USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=32 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 121 ASN : amide:sc= -1.54 K(o=-1.5,f=-0.6) USER MOD Set 1.2: A 122 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 35 ASN : amide:sc= -4.9! C(o=-4.9!,f=-6.8!) USER MOD Set 2.2: A 89 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.137) USER MOD Set 3.1: A 28 TYR OH : rot 70:sc= 0.561 USER MOD Set 3.2: A 47 SER OG : rot -136:sc= 1.89 USER MOD Single : A 12 SER OG : rot -7:sc= 0.744 USER MOD Single : A 19 SER OG : rot 34:sc= 0.97 USER MOD Single : A 20 HIS : no HD1:sc=-0.00543 K(o=-0.0054,f=-0.89) USER MOD Single : A 21 MET CE :methyl 163:sc= -2.91 (180deg=-4.36!) USER MOD Single : A 30 THR OG1 : rot -150:sc= 0.0702 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.0219 X(o=-0.022,f=0) USER MOD Single : A 34 THR OG1 : rot 170:sc= -0.119 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+ -169:sc= 0 (180deg=-0.0739) USER MOD Single : A 44 TYR OH : rot 43:sc= 1.22 USER MOD Single : A 48 SER OG : rot -100:sc= -0.567 USER MOD Single : A 52 THR OG1 : rot 25:sc= 0.0167 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 130:sc= -0.577 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.406 X(o=-0.41,f=-0.14) USER MOD Single : A 63 LYS NZ :NH3+ 163:sc= -0.659 (180deg=-1.27) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 67 TYR OH : rot -33:sc= -0.0577! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -126:sc= -0.0869 (180deg=-0.655) 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= -1.13 X(o=-1.1,f=-0.68) 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= -0.544 X(o=-0.54,f=-0.19) USER MOD Single : A 100 MET CE :methyl 139:sc= -1.82 (180deg=-6.63!) USER MOD Single : A 102 TYR OH : rot 152:sc= 1.19 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 -122:sc= -2.02 (180deg=-7.21!) USER MOD Single : A 112 THR OG1 : rot -49:sc= 0.26 USER MOD Single : A 113 MET CE :methyl -126:sc= -1.19 (180deg=-4.98!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.0175 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 ASN : amide:sc= -0.056 X(o=-0.056,f=-0.091) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.0033 USER MOD Single : A 138 THR OG1 : rot -139:sc= -0.28 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 1.157 0.811 0.500 1.00 32.12 N ATOM 2 CA SER A 12 1.807 -0.399 0.990 1.00 12.13 C ATOM 3 C SER A 12 3.286 -0.411 0.616 1.00 11.41 C ATOM 4 O SER A 12 3.713 0.298 -0.294 1.00 41.30 O ATOM 5 CB SER A 12 1.116 -1.640 0.423 1.00 73.22 C ATOM 6 OG SER A 12 0.330 -1.313 -0.710 1.00 73.21 O ATOM 0 HA SER A 12 1.725 -0.411 2.077 1.00 12.13 H new ATOM 0 HB2 SER A 12 1.864 -2.383 0.148 1.00 73.22 H new ATOM 0 HB3 SER A 12 0.485 -2.091 1.189 1.00 73.22 H new ATOM 0 HG SER A 12 0.306 -0.340 -0.821 1.00 73.21 H new ATOM 12 N GLY A 13 4.063 -1.222 1.327 1.00 64.24 N ATOM 13 CA GLY A 13 5.486 -1.312 1.055 1.00 2.04 C ATOM 14 C GLY A 13 6.053 -2.681 1.378 1.00 54.53 C ATOM 15 O GLY A 13 7.002 -2.801 2.153 1.00 10.13 O ATOM 0 H GLY A 13 3.733 -1.818 2.086 1.00 64.24 H new ATOM 0 HA2 GLY A 13 5.667 -1.086 0.004 1.00 2.04 H new ATOM 0 HA3 GLY A 13 6.013 -0.557 1.639 1.00 2.04 H new ATOM 19 N LEU A 14 5.469 -3.715 0.783 1.00 23.42 N ATOM 20 CA LEU A 14 5.921 -5.084 1.012 1.00 13.43 C ATOM 21 C LEU A 14 5.433 -6.011 -0.096 1.00 54.21 C ATOM 22 O LEU A 14 4.262 -6.391 -0.131 1.00 63.33 O ATOM 23 CB LEU A 14 5.423 -5.585 2.369 1.00 73.42 C ATOM 24 CG LEU A 14 6.118 -6.831 2.920 1.00 0.43 C ATOM 25 CD1 LEU A 14 5.976 -6.896 4.433 1.00 52.40 C ATOM 26 CD2 LEU A 14 5.552 -8.087 2.275 1.00 21.31 C ATOM 0 H LEU A 14 4.682 -3.632 0.139 1.00 23.42 H new ATOM 0 HA LEU A 14 7.011 -5.087 1.008 1.00 13.43 H new ATOM 0 HB2 LEU A 14 5.535 -4.780 3.095 1.00 73.42 H new ATOM 0 HB3 LEU A 14 4.356 -5.794 2.288 1.00 73.42 H new ATOM 0 HG LEU A 14 7.179 -6.769 2.677 1.00 0.43 H new ATOM 0 HD11 LEU A 14 6.477 -7.789 4.807 1.00 52.40 H new ATOM 0 HD12 LEU A 14 6.430 -6.011 4.879 1.00 52.40 H new ATOM 0 HD13 LEU A 14 4.919 -6.934 4.698 1.00 52.40 H new ATOM 0 HD21 LEU A 14 6.058 -8.963 2.679 1.00 21.31 H new ATOM 0 HD22 LEU A 14 4.485 -8.155 2.486 1.00 21.31 H new ATOM 0 HD23 LEU A 14 5.707 -8.044 1.197 1.00 21.31 H new ATOM 38 N VAL A 15 6.338 -6.373 -0.999 1.00 42.14 N ATOM 39 CA VAL A 15 6.001 -7.259 -2.107 1.00 41.55 C ATOM 40 C VAL A 15 5.312 -8.524 -1.609 1.00 62.14 C ATOM 41 O VAL A 15 5.753 -9.166 -0.656 1.00 34.23 O ATOM 42 CB VAL A 15 7.254 -7.652 -2.913 1.00 12.04 C ATOM 43 CG1 