.955 1.00 61.22 C ATOM 1859 C PHE A 128 22.189 -9.542 17.751 1.00 43.32 C ATOM 1860 O PHE A 128 23.121 -9.829 16.998 1.00 54.25 O ATOM 1861 CB PHE A 128 22.992 -9.435 20.118 1.00 13.53 C ATOM 1862 CG PHE A 128 23.585 -10.749 19.700 1.00 60.50 C ATOM 1863 CD1 PHE A 128 22.807 -11.895 19.663 1.00 34.20 C ATOM 1864 CD2 PHE A 128 24.921 -10.840 19.343 1.00 13.32 C ATOM 1865 CE1 PHE A 128 23.350 -13.106 19.279 1.00 24.53 C ATOM 1866 CE2 PHE A 128 25.470 -12.048 18.958 1.00 30.31 C ATOM 1867 CZ PHE A 128 24.683 -13.183 18.925 1.00 3.12 C ATOM 0 H PHE A 128 20.789 -8.315 20.250 1.00 63.43 H new ATOM 0 HA PHE A 128 23.113 -7.848 18.673 1.00 61.22 H new ATOM 0 HB2 PHE A 128 23.760 -8.840 20.612 1.00 13.53 H new ATOM 0 HB3 PHE A 128 22.208 -9.617 20.853 1.00 13.53 H new ATOM 0 HD1 PHE A 128 21.764 -11.841 19.938 1.00 34.20 H new ATOM 0 HD2 PHE A 128 25.541 -9.956 19.366 1.00 13.32 H new ATOM 0 HE1 PHE A 128 22.733 -13.992 19.256 1.00 24.53 H new ATOM 0 HE2 PHE A 128 26.513 -12.105 18.683 1.00 30.31 H new ATOM 0 HZ PHE A 128 25.109 -14.128 18.623 1.00 3.12 H new ATOM 1877 N LEU A 129 20.953 -9.994 17.576 1.00 34.11 N ATOM 1878 CA LEU A 129 20.610 -10.874 16.464 1.00 33.02 C ATOM 1879 C LEU A 129 20.108 -10.071 15.269 1.00 54.52 C ATOM 1880 O LEU A 129 20.749 -10.035 14.219 1.00 43.42 O ATOM 1881 CB LEU A 129 19.546 -11.885 16.897 1.00 40.40 C ATOM 1882 CG LEU A 129 20.058 -13.127 17.627 1.00 11.20 C ATOM 1883 CD1 LEU A 129 18.898 -14.017 18.045 1.00 55.52 C ATOM 1884 CD2 LEU A 129 21.034 -13.897 16.749 1.00 12.14 C ATOM 0 H LEU A 129 20.171 -9.766 18.190 1.00 34.11 H new ATOM 0 HA LEU A 129 21.511 -11.410 16.166 1.00 33.02 H new ATOM 0 HB2 LEU A 129 18.832 -11.376 17.545 1.00 40.40 H new ATOM 0 HB3 LEU A 129 18.999 -12.208 16.011 1.00 40.40 H new ATOM 0 HG LEU A 129 20.584 -12.805 18.526 1.00 11.20 H new ATOM 0 HD11 LEU A 129 19.282 -14.896 18.563 1.00 55.52 H new ATOM 0 HD12 LEU A 129 18.236 -13.463 18.711 1.00 55.52 H new ATOM 0 HD13 LEU A 129 18.343 -14.331 17.161 1.00 55.52 H new ATOM 0 HD21 LEU A 129 21.388 -14.778 17.285 1.00 12.14 H new ATOM 0 HD22 LEU A 129 20.532 -14.207 15.832 1.00 12.14 H new ATOM 0 HD23 LEU A 129 21.882 -13.258 16.500 1.00 12.14 H new ATOM 1896 N ARG A 130 18.958 -9.426 15.437 1.00 53.32 N ATOM 1897 CA ARG A 130 18.370 -8.622 14.372 1.00 1.40 C ATOM 1898 C ARG A 130 18.113 -9.469 13.129 1.00 31.15 C ATOM 1899 