VAL A 15 8.278 -8.326 -2.012 1.00 53.10 C ATOM 44 CG2 VAL A 15 6.877 -8.557 -4.075 1.00 74.35 C ATOM 0 H VAL A 15 7.311 -6.066 -0.985 1.00 42.14 H new ATOM 0 HA VAL A 15 5.319 -6.709 -2.756 1.00 41.55 H new ATOM 0 HB VAL A 15 7.703 -6.746 -3.319 1.00 12.04 H new ATOM 0 HG11 VAL A 15 9.156 -8.597 -2.598 1.00 53.10 H new ATOM 0 HG12 VAL A 15 8.570 -7.640 -1.216 1.00 53.10 H new ATOM 0 HG13 VAL A 15 7.843 -9.225 -1.575 1.00 53.10 H new ATOM 0 HG21 VAL A 15 7.774 -8.825 -4.633 1.00 74.35 H new ATOM 0 HG22 VAL A 15 6.404 -9.462 -3.693 1.00 74.35 H new ATOM 0 HG23 VAL A 15 6.183 -8.034 -4.733 1.00 74.35 H new ATOM 54 N PRO A 16 4.205 -8.894 -2.269 1.00 55.44 N ATOM 55 CA PRO A 16 3.431 -10.086 -1.912 1.00 60.51 C ATOM 56 C PRO A 16 4.174 -11.378 -2.237 1.00 52.13 C ATOM 57 O PRO A 16 4.179 -11.831 -3.382 1.00 52.41 O ATOM 58 CB PRO A 16 2.171 -9.963 -2.773 1.00 20.15 C ATOM 59 CG PRO A 16 2.588 -9.134 -3.938 1.00 31.00 C ATOM 60 CD PRO A 16 3.622 -8.176 -3.416 1.00 2.44 C ATOM 0 HA PRO A 16 3.229 -10.135 -0.842 1.00 60.51 H new ATOM 0 HB2 PRO A 16 1.812 -10.942 -3.092 1.00 20.15 H new ATOM 0 HB3 PRO A 16 1.359 -9.490 -2.221 1.00 20.15 H new ATOM 0 HG2 PRO A 16 2.999 -9.757 -4.733 1.00 31.00 H new ATOM 0 HG3 PRO A 16 1.738 -8.598 -4.360 1.00 31.00 H new ATOM 0 HD2 PRO A 16 4.374 -7.946 -4.171 1.00 2.44 H new ATOM 0 HD3 PRO A 16 3.176 -7.229 -3.112 1.00 2.44 H new ATOM 68 N ARG A 17 4.800 -11.967 -1.223 1.00 54.54 N ATOM 69 CA ARG A 17 5.546 -13.206 -1.402 1.00 42.14 C ATOM 70 C ARG A 17 5.069 -14.274 -0.423 1.00 24.24 C ATOM 71 O ARG A 17 4.050 -14.107 0.246 1.00 61.53 O ATOM 72 CB ARG A 17 7.043 -12.956 -1.212 1.00 65.34 C ATOM 73 CG ARG A 17 7.550 -11.716 -1.930 1.00 40.10 C ATOM 74 CD ARG A 17 8.764 -12.027 -2.791 1.00 23.22 C ATOM 75 NE ARG A 17 8.771 -11.252 -4.029 1.00 31.32 N ATOM 76 CZ ARG A 17 9.863 -11.034 -4.753 1.00 54.13 C ATOM 77 NH1 ARG A 17 11.030 -11.530 -4.366 1.00 13.43 N ATOM 78 NH2 ARG A 17 9.788 -10.319 -5.868 1.00 42.44 N ATOM 0 H ARG A 17 4.805 -11.606 -0.269 1.00 54.54 H new ATOM 0 HA ARG A 17 5.370 -13.564 -2.416 1.00 42.14 H new ATOM 0 HB2 ARG A 17 7.254 -12.861 -0.147 1.00 65.34 H new ATOM 0 HB3 ARG A 17 7.596 -13.824 -1.570 1.00 65.34 H new ATOM 0 HG2 ARG A 17 6.756 -11.305 -2.554 1.00 40.10 H new ATOM 0 HG3 ARG A 17 7.808 -10.951 -1.198 1.00 40.10 H new ATOM 0 HD2 ARG A 17 9.672 -11.816 -2.226 1.00 23.22 H new ATOM 0 HD3 ARG A 17 8.776 -13.091 -3.029 1.00 23.22 H new ATOM 0 HE ARG A 17 7.889 -10.857 -4.355 1.00 31.32 H new ATOM 0 HH11 ARG A 17 11.091 -12.081 -3.510 1.00 13.43 H new ATOM 0 HH12 ARG A 17 11.867 -11.361 -4.924 1.00 13.43 H new ATOM 0 HH21 ARG A 17 8.892 -9.937 -6.169 1.00 42.44 H new ATOM 0 HH22 ARG A 17 10.627 -10.152 -6.424 1.00 42.44 H new ATOM 92 N GLY A 18 5.815 -15.373 -0.344 1.00 14.44 N ATOM 93 CA GLY A 18 5.452 -16.452 0.556 1.00 72.01 C ATOM 94 C GLY A 18 5.218 -15.971 1.974 1.00 2.03 C ATOM 95 O GLY A 18 4.167 -16.231 2.560 1.00 41.31 O ATOM 0 H GLY A 18 6.663 -15.535 -0.887 1.00 14.44 H new ATOM 0 HA2 GLY A 18 4.550 -16.940 0.188 1.00 72.01 H new ATOM 0 HA3 GLY A 18 6.243 -17.202 0.556 1.00 72.01 H new ATOM 99 N SER A 19 6.201 -15.269 2.529 1.00 43.01 N ATOM 100 CA SER A 19 6.100 -14.755 3.890 1.00 62.22 C ATOM 101 C SER A 19 7.126 -13.652 4.132 1.00 64.51 C ATOM 102 O SER A 19 6.785 -12.470 4.182 1.00 74.41 O ATOM 103 CB SER A 19 6.302 -15.886 4.901 1.00 54.24 C ATOM 104 OG SER A 19 5.084 -16.563 5.158 1.00 14.21 O ATOM 0 H SER A 19 7.077 -15.043 2.057 1.00 43.01 H new ATOM 0 HA SER A 19 5.103 -14.334 4.020 1.00 62.22 H new ATOM 0 HB2 SER A 19 7.040 -16.591 4.520 1.00 54.24 H new ATOM 0 HB3 SER A 19 6.699 -15.480 5.831 1.00 54.24 H new ATOM 0 HG SER A 19 4.542 -16.582 4.342 1.00 14.21 H new ATOM 110 N HIS A 20 8.387 -14.048 4.282 1.00 74.14 N ATOM 111 CA HIS A 20 9.464 -13.094 4.518 1.00 64.10 C ATOM 112 C HIS A 20 10.660 -13.391 3.618 1.00 70.20 C ATOM 113 O HIS A 20 11.178 -14.508 3.606 1.00 55.40 O ATOM 114 CB HIS A 20 9.894 -13.131 5.985 1.00 52.11 C ATOM 115 CG HIS A 20 9.103 -12.212 6.864 1.00 51.52 C ATOM 116 ND1 HIS A 20 7.733 -12.292 6.997 1.00 12.50 N ATOM 117 CD2 HIS A 20 9.498 -11.189 7.658 1.00 14.00 C ATOM 118 CE1 HIS A 20 7.319 -11.357 7.834 1.00 53.23 C ATOM 119 NE2 HIS A 20 8.370 -10.674 8.250 1.00 63.25 N ATOM 0 H HIS A 20 8.687 -15.022 4.244 1.00 74.14 H new ATOM 0 HA HIS A 20 9.092 -12.097 4.281 1.00 64.10 H new ATOM 0 HB2 HIS A 20 9.797 -14.151 6.358 1.00 52.11 H new ATOM 0 HB3 HIS A 20 10.949 -12.866 6.053 1.00 52.11 H new ATOM 0 HD2 HIS A 20 10.511 -10.842 7.800 1.00 14.00 H new ATOM 0 HE1 HIS A 20 6.295 -11.181 8.128 1.00 53.23 H new ATOM 0 HE2 HIS A 20 8.348 -9.892 8.904 1.00 63.25 H new ATOM 127 N MET A 21 11.093 -12.385 2.866 1.00 54.25 N ATOM 128 CA MET A 21 12.228 -12.539 1.963 1.00 55.12 C ATOM 129 C MET A 21 12.556 -11.219 1.272 1.00 72.22 C ATOM 130 O MET A 21 13.719 -10.827 1.181 1.00 63.33 O ATOM 131 CB MET A 21 11.932 -13.616 0.917 1.00 2.11 C ATOM 132 CG MET A 21 10.639 -13.382 0.152 1.00 25.14 C ATOM 133 SD MET A 21 9.769 -14.915 -0.225 1.00 34.23 S ATOM 134 CE MET A 21 9.454 -15.540 1.424 1.00 23.41 C ATOM 0 H MET A 21 10.675 -11.454 2.864 1.00 54.25 H new ATOM 0 HA MET A 21 13.092 -12.844 2.554 1.00 55.12 H new ATOM 0 HB2 MET A 21 12.760 -13.661 0.210 1.00 2.11 H new ATOM 0 HB3 MET A 21 11.882 -14.586 1.411 1.00 2.11 H new ATOM 0 HG2 MET A 21 9.987 -12.733 0.737 1.00 25.14 H new ATOM 0 HG3 MET A 21 10.861 -12.857 -0.777 1.00 25.14 H new ATOM 0 HE1 MET A 21 8.679 -16.305 1.381 1.00 23.41 H new ATOM 0 HE2 MET A 21 10.368 -15.973 1.830 1.00 23.41 H new ATOM 0 HE3 MET A 21 9.123 -14.723 2.066 1.00 23.41 H new ATOM 144 N VAL A 22 11.523 -10.538 0.786 1.00 40.30 N ATOM 145 CA VAL A 22 11.702 -9.262 0.104 1.00 50.41 C ATOM 146 C VAL A 22 10.565 -8.300 0.430 1.00 52.00 C ATOM 147 O VAL A 22 9.470 -8.721 0.803 1.00 73.24 O ATOM 148 CB VAL A 22 11.781 -9.448 -1.423 1.00 55.51 C ATOM 149 CG1 VAL A 22 12.316 -8.188 -2.088 1.00 32.44 C ATOM 150 CG2 VAL A 22 12.644 -10.651 -1.769 1.00 70.21 C ATOM 0 H VAL A 22 10.554 -10.849 0.852 1.00 40.30 H new ATOM 0 HA VAL A 22 12.643 -8.842 0.460 1.00 50.41 H new ATOM 0 HB VAL A 22 10.775 -9.630 -1.802 1.00 55.51 H new ATOM 0 HG11 VAL A 22 12.365 -8.338 -3.166 1.00 32.44 H new ATOM 0 HG12 VAL A 22 11.653 -7.351 -1.868 1.00 32.44 H new ATOM 0 HG13 VAL A 22 13.314 -7.971 -1.707 1.00 32.44 H new ATOM 0 HG21 VAL A 22 12.689 -10.767 -2.852 1.00 70.21 H new ATOM 0 HG22 VAL A 22 13.650 -10.501 -1.378 1.00 70.21 H new ATOM 0 HG23 VAL A 22 12.212 -11.548 -1.325 1.00 70.21 H new ATOM 160 N ARG A 23 10.832 -7.006 0.287 1.00 60.03 N ATOM 161 CA ARG A 23 9.831 -5.984 0.567 1.00 41.43 C ATOM 162 C ARG A 23 10.273 -4.627 0.025 1.00 21.30 C ATOM 163 O ARG A 23 11.460 -4.302 0.032 1.00 4.01 O ATOM 164 CB ARG A 23 9.579 -5.886 2.072 1.00 14.33 C ATOM 165 CG ARG A 23 10.635 -5.086 2.816 1.00 1.54 C ATOM 166 CD ARG A 23 10.338 -5.020 4.306 1.00 31.33 C ATOM 167 NE ARG A 23 10.212 -6.350 4.898 1.00 55.41 N ATOM 168 CZ ARG A 23 9.701 -6.572 6.104 1.00 2.40 C ATOM 169 NH1 ARG A 23 9.271 -5.558 6.843 1.00 45.14 N ATOM 170 NH2 ARG A 23 9.619 -7.810 6.573 1.00 25.15 N ATOM 0 H ARG A 23 11.733 -6.641 -0.021 1.00 60.03 H new ATOM 0 HA ARG A 23 8.905 -6.271 0.068 1.00 41.43 H new ATOM 0 HB2 ARG A 23 8.604 -5.428 2.239 1.00 14.33 H new ATOM 0 HB3 ARG A 23 9.535 -6.891 2.491 1.00 14.33 H new ATOM 0 HG2 ARG A 23 11.614 -5.539 2.659 1.00 1.54 H new ATOM 0 HG3 ARG A 23 10.682 -4.076 2.408 1.00 1.54 H new ATOM 0 HD2 ARG A 23 11.134 -4.472 4.811 1.00 31.33 H new ATOM 0 HD3 ARG A 23 9.416 -4.462 4.468 1.00 31.33 H new ATOM 0 HE ARG A 23 10.534 -7.152 4.356 1.00 55.41 H new ATOM 0 HH11 ARG A 23 9.332 -4.605 6.486 1.00 45.14 H new ATOM 0 HH12 ARG A 23 8.879 -5.732 7.769 1.00 45.14 H new ATOM 0 HH21 ARG A 23 9.948 -8.592 6.008 1.00 25.15 H new ATOM 0 HH22 ARG A 23 9.227 -7.980 7.499 1.00 25.15 H new ATOM 184 N ARG A 24 9.310 -3.841 -0.444 1.00 51.12 N ATOM 185 CA ARG A 24 9.600 -2.521 -0.991 1.00 51.02 C ATOM 186 C ARG A 24 10.119 -1.584 0.096 1.00 74.03 C ATOM 187 O ARG A 24 9.355 -0.825 0.691 1.00 33.24 O ATOM 188 CB ARG A 24 8.347 -1.926 -1.637 1.00 32.44 C ATOM 189 CG ARG A 24 7.701 -2.839 -2.667 1.00 0.43 C ATOM 190 CD ARG A 24 8.420 -2.764 -4.005 1.00 34.32 C ATOM 191 NE ARG A 24 8.488 -1.397 -4.514 1.00 71.43 N ATOM 192 CZ ARG A 24 7.496 -0.808 -5.172 1.00 13.55 C ATOM 193 NH1 ARG A 24 6.365 -1.462 -5.397 1.00 53.55 N ATOM 194 NH2 ARG A 24 7.633 0.439 -5.604 1.00 4.41 N ATOM 0 H ARG A 24 8.322 -4.095 -0.456 1.00 51.12 H new ATOM 0 HA ARG A 24 10.374 -2.632 -1.751 1.00 51.02 H new ATOM 0 HB2 ARG A 24 7.619 -1.699 -0.858 1.00 32.44 H new ATOM 0 HB3 ARG A 24 8.608 -0.981 -2.114 1.00 32.44 H new ATOM 0 HG2 ARG A 24 7.713 -3.866 -2.303 1.00 0.43 H new ATOM 0 HG3 ARG A 24 6.656 -2.560 -2.798 1.00 0.43 H new ATOM 0 HD2 ARG A 24 9.429 -3.161 -3.897 1.00 34.32 H new ATOM 0 HD3 ARG A 24 7.905 -3.395 -4.729 1.00 34.32 H new ATOM 0 HE ARG A 24 9.344 -0.866 -4.356 1.00 71.43 H new ATOM 0 HH11 ARG A 24 6.255 -2.420 -5.064 