O ARG A 130 18.535 -9.118 12.027 1.00 32.11 O ATOM 1900 CB ARG A 130 19.289 -7.450 14.022 1.00 25.10 C ATOM 1901 CG ARG A 130 19.433 -6.433 15.142 1.00 0.22 C ATOM 1902 CD ARG A 130 18.685 -5.147 14.826 1.00 4.20 C ATOM 1903 NE ARG A 130 17.918 -4.664 15.971 1.00 23.01 N ATOM 1904 CZ ARG A 130 16.720 -5.131 16.302 1.00 15.31 C ATOM 1905 NH1 ARG A 130 16.154 -6.088 15.579 1.00 2.41 N ATOM 1906 NH2 ARG A 130 16.084 -4.641 17.359 1.00 51.43 N ATOM 0 H ARG A 130 18.415 -9.445 16.300 1.00 53.32 H new ATOM 0 HA ARG A 130 17.416 -8.233 14.729 1.00 1.40 H new ATOM 0 HB2 ARG A 130 20.275 -7.837 13.765 1.00 25.10 H new ATOM 0 HB3 ARG A 130 18.902 -6.948 13.135 1.00 25.10 H new ATOM 0 HG2 ARG A 130 19.053 -6.857 16.071 1.00 0.22 H new ATOM 0 HG3 ARG A 130 20.488 -6.212 15.301 1.00 0.22 H new ATOM 0 HD2 ARG A 130 19.396 -4.381 14.517 1.00 4.20 H new ATOM 0 HD3 ARG A 130 18.013 -5.316 13.985 1.00 4.20 H new ATOM 0 HE ARG A 130 18.325 -3.928 16.548 1.00 23.01 H new ATOM 0 HH11 ARG A 130 16.639 -6.467 14.766 1.00 2.41 H new ATOM 0 HH12 ARG A 130 15.234 -6.445 15.836 1.00 2.41 H new ATOM 0 HH21 ARG A 130 16.516 -3.905 17.918 1.00 51.43 H new ATOM 0 HH22 ARG A 130 15.164 -5.001 17.612 1.00 51.43 H new ATOM 1920 N CYS A 131 17.419 -10.587 13.315 1.00 15.32 N ATOM 1921 CA CYS A 131 17.105 -11.486 12.211 1.00 44.50 C ATOM 1922 C CYS A 131 15.924 -12.385 12.560 1.00 34.44 C ATOM 1923 O CYS A 131 15.737 -12.762 13.717 1.00 45.43 O ATOM 1924 CB CYS A 131 18.325 -12.340 11.860 1.00 71.20 C ATOM 1925 SG CYS A 131 18.314 -13.998 12.616 1.00 52.42 S ATOM 0 H CYS A 131 17.063 -10.892 14.221 1.00 15.32 H new ATOM 0 HA CYS A 131 16.833 -10.880 11.347 1.00 44.50 H new ATOM 0 HB2 CYS A 131 18.381 -12.447 10.777 1.00 71.20 H new ATOM 0 HB3 CYS A 131 19.226 -11.814 12.176 1.00 71.20 H new ATOM 1930 N ASN A 132 15.128 -12.726 11.552 1.00 61.43 N ATOM 1931 CA ASN A 132 13.964 -13.582 11.752 1.00 50.22 C ATOM 1932 C ASN A 132 14.386 -14.980 12.192 1.00 72.54 C ATOM 1933 O ASN A 132 15.081 -15.687 11.462 1.00 33.35 O ATOM 1934 CB ASN A 132 13.140 -13.666 10.465 1.00 20.34 C ATOM 1935 CG ASN A 132 14.006 -13.856 9.235 1.00 4.33 C ATOM 1936 OD1 ASN A 132 14.586 -14.922 9.029 1.00 44.20 O ATOM 1937 ND2 ASN A 132 14.098 -12.819 8.411 1.00 2.51 N ATOM 0 H ASN A 132 15.268 -12.423 10.588 1.00 61.43 H new ATOM 0 HA ASN A 132 13.352 -13.143 12.539 1.00 50.22 H new ATOM 