1.00 53.55 H new ATOM 0 HH12 ARG A 24 5.605 -1.007 -5.903 1.00 53.55 H new ATOM 0 HH21 ARG A 24 8.501 0.946 -5.431 1.00 4.41 H new ATOM 0 HH22 ARG A 24 6.871 0.890 -6.109 1.00 4.41 H new ATOM 208 N ALA A 25 11.422 -1.644 0.349 1.00 40.34 N ATOM 209 CA ALA A 25 12.043 -0.800 1.362 1.00 31.01 C ATOM 210 C ALA A 25 12.908 0.281 0.722 1.00 33.22 C ATOM 211 O ALA A 25 13.363 0.134 -0.412 1.00 61.21 O ATOM 212 CB ALA A 25 12.872 -1.646 2.317 1.00 44.20 C ATOM 0 H ALA A 25 12.068 -2.268 -0.134 1.00 40.34 H new ATOM 0 HA ALA A 25 11.250 -0.307 1.925 1.00 31.01 H new ATOM 0 HB1 ALA A 25 13.330 -1.003 3.068 1.00 44.20 H new ATOM 0 HB2 ALA A 25 12.229 -2.377 2.808 1.00 44.20 H new ATOM 0 HB3 ALA A 25 13.652 -2.165 1.760 1.00 44.20 H new ATOM 218 N ARG A 26 13.129 1.366 1.456 1.00 4.32 N ATOM 219 CA ARG A 26 13.938 2.473 0.959 1.00 62.31 C ATOM 220 C ARG A 26 15.424 2.128 1.013 1.00 75.42 C ATOM 221 O ARG A 26 15.894 1.507 1.967 1.00 14.30 O ATOM 222 CB ARG A 26 13.668 3.738 1.776 1.00 74.43 C ATOM 223 CG ARG A 26 13.962 5.024 1.022 1.00 52.04 C ATOM 224 CD ARG A 26 12.681 5.733 0.609 1.00 4.45 C ATOM 225 NE ARG A 26 11.914 6.192 1.764 1.00 33.12 N ATOM 226 CZ ARG A 26 10.704 6.734 1.674 1.00 22.23 C ATOM 227 NH1 ARG A 26 10.128 6.884 0.490 1.00 74.32 N ATOM 228 NH2 ARG A 26 10.069 7.126 2.771 1.00 53.50 N ATOM 0 H ARG A 26 12.759 1.503 2.397 1.00 4.32 H new ATOM 0 HA ARG A 26 13.661 2.654 -0.080 1.00 62.31 H new ATOM 0 HB2 ARG A 26 12.624 3.742 2.090 1.00 74.43 H new ATOM 0 HB3 ARG A 26 14.274 3.711 2.682 1.00 74.43 H new ATOM 0 HG2 ARG A 26 14.560 5.686 1.649 1.00 52.04 H new ATOM 0 HG3 ARG A 26 14.557 4.800 0.137 1.00 52.04 H new ATOM 0 HD2 ARG A 26 12.926 6.585 -0.025 1.00 4.45 H new ATOM 0 HD3 ARG A 26 12.069 5.057 0.012 1.00 4.45 H new ATOM 0 HE ARG A 26 12.330 6.091 2.690 1.00 33.12 H new ATOM 0 HH11 ARG A 26 10.613 6.583 -0.355 1.00 74.32 H new ATOM 0 HH12 ARG A 26 9.199 7.300 0.424 1.00 74.32 H new ATOM 0 HH21 ARG A 26 10.510 7.011 3.684 1.00 53.50 H new ATOM 0 HH22 ARG A 26 9.140 7.542 2.702 1.00 53.50 H new ATOM 242 N CYS A 27 16.158 2.533 -0.018 1.00 74.00 N ATOM 243 CA CYS A 27 17.589 2.267 -0.090 1.00 21.41 C ATOM 244 C CYS A 27 18.382 3.569 -0.164 1.00 34.53 C ATOM 245 O CYS A 27 18.017 4.489 -0.896 1.00 21.12 O ATOM 246 CB CYS A 27 17.906 1.394 -1.306 1.00 23.12 C ATOM 247 SG CYS A 27 16.815 -0.054 -1.487 1.00 44.31 S ATOM 0 H CYS A 27 15.784 3.047 -0.816 1.00 74.00 H new ATOM 0 HA CYS A 27 17.880 1.736 0.816 1.00 21.41 H new ATOM 0 HB2 CYS A 27 17.834 2.004 -2.206 1.00 23.12 H new ATOM 0 HB3 CYS A 27 18.938 1.051 -1.234 1.00 23.12 H new ATOM 252 N TYR A 28 19.467 3.638 0.599 1.00 70.30 N ATOM 253 CA TYR A 28 20.310 4.827 0.622 1.00 23.01 C ATOM 254 C TYR A 28 21.776 4.459 0.415 1.00 43.33 C ATOM 255 O TYR A 28 22.217 3.354 0.730 1.00 35.40 O ATOM 256 CB TYR A 28 20.142 5.571 1.948 1.00 42.21 C ATOM 257 CG TYR A 28 20.540 4.753 3.156 1.00 53.51 C ATOM 258 CD1 TYR A 28 21.877 4.570 3.485 1.00 1.15 C ATOM 259 CD2 TYR A 28 19.578 4.163 3.967 1.00 5.52 C ATOM 260 CE1 TYR A 28 22.245 3.823 4.588 1.00 42.21 C ATOM 261 CE2 TYR A 28 19.937 3.416 5.072 1.00 3.32 C ATOM 262 CZ TYR A 28 21.272 3.249 5.378 1.00 33.23 C ATOM 263 OH TYR A 28 21.633 2.504 6.477 1.00 23.05 O ATOM 0 H TYR A 28 19.783 2.885 1.210 1.00 70.30 H new ATOM 0 HA TYR A 28 19.999 5.478 -0.195 1.00 23.01 H new ATOM 0 HB2 TYR A 28 20.741 6.481 1.923 1.00 42.21 H new ATOM 0 HB3 TYR A 28 19.101 5.877 2.054 1.00 42.21 H new ATOM 0 HD1 TYR A 28 22.642 5.019 2.869 1.00 1.15 H new ATOM 0 HD2 TYR A 28 18.532 4.291 3.729 1.00 5.52 H new ATOM 0 HE1 TYR A 28 23.289 3.690 4.830 1.00 42.21 H new ATOM 0 HE2 TYR A 28 19.177 2.965 5.693 1.00 3.32 H new ATOM 0 HH TYR A 28 22.002 3.095 7.166 1.00 23.05 H new ATOM 273 N PRO A 29 22.552 5.409 -0.129 1.00 1.14 N ATOM 274 CA PRO A 29 23.981 5.211 -0.390 1.00 32.41 C ATOM 275 C PRO A 29 24.800 5.138 0.894 1.00 63.31 C ATOM 276 O PRO A 29 24.898 6.115 1.638 1.00 73.45 O ATOM 277 CB PRO A 29 24.368 6.449 -1.202 1.00 63.11 C ATOM 278 CG PRO A 29 23.375 7.487 -0.807 1.00 25.10 C ATOM 279 CD PRO A 29 22.094 6.750 -0.529 1.00 44.21 C ATOM 0 HA PRO A 29 24.175 4.270 -0.904 1.00 32.41 H new ATOM 0 HB2 PRO A 29 25.385 6.768 -0.976 1.00 63.11 H new ATOM 0 HB3 PRO A 29 24.327 6.249 -2.273 1.00 63.11 H new ATOM 0 HG2 PRO A 29 23.711 8.033 0.075 1.00 25.10 H new ATOM 0 HG3 PRO A 29 23.239 8.220 -1.602 1.00 25.10 H new ATOM 0 HD2 PRO A 29 21.518 7.230 0.262 1.00 44.21 H new ATOM 0 HD3 PRO A 29 21.454 6.710 -1.410 1.00 44.21 H new ATOM 287 N THR A 30 25.390 3.974 1.149 1.00 35.44 N ATOM 288 CA THR A 30 26.200 3.773 2.344 1.00 43.22 C ATOM 289 C THR A 30 27.464 4.625 2.300 1.00 70.52 C ATOM 290 O THR A 30 27.589 5.605 3.034 1.00 64.33 O ATOM 291 CB THR A 30 26.597 2.294 2.512 1.00 52.31 C ATOM 292 OG1 THR A 30 25.711 1.461 1.757 1.00 74.51 O ATOM 293 CG2 THR A 30 26.559 1.887 3.977 1.00 2.11 C ATOM 0 H THR A 30 25.322 3.156 0.543 1.00 35.44 H new ATOM 0 HA THR A 30 25.589 4.076 3.195 1.00 43.22 H new ATOM 0 HB THR A 30 27.615 2.169 2.143 1.00 52.31 H new ATOM 0 HG1 THR A 30 25.629 0.588 2.196 1.00 74.51 H new ATOM 0 HG21 THR A 30 26.843 0.839 4.071 1.00 2.11 H new ATOM 0 HG22 THR A 30 27.256 2.504 4.544 1.00 2.11 H new ATOM 0 HG23 THR A 30 25.551 2.026 4.367 1.00 2.11 H new ATOM 301 N SER A 31 28.398 4.244 1.434 1.00 2.41 N ATOM 302 CA SER A 31 29.655 4.972 1.297 1.00 75.13 C ATOM 303 C SER A 31 29.721 5.693 -0.046 1.00 73.23 C ATOM 304 O SER A 31 28.779 5.644 -0.836 1.00 70.02 O ATOM 305 CB SER A 31 30.840 4.015 1.434 1.00 62.25 C ATOM 306 OG SER A 31 30.886 3.442 2.729 1.00 60.43 O ATOM 0 H SER A 31 28.308 3.436 0.817 1.00 2.41 H new ATOM 0 HA SER A 31 29.705 5.716 2.092 1.00 75.13 H new ATOM 0 HB2 SER A 31 30.762 3.226 0.686 1.00 62.25 H new ATOM 0 HB3 SER A 31 31.769 4.551 1.237 1.00 62.25 H new ATOM 0 HG SER A 31 31.651 2.833 2.790 1.00 60.43 H new ATOM 312 N ASN A 32 30.841 6.362 -0.297 1.00 24.01 N ATOM 313 CA ASN A 32 31.032 7.094 -1.544 1.00 12.23 C ATOM 314 C ASN A 32 31.107 6.138 -2.730 1.00 52.02 C ATOM 315 O ASN A 32 30.425 6.327 -3.737 1.00 13.12 O ATOM 316 CB ASN A 32 32.306 7.939 -1.474 1.00 15.02 C ATOM 317 CG ASN A 32 32.015 9.427 -1.511 1.00 2.02 C ATOM 318 OD1 ASN A 32 32.514 10.147 -2.376 1.00 74.33 O ATOM 319 ND2 ASN A 32 31.205 9.895 -0.568 1.00 42.13 N ATOM 0 H ASN A 32 31.631 6.413 0.347 1.00 24.01 H new ATOM 0 HA ASN A 32 30.175 7.752 -1.685 1.00 12.23 H new ATOM 0 HB2 ASN A 32 32.848 7.700 -0.559 1.00 15.02 H new ATOM 0 HB3 ASN A 32 32.958 7.678 -2.308 1.00 15.02 H new ATOM 0 HD21 ASN A 32 30.974 10.888 -0.541 1.00 42.13 H new ATOM 0 HD22 ASN A 32 30.814 9.261 0.129 1.00 42.13 H new ATOM 326 N ALA A 33 31.940 5.111 -2.603 1.00 62.43 N ATOM 327 CA ALA A 33 32.103 4.123 -3.663 1.00 54.32 C ATOM 328 C ALA A 33 31.215 2.907 -3.422 1.00 13.34 C ATOM 329 O ALA A 33 30.409 2.534 -4.275 1.00 64.50 O ATOM 330 CB ALA A 33 33.560 3.701 -3.773 1.00 4.53 C ATOM 0 H ALA A 33 32.513 4.941 -1.776 1.00 62.43 H new ATOM 0 HA ALA A 33 31.798 4.583 -4.603 1.00 54.32 H new ATOM 0 HB1 ALA A 33 33.666 2.963 -4.568 1.00 4.53 H new ATOM 0 HB2 ALA A 33 34.175 4.572 -4.001 1.00 4.53 H new ATOM 0 HB3 ALA A 33 33.885 3.265 -2.828 1.00 4.53 H new ATOM 336 N THR A 34 31.367 2.292 -2.253 1.00 31.00 N ATOM 337 CA THR A 34 30.580 1.117 -1.900 1.00 24.12 C ATOM 338 C THR A 34 30.788 0.735 -0.439 1.00 14.44 C ATOM 339 O THR A 34 31.821 1.045 0.153 1.00 61.43 O ATOM 340 CB THR A 34 30.940 -0.088 -2.789 1.00 65.12 C ATOM 341 OG1 THR A 34 30.346 -1.280 -2.264 1.00 12.05 O ATOM 342 CG2 THR A 34 32.449 -0.264 -2.877 1.00 71.21 C ATOM 0 H THR A 34 32.028 2.588 -1.535 1.00 31.00 H new ATOM 0 HA THR A 34 29.534 1.378 -2.060 1.00 24.12 H new ATOM 0 HB THR A 34 30.552 0.099 -3.790 1.00 65.12 H new ATOM 0 HG1 THR A 34 30.442 -2.007 -2.914 1.00 12.05 H new ATOM 0 HG21 THR A 34 32.679 -1.121 -3.510 1.00 71.21 H new ATOM 0 HG22 THR A 34 32.896 0.633 -3.305 1.00 71.21 H new ATOM 0 HG23 THR A 34 32.855 -0.431 -1.879 1.00 71.21 H new ATOM 350 N ASN A 35 29.798 0.061 0.138 1.00 0.22 N ATOM 351 CA ASN A 35 29.873 -0.363 1.532 1.00 54.24 C ATOM 352 C ASN A 35 30.869 -1.506 1.700 1.00 51.02 C ATOM 353 O ASN A 35 31.011 -2.356 0.820 1.00 41.32 O ATOM 354 CB ASN A 35 28.492 -0.797 2.029 1.00 63.12 C ATOM 355 CG ASN A 35 28.554 -1.486 3.378 1.00 24.32 C ATOM 356 OD1 ASN A 35 28.030 -2.587 3.550 1.00 3.02 O ATOM 357 ND2 ASN A 35 29.197 -0.840 4.344 1.00 41.43 N ATOM 0 H ASN A 35 28.935 -0.203 -0.338 1.00 0.22 H new ATOM 0 HA ASN A 35 30.216 0.484 2.126 1.00 54.24 H new ATOM 0 HB2 ASN A 35 27.843 0.076 2.099 1.00 63.12 H new ATOM 0 HB3 ASN A 35 28.042 -1.471 1.300 1.00 63.12 H new ATOM 0 HD21 ASN A 35 29.271 -1.255 5.273 1.00 41.43 H new ATOM 0 HD22 ASN A 35 29.616 0.071 4.157 1.00 41.43 H new ATOM 364 N THR A 36 31.557 -1.521 2.837 1.00 23.41 N ATOM 365 CA THR A 36 32.541 -2.559 3.121 1.00 14.13 C ATOM 366 C THR A 36 32.179 -3.328 4.387 1.00 55.41 C ATOM 367 O THR A 36 31.479 -2.813 5.260 1.00 42.42 O ATOM 368 CB THR A 36 33.953 -1.966 3.281 1.00 41.30 