0 HB2 ASN A 132 12.436 -14.494 10.541 1.00 20.34 H new ATOM 0 HB3 ASN A 132 12.551 -12.756 10.354 1.00 20.34 H new ATOM 0 HD21 ASN A 132 14.667 -12.887 7.567 1.00 2.51 H new ATOM 0 HD22 ASN A 132 13.600 -11.954 8.622 1.00 2.51 H new ATOM 1944 N GLU A 133 13.960 -15.372 13.388 1.00 33.43 N ATOM 1945 CA GLU A 133 14.294 -16.687 13.925 1.00 52.53 C ATOM 1946 C GLU A 133 13.063 -17.587 13.963 1.00 33.44 C ATOM 1947 O GLU A 133 13.040 -18.655 13.350 1.00 23.23 O ATOM 1948 CB GLU A 133 14.886 -16.553 15.329 1.00 20.13 C ATOM 1949 CG GLU A 133 16.293 -17.114 15.452 1.00 33.15 C ATOM 1950 CD GLU A 133 17.132 -16.366 16.470 1.00 31.54 C ATOM 1951 OE1 GLU A 133 16.552 -15.598 17.266 1.00 5.41 O ATOM 1952 OE2 GLU A 133 18.367 -16.550 16.471 1.00 10.44 O ATOM 0 H GLU A 133 13.383 -14.799 14.004 1.00 33.43 H new ATOM 0 HA GLU A 133 15.035 -17.143 13.268 1.00 52.53 H new ATOM 0 HB2 GLU A 133 14.898 -15.500 15.610 1.00 20.13 H new ATOM 0 HB3 GLU A 133 14.236 -17.065 16.039 1.00 20.13 H new ATOM 0 HG2 GLU A 133 16.238 -18.165 15.734 1.00 33.15 H new ATOM 0 HG3 GLU A 133 16.784 -17.071 14.480 1.00 33.15 H new ATOM 1959 N THR A 134 12.039 -17.150 14.690 1.00 53.55 N ATOM 1960 CA THR A 134 10.805 -17.915 14.811 1.00 73.53 C ATOM 1961 C THR A 134 9.667 -17.249 14.046 1.00 34.03 C ATOM 1962 O THR A 134 8.495 -17.568 14.253 1.00 21.54 O ATOM 1963 CB THR A 134 10.390 -18.082 16.285 1.00 75.44 C ATOM 1964 OG1 THR A 134 10.379 -16.808 16.938 1.00 72.12 O ATOM 1965 CG2 THR A 134 11.339 -19.022 17.011 1.00 24.53 C ATOM 0 H THR A 134 12.041 -16.269 15.204 1.00 53.55 H new ATOM 0 HA THR A 134 11.000 -18.898 14.382 1.00 73.53 H new ATOM 0 HB THR A 134 9.389 -18.512 16.311 1.00 75.44 H new ATOM 0 HG1 THR A 134 10.113 -16.923 17.874 1.00 72.12 H new ATOM 0 HG21 THR A 134 11.026 -19.124 18.050 1.00 24.53 H new ATOM 0 HG22 THR A 134 11.322 -20.000 16.529 1.00 24.53 H new ATOM 0 HG23 THR A 134 12.350 -18.617 16.975 1.00 24.53 H new ATOM 1973 N LEU A 135 10.017 -16.322 13.162 1.00 65.34 N ATOM 1974 CA LEU A 135 9.024 -15.611 12.365 1.00 44.55 C ATOM 1975 C LEU A 135 8.635 -16.419 11.131 1.00 44.21 C ATOM 1976 O LEU A 135 7.570 -17.035 11.090 1.00 24.31 O ATOM 1977 CB LEU A 135 9.565 -14.243 11.943 1.00 71.12 C ATOM 1978 CG LEU A 135 9.836 -13.251 13.074 1.00 51.50 C ATOM 1979 CD1 LEU A 135 10.817 -12.180 12.621 1.00 22.44 C ATOM 1980 CD2 LEU A 135 8.537 -12.618 