C ATOM 369 OG1 THR A 36 34.006 -0.661 2.693 1.00 12.13 O ATOM 370 CG2 THR A 36 34.994 -2.863 2.629 1.00 31.42 C ATOM 0 H THR A 36 31.451 -0.826 3.576 1.00 23.41 H new ATOM 0 HA THR A 36 32.535 -3.241 2.270 1.00 14.13 H new ATOM 0 HB THR A 36 34.174 -1.894 4.346 1.00 41.30 H new ATOM 0 HG1 THR A 36 34.907 -0.290 2.800 1.00 12.13 H new ATOM 0 HG21 THR A 36 35.983 -2.423 2.755 1.00 31.42 H new ATOM 0 HG22 THR A 36 34.972 -3.847 3.098 1.00 31.42 H new ATOM 0 HG23 THR A 36 34.774 -2.963 1.566 1.00 31.42 H new ATOM 378 N CYS A 37 32.659 -4.563 4.481 1.00 2.11 N ATOM 379 CA CYS A 37 32.387 -5.404 5.641 1.00 53.45 C ATOM 380 C CYS A 37 33.619 -6.218 6.024 1.00 40.04 C ATOM 381 O CYS A 37 33.918 -7.240 5.405 1.00 4.50 O ATOM 382 CB CYS A 37 31.212 -6.341 5.353 1.00 50.45 C ATOM 383 SG CYS A 37 30.753 -7.410 6.754 1.00 14.42 S ATOM 0 H CYS A 37 33.239 -5.004 3.767 1.00 2.11 H new ATOM 0 HA CYS A 37 32.129 -4.754 6.477 1.00 53.45 H new ATOM 0 HB2 CYS A 37 30.346 -5.744 5.067 1.00 50.45 H new ATOM 0 HB3 CYS A 37 31.463 -6.969 4.498 1.00 50.45 H new ATOM 388 N PHE A 38 34.330 -5.758 7.048 1.00 60.40 N ATOM 389 CA PHE A 38 35.530 -6.443 7.514 1.00 63.12 C ATOM 390 C PHE A 38 36.487 -6.713 6.356 1.00 53.22 C ATOM 391 O PHE A 38 36.818 -7.861 6.065 1.00 63.23 O ATOM 392 CB PHE A 38 35.159 -7.759 8.200 1.00 34.21 C ATOM 393 CG PHE A 38 34.242 -7.583 9.377 1.00 72.52 C ATOM 394 CD1 PHE A 38 34.216 -6.390 10.080 1.00 42.44 C ATOM 395 CD2 PHE A 38 33.405 -8.612 9.780 1.00 44.11 C ATOM 396 CE1 PHE A 38 33.374 -6.226 11.163 1.00 1.22 C ATOM 397 CE2 PHE A 38 32.561 -8.454 10.863 1.00 52.35 C ATOM 398 CZ PHE A 38 32.545 -7.259 11.554 1.00 15.54 C ATOM 0 H PHE A 38 34.096 -4.914 7.571 1.00 60.40 H new ATOM 0 HA PHE A 38 36.031 -5.795 8.233 1.00 63.12 H new ATOM 0 HB2 PHE A 38 34.682 -8.417 7.473 1.00 34.21 H new ATOM 0 HB3 PHE A 38 36.071 -8.257 8.531 1.00 34.21 H new ATOM 0 HD1 PHE A 38 34.861 -5.578 9.778 1.00 42.44 H new ATOM 0 HD2 PHE A 38 33.413 -9.548 9.241 1.00 44.11 H new ATOM 0 HE1 PHE A 38 33.364 -5.291 11.703 1.00 1.22 H new ATOM 0 HE2 PHE A 38 31.915 -9.264 11.168 1.00 52.35 H new ATOM 0 HZ PHE A 38 31.885 -7.132 12.399 1.00 15.54 H new ATOM 408 N GLY A 39 36.926 -5.644 5.698 1.00 61.23 N ATOM 409 CA GLY A 39 37.839 -5.786 4.579 1.00 41.14 C ATOM 410 C GLY A 39 37.126 -6.142 3.290 1.00 75.44 C ATOM 411 O GLY A 39 37.268 -5.451 2.281 1.00 0.35 O ATOM 0 H GLY A 39 36.666 -4.683 5.920 1.00 61.23 H new ATOM 0 HA2 GLY A 39 38.388 -4.854 4.442 1.00 41.14 H new ATOM 0 HA3 GLY A 39 38.574 -6.558 4.809 1.00 41.14 H new ATOM 415 N SER A 40 36.356 -7.226 3.321 1.00 24.10 N ATOM 416 CA SER A 40 35.622 -7.677 2.145 1.00 42.45 C ATOM 417 C SER A 40 34.474 -6.725 1.823 1.00 11.24 C ATOM 418 O SER A 40 33.525 -6.595 2.597 1.00 54.44 O ATOM 419 CB SER A 40 35.081 -9.090 2.365 1.00 21.54 C ATOM 420 OG SER A 40 35.916 -10.058 1.753 1.00 43.30 O ATOM 0 H SER A 40 36.225 -7.808 4.148 1.00 24.10 H new ATOM 0 HA SER A 40 36.311 -7.687 1.300 1.00 42.45 H new ATOM 0 HB2 SER A 40 35.008 -9.292 3.434 1.00 21.54 H new ATOM 0 HB3 SER A 40 34.073 -9.164 1.957 1.00 21.54 H new ATOM 0 HG SER A 40 35.549 -10.953 1.910 1.00 43.30 H new ATOM 426 N LYS A 41 34.568 -6.061 0.676 1.00 15.34 N ATOM 427 CA LYS A 41 33.538 -5.121 0.249 1.00 13.05 C ATOM 428 C LYS A 41 32.271 -5.858 -0.176 1.00 4.45 C ATOM 429 O LYS A 41 32.337 -6.935 -0.770 1.00 2.45 O ATOM 430 CB LYS A 41 34.052 -4.260 -0.906 1.00 54.43 C ATOM 431 CG LYS A 41 35.427 -3.665 -0.657 1.00 12.21 C ATOM 432 CD LYS A 41 35.438 -2.165 -0.901 1.00 22.11 C ATOM 433 CE LYS A 41 35.401 -1.842 -2.387 1.00 15.23 C ATOM 434 NZ LYS A 41 36.705 -2.122 -3.048 1.00 51.55 N ATOM 0 H LYS A 41 35.347 -6.156 0.025 1.00 15.34 H new ATOM 0 HA LYS A 41 33.296 -4.477 1.094 1.00 13.05 H new ATOM 0 HB2 LYS A 41 34.086 -4.865 -1.812 1.00 54.43 H new ATOM 0 HB3 LYS A 41 33.344 -3.452 -1.089 1.00 54.43 H new ATOM 0 HG2 LYS A 41 35.733 -3.870 0.369 1.00 12.21 H new ATOM 0 HG3 LYS A 41 36.156 -4.146 -1.309 1.00 12.21 H new ATOM 0 HD2 LYS A 41 34.580 -1.709 -0.407 1.00 22.11 H new ATOM 0 HD3 LYS A 41 36.332 -1.729 -0.455 1.00 22.11 H new ATOM 0 HE2 LYS A 41 34.617 -2.429 -2.867 1.00 15.23 H new ATOM 0 HE3 LYS A 41 35.142 -0.792 -2.524 1.00 15.23 H new ATOM 0 HZ1 LYS A 41 36.702 -1.720 -4.007 1.00 51.55 H new ATOM 0 HZ2 LYS A 41 37.474 -1.692 -2.495 1.00 51.55 H new ATOM 0 HZ3 LYS A 41 36.852 -3.150 -3.104 1.00 51.55 H new ATOM 448 N LEU A 42 31.120 -5.270 0.131 1.00 71.32 N ATOM 449 CA LEU A 42 29.838 -5.870 -0.221 