13.551 1.00 12.02 C ATOM 0 H LEU A 135 10.981 -16.045 12.979 1.00 65.34 H new ATOM 0 HA LEU A 135 8.135 -15.470 12.979 1.00 44.55 H new ATOM 0 HB2 LEU A 135 10.492 -14.396 11.391 1.00 71.12 H new ATOM 0 HB3 LEU A 135 8.853 -13.790 11.252 1.00 71.12 H new ATOM 0 HG LEU A 135 10.281 -13.794 13.908 1.00 51.50 H new ATOM 0 HD11 LEU A 135 10.998 -11.483 13.439 1.00 22.44 H new ATOM 0 HD12 LEU A 135 11.757 -12.648 12.328 1.00 22.44 H new ATOM 0 HD13 LEU A 135 10.400 -11.641 11.770 1.00 22.44 H new ATOM 0 HD21 LEU A 135 8.749 -11.915 14.356 1.00 12.02 H new ATOM 0 HD22 LEU A 135 8.064 -12.090 12.723 1.00 12.02 H new ATOM 0 HD23 LEU A 135 7.866 -13.396 13.916 1.00 12.02 H new ATOM 1992 N PHE A 136 9.506 -16.413 10.127 1.00 25.23 N ATOM 1993 CA PHE A 136 9.255 -17.147 8.892 1.00 11.14 C ATOM 1994 C PHE A 136 10.533 -17.281 8.069 1.00 12.14 C ATOM 1995 O PHE A 136 10.645 -16.757 6.961 1.00 62.11 O ATOM 1996 CB PHE A 136 8.175 -16.444 8.068 1.00 51.35 C ATOM 1997 CG PHE A 136 6.790 -16.963 8.327 1.00 54.31 C ATOM 1998 CD1 PHE A 136 6.437 -18.250 7.955 1.00 13.10 C ATOM 1999 CD2 PHE A 136 5.840 -16.163 8.942 1.00 31.13 C ATOM 2000 CE1 PHE A 136 5.163 -18.731 8.193 1.00 53.24 C ATOM 2001 CE2 PHE A 136 4.565 -16.639 9.183 1.00 53.41 C ATOM 2002 CZ PHE A 136 4.225 -17.923 8.806 1.00 23.55 C ATOM 0 H PHE A 136 10.392 -15.908 10.145 1.00 25.23 H new ATOM 0 HA PHE A 136 8.908 -18.146 9.156 1.00 11.14 H new ATOM 0 HB2 PHE A 136 8.201 -15.376 8.286 1.00 51.35 H new ATOM 0 HB3 PHE A 136 8.405 -16.559 7.009 1.00 51.35 H new ATOM 0 HD1 PHE A 136 7.166 -18.885 7.473 1.00 13.10 H new ATOM 0 HD2 PHE A 136 6.099 -15.157 9.236 1.00 31.13 H new ATOM 0 HE1 PHE A 136 4.901 -19.737 7.900 1.00 53.24 H new ATOM 0 HE2 PHE A 136 3.835 -16.007 9.666 1.00 53.41 H new ATOM 0 HZ PHE A 136 3.228 -18.295 8.990 1.00 23.55 H new ATOM 2012 N PRO A 137 11.521 -17.999 8.624 1.00 35.11 N ATOM 2013 CA PRO A 137 12.809 -18.219 7.960 1.00 75.34 C ATOM 2014 C PRO A 137 12.687 -19.139 6.749 1.00 13.04 C ATOM 2015 O PRO A 137 11.583 -19.464 6.312 1.00 75.42 O ATOM 2016 CB PRO A 137 13.661 -18.877 9.048 1.00 60.15 C ATOM 2017 CG PRO A 137 12.677 -19.529 9.957 1.00 5.43 C ATOM 2018 CD PRO A 137 11.456 -18.652 9.942 1.00 32.14 C ATOM 0 HA PRO A 137 13.231 -17.292 7.571 1.00 75.34 H new ATOM 0 HB2 PRO A 137 14.351 -19.606 8.624 1.00 60.15 H new ATOM 0 HB3 PRO A 137 14.263 -18.140 9.579 1.00 60.15 H new ATOM 0 HG2 PRO A 137 12.438 -20.536 9.616 1.00 5.43 H new ATOM 0 HG3 PRO A 137 13.079 -19.621 10.966 1.00 5.43 H new ATOM 0 HD2 PRO A 137 10.542 -19.234 10.057 1.00 32.14 H new ATOM 0 HD3 PRO A 137 11.474 -17.924 10.753 1.00 32.14 H new ATOM 2026 N THR A 138 13.829 -19.556 6.212 1.00 73.34 N ATOM 2027 CA THR A 138 13.850 -20.438 5.051 1.00 31.15 C ATOM 2028 C THR A 138 13.105 -19.817 3.875 1.00 24.01 C ATOM 2029 O THR A 138 11.875 -19.836 3.825 1.00 3.14 O ATOM 2030 CB THR A 138 13.224 -21.808 5.375 1.00 13.33 C ATOM 2031 OG1 THR A 138 12.828 -21.853 6.751 1.00 44.32 O ATOM 2032 CG2 THR A 138 14.206 -22.933 5.087 1.00 34.35 C ATOM 0 H THR A 138 14.751 -19.297 6.562 1.00 73.34 H new ATOM 0 HA THR A 138 14.896 -20.580 4.781 1.00 31.15 H new ATOM 0 HB THR A 138 12.347 -21.941 4.741 1.00 13.33 H new ATOM 0 HG1 THR A 138 12.430 -22.726 6.948 1.00 44.32 H new ATOM 0 HG21 THR A 138 13.742 -23.891 5.323 1.00 34.35 H new ATOM 0 HG22 THR A 138 14.482 -22.914 4.033 1.00 34.35 H new ATOM 0 HG23 THR A 138 15.099 -22.802 5.698 1.00 34.35 H new ATOM 2040 N LYS A 139 13.858 -19.267 2.928 1.00 22.14 N ATOM 2041 CA LYS A 139 13.270 -18.641 1.750 1.00 63.41 C ATOM 2042 C LYS A 139 12.282 -19.583 1.070 1.00 61.44 C ATOM 2043 O LYS A 139 12.286 -20.789 1.320 1.00 50.03 O ATOM 2044 CB LYS A 139 14.367 -18.235 0.762 1.00 34.33 C ATOM 2045 CG LYS A 139 15.060 -19.416 0.104 1.00 52.41 C ATOM 2046 CD LYS A 139 14.501 -19.688 -1.283 1.00 10.14 C ATOM 2047 CE LYS A 139 14.877 -21.078 -1.772 1.00 32.22 C ATOM 2048 NZ LYS A 139 13.954 -22.121 -1.243 1.00 3.43 N ATOM 0 H LYS A 139 14.877 -19.242 2.954 1.00 22.14 H new ATOM 0 HA LYS A 139 12.732 -17.750 2.073 1.00 63.41 H new ATOM 0 HB2 LYS A 139 13.932 -17.603 -0.012 1.00 34.33 H new ATOM 0 HB3 LYS A 139 15.110 -17.633 1.285 1.00 34.33 H new ATOM 0 HG2 LYS A 139 16.130 -19.219 0.034 1.00 52.41 H new ATOM 0 HG3 LYS A 139 14.940 -20.303 0.726 1.00 52.41 H new ATOM 0 HD2 LYS A 139 13.416 -19.589 -1.265 1.00 10.14 H new ATOM 0 HD3 LYS A 139 14.878 -18.941 -1.981 1.00 10.14 H new ATOM 0 HE2 LYS A 139 14.860 -21.097 -2.862 1.00 32.22 H new ATOM 0 HE3 LYS A 139 15.898 -21.307 -1.466 1.00 32.22 H new ATOM 0 HZ1 LYS A 139 14.506 -22.942 -0.922 1.00 3.43 H new ATOM 0 HZ2 LYS A 139 13.413 -21.733 -0.444 1.00 3.43 H new ATOM 0 HZ3 LYS A 139 13.298 -22.417 -1.994 1.00 3.43 H new TER 2062 LYS A 139