1.00 74.31 C ATOM 450 C LEU A 42 29.494 -5.603 -1.683 1.00 2.00 C ATOM 451 O LEU A 42 29.905 -4.602 -2.270 1.00 0.54 O ATOM 452 CB LEU A 42 28.731 -5.324 0.683 1.00 42.42 C ATOM 453 CG LEU A 42 28.884 -5.607 2.178 1.00 63.24 C ATOM 454 CD1 LEU A 42 29.330 -7.043 2.406 1.00 72.24 C ATOM 455 CD2 LEU A 42 29.871 -4.634 2.807 1.00 70.44 C ATOM 0 H LEU A 42 31.048 -4.379 0.623 1.00 71.32 H new ATOM 0 HA LEU A 42 29.918 -6.947 -0.077 1.00 74.31 H new ATOM 0 HB2 LEU A 42 28.674 -4.245 0.542 1.00 42.42 H new ATOM 0 HB3 LEU A 42 27.780 -5.740 0.350 1.00 42.42 H new ATOM 0 HG LEU A 42 27.914 -5.469 2.656 1.00 63.24 H new ATOM 0 HD11 LEU A 42 29.434 -7.226 3.475 1.00 72.24 H new ATOM 0 HD12 LEU A 42 28.588 -7.725 1.991 1.00 72.24 H new ATOM 0 HD13 LEU A 42 30.289 -7.208 1.915 1.00 72.24 H new ATOM 0 HD21 LEU A 42 29.967 -4.850 3.871 1.00 70.44 H new ATOM 0 HD22 LEU A 42 30.843 -4.740 2.326 1.00 70.44 H new ATOM 0 HD23 LEU A 42 29.510 -3.614 2.675 1.00 70.44 H new ATOM 467 N PRO A 43 28.721 -6.518 -2.286 1.00 53.23 N ATOM 468 CA PRO A 43 28.302 -6.401 -3.686 1.00 63.44 C ATOM 469 C PRO A 43 27.301 -5.271 -3.900 1.00 64.12 C ATOM 470 O PRO A 43 26.943 -4.953 -5.034 1.00 53.23 O ATOM 471 CB PRO A 43 27.650 -7.755 -3.975 1.00 74.53 C ATOM 472 CG PRO A 43 27.192 -8.247 -2.645 1.00 41.14 C ATOM 473 CD PRO A 43 28.195 -7.736 -1.648 1.00 33.01 C ATOM 0 HA PRO A 43 29.139 -6.166 -4.343 1.00 63.44 H new ATOM 0 HB2 PRO A 43 26.815 -7.652 -4.668 1.00 74.53 H new ATOM 0 HB3 PRO A 43 28.359 -8.447 -4.430 1.00 74.53 H new ATOM 0 HG2 PRO A 43 26.192 -7.879 -2.416 1.00 41.14 H new ATOM 0 HG3 PRO A 43 27.143 -9.336 -2.627 1.00 41.14 H new ATOM 0 HD2 PRO A 43 27.730 -7.517 -0.687 1.00 33.01 H new ATOM 0 HD3 PRO A 43 28.984 -8.465 -1.462 1.00 33.01 H new ATOM 481 N TYR A 44 26.854 -4.668 -2.804 1.00 45.14 N ATOM 482 CA TYR A 44 25.893 -3.574 -2.872 1.00 40.24 C ATOM 483 C TYR A 44 26.485 -2.292 -2.294 1.00 54.00 C ATOM 484 O TYR A 44 27.373 -2.335 -1.444 1.00 43.31 O ATOM 485 CB TYR A 44 24.614 -3.943 -2.119 1.00 70.53 C ATOM 486 CG TYR A 44 24.856 -4.805 -0.901 1.00 4.15 C ATOM 487 CD1 TYR A 44 25.187 -4.235 0.323 1.00 61.23 C ATOM 488 CD2 TYR A 44 24.754 -6.189 -0.972 1.00 53.23 C ATOM 489 CE1 TYR A 44 25.410 -5.019 1.438 1.00 2.45 C ATOM 490 CE2 TYR A 44 24.974 -6.980 0.139 1.00 54.13 C ATOM 491 CZ TYR A 44 25.302 -6.390 1.342 1.00 61.25 C ATOM 492 OH TYR A 44 25.522 -7.174 2.451 1.00 1.10 O ATOM 0 H TYR A 44 27.142 -4.918 -1.858 1.00 45.14 H new ATOM 0 HA TYR A 44 25.652 -3.401 -3.921 1.00 40.24 H new ATOM 0 HB2 TYR A 44 24.107 -3.029 -1.812 1.00 70.53 H new ATOM 0 HB3 TYR A 44 23.942 -4.468 -2.797 1.00 70.53 H new ATOM 0 HD1 TYR A 44 25.271 -3.161 0.403 1.00 61.23 H new ATOM 0 HD2 TYR A 44 24.498 -6.655 -1.912 1.00 53.23 H new ATOM 0 HE1 TYR A 44 25.668 -4.560 2.381 1.00 2.45 H new ATOM 0 HE2 TYR A 44 24.890 -8.054 0.066 1.00 54.13 H new ATOM 0 HH TYR A 44 25.081 -6.772 3.228 1.00 1.10 H new ATOM 502 N GLU A 45 25.983 -1.153 -2.762 1.00 5.01 N ATOM 503 CA GLU A 45 26.462 0.142 -2.292 1.00 22.44 C ATOM 504 C GLU A 45 25.349 0.910 -1.586 1.00 34.34 C ATOM 505 O GLU A 45 25.542 2.046 -1.151 1.00 34.12 O ATOM 506 CB GLU A 45 27.003 0.966 -3.462 1.00 11.13 C ATOM 507 CG GLU A 45 25.917 1.520 -4.369 1.00 62.53 C ATOM 508 CD GLU A 45 26.443 1.912 -5.736 1.00 64.54 C ATOM 509 OE1 GLU A 45 27.163 2.929 -5.825 1.00 72.42 O ATOM 510 OE2 GLU A 45 26.136 1.202 -6.717 1.00 10.21 O ATOM 0 H GLU A 45 25.246 -1.101 -3.465 1.00 5.01 H new ATOM 0 HA GLU A 45 27.267 -0.034 -1.579 1.00 22.44 H new ATOM 0 HB2 GLU A 45 27.595 1.793 -3.070 1.00 11.13 H new ATOM 0 HB3 GLU A 45 27.676 0.345 -4.053 1.00 11.13 H new ATOM 0 HG2 GLU A 45 25.131 0.774 -4.486 1.00 62.53 H new ATOM 0 HG3 GLU A 45 25.462 2.390 -3.896 1.00 62.53 H new ATOM 517 N LEU A 46 24.183 0.282 -1.476 1.00 10.13 N ATOM 518 CA LEU A 46 23.037 0.906 -0.823 1.00 71.50 C ATOM 519 C LEU A 46 22.652 0.147 0.443 1.00 73.42 C ATOM 520 O LEU A 46 23.182 -0.929 0.719 1.00 71.41 O ATOM 521 CB LEU A 46 21.846 0.959 -1.782 1.00 30.04 C ATOM 522 CG LEU A 46 22.028 1.822 -3.031 1.00 21.41 C ATOM 523 CD1 LEU A 46 20.887 1.592 -4.009 1.00 72.34 C ATOM 524 CD2 LEU A 46 22.122 3.293 -2.654 1.00 71.11 C ATOM 0 H LEU A 46 24.006 -0.658 -1.830 1.00 10.13 H new ATOM 0 HA LEU A 46 23.317 1.922 -0.544 1.00 71.50 H new ATOM 0 HB2 LEU A 46 21.614 -0.058 -2.098 1.00 30.04 H new ATOM 0 HB3 LEU A 46 20.979 1.328 -1.233 1.00 30.04 H new ATOM 0 HG LEU A 46 22.960 1.532 -3.517 1.00 21.41 H new ATOM 0 HD11 LEU A 46 21.033 2.214 -4.892 1.00 72.34 H new ATOM 0 HD12 LEU A 46 20.867 0.543 -4.304 1.00 72.34 H new ATOM 0 HD13 LEU A 46 19.942 1.854 -3.533 1.00 72.34 H new ATOM 0 HD21 LEU A 46 22.251 3.892 -3.555 1.00 71.11 H new ATOM 0 HD22 LEU A 46 21.208 3.597 -2.144 1.00 71.11 H new ATOM 0 HD23 LEU A 46 22.974 3.445 -1.992 1.00 71.11 H new ATOM 536 N SER A 47 21.724 0.714 1.208 1.00 62.35 N ATOM 537 CA SER A 47 21.269 0.091 2.445 1.00 13.52 C ATOM 538 C SER A 47 19.866 0.568 2.809 1.00 51.42 C ATOM 539 O SER A 47 19.478 1.692 2.489 1.00 71.02 O ATOM 540 CB SER A 47 22.238 0.406 3.586 1.00 44.11 C ATOM 541 OG SER A 47 21.569 0.422 4.835 1.00 54.44 O ATOM 0 H SER A 47 21.273 1.603 0.993 1.00 62.35 H new ATOM 0 HA SER A 47 21.239 -0.988 2.290 1.00 13.52 H new ATOM 0 HB2 SER A 47 23.034 -0.338 3.606 1.00 44.11 H new ATOM 0 HB3 SER A 47 22.709 1.373 3.410 1.00 44.11 H new ATOM 0 HG SER A 47 21.874 1.192 5.359 1.00 54.44 H new ATOM 547 N SER A 48 19.110 -0.295 3.480 1.00 54.53 N ATOM 548 CA SER A 48 17.748 0.036 3.884 1.00 22.23 C ATOM 549 C SER A 48 17.610 0.005 5.403 1.00 22.44 C ATOM 550 O SER A 48 17.605 -1.064 6.016 1.00 5.24 O ATOM 551 CB SER A 48 16.754 -0.940 3.250 1.00 4.54 C ATOM 552 OG SER A 48 15.512 -0.916 3.931 1.00 13.40 O ATOM 0 H SER A 48 19.417 -1.228 3.755 1.00 54.53 H new ATOM 0 HA SER A 48 17.527 1.045 3.537 1.00 22.23 H new ATOM 0 HB2 SER A 48 16.603 -0.681 2.202 1.00 4.54 H new ATOM 0 HB3 SER A 48 17.165 -1.949 3.273 1.00 4.54 H new ATOM 0 HG SER A 48 15.459 -1.680 4.542 1.00 13.40 H new ATOM 558 N LEU A 49 17.498 1.184 6.005 1.00 21.41 N ATOM 559 CA LEU A 49 17.360 1.293 7.453 1.00 12.42 C ATOM 560 C LEU A 49 16.090 0.598 7.933 1.00 21.33 C ATOM 561 O LEU A 49 15.966 0.252 9.108 1.00 24.33 O ATOM 562 CB LEU A 49 17.339 2.764 7.873 1.00 0.22 C ATOM 563 CG LEU A 49 18.084 3.104 9.164 1.00 2.14 C ATOM 564 CD1 LEU A 49 17.375 2.498 10.365 1.00 30.14 C ATOM 565 CD2 LEU A 49 19.525 2.619 9.092 1.00 33.24 C ATOM 0 H LEU A 49 17.500 2.078 5.513 1.00 21.41 H new ATOM 0 HA LEU A 49 18.217 0.801 7.913 1.00 12.42 H new ATOM 0 HB2 LEU A 49 17.765 3.358 7.064 1.00 0.22 H new ATOM 0 HB3 LEU A 49 16.300 3.075 7.984 1.00 0.22 H new ATOM 0 HG LEU A 49 18.092 4.188 9.282 1.00 2.14 H new ATOM 0 HD11 LEU A 49 17.920 2.751 11.275 1.00 30.14 H new ATOM 0 HD12 LEU A 49 16.361 2.894 10.427 1.00 30.14 H new ATOM 0 HD13 LEU A 49 17.335 1.414 10.255 1.00 30.14 H new ATOM 0 HD21 LEU A 49 20.040 2.870 10.019 1.00 33.24 H new ATOM 0 HD22 LEU A 49 19.539 1.538 8.950 1.00 33.24 H new ATOM 0 HD23 LEU A 49 20.030 3.101 8.255 1.00 33.24 H new ATOM 577 N ASP A 50 15.151 0.394 7.016 1.00 14.25 N ATOM 578 CA ASP A 50 13.891 -0.264 7.345 1.00 3.51 C ATOM 579 C ASP A 50 14.135 -1.681 7.855 1.00 41.42 C ATOM 580 O ASP A 50 13.341 -2.220 8.626 1.00 15.22 O ATOM 581 CB ASP A 50 12.975 -0.299 6.121 1.00 61.11 C ATOM 582 CG ASP A 50 11.548 -0.667 6.476 1.00 11.33 C ATOM 583 OD1 ASP A 50 11.087 -0.272 7.568 1.00 5.22 O ATOM 584 OD2 ASP A 50 10.891 -1.349 5.662 1.00 1.43 O ATOM 0 H ASP A 50 15.238 0.674 6.039 1.00 14.25 H new ATOM 0 HA ASP A 50 13.406 0.308 8.136 1.00 3.51 H new ATOM 0 HB2 ASP A 50 12.985 0.677 5.635 1.00 61.11 H new ATOM 0 HB3 ASP A 50 13.364 -1.018 5.400 1.00 61.11 H new ATOM 589 N LEU A 51 15.238 -2.279 7.418 1.00 33.11 N ATOM 590 CA LEU A 51 15.586 -3.635 7.829 1.00 4.31 C ATOM 591 C LEU A 51 15.665 -3.740 9.349 1.00 54.12 C ATOM 592 O LEU A 51 15.527 -4.825 9.915 1.00 15.44 O ATOM 593 CB LEU A 51 16.922 -4.049 7.208 1.00 34.44 C ATOM 594 CG LEU A 51 17.028 -5.507 6.757 1.00 3.43 C ATOM 595 CD1 LEU A 51 16.919 -5.606 5.244 1.00 73.22 C ATOM 596 CD2 LEU A 51 18.334 -6.120 7.241 1.00 61.31 C ATOM 0 H LEU A 51 15.906 -1.847 6.780 1.00 33.11 H new ATOM 0 HA LEU A 51 14.804 -4.308 7.477 1.00 4.31 H new ATOM 0 HB2 LEU A 51 17.114 -3.408 6.347 1.00 34.44 H new ATOM 0 HB3 LEU A 51 17.713 -3.855 7.933 1.00 34.44 H new ATOM 0 HG LEU A 51 16.202 -6.066 7.197 1.00 3.43 H new ATOM 0 HD11 LEU A 51 16.997 -6.650 4.941 1.00 73.22 H new ATOM 0 HD12 LEU A 51 15.958 -5.205 4.921 1.00 73.22 H new ATOM 0 HD13 LEU A 51 17.724 -5.034 4.783 1.00 73.22 H new ATOM 0 HD21 LEU A 51 18.393 -7.157 6.911 1.00 61.31 H new ATOM 0 HD22 LEU A 51 19.173 -5.560 6.829 1.00 61.31 H new ATOM 0 HD23 LEU A 51 18.372 -6.082 8.330 1.00 61.31 H new ATOM 608 N THR A 52 15.885 -2.605 10.005 1.00 50.20 N ATOM 609 CA THR A 52 15.980 -2.569 11.459 1.00 43.52 C ATOM 610 C THR A 52 14.819 -1.790 12.067 1.00 61.23 C ATOM 611 O THR A 52 13.926 -1.331 11.354 1.00 63.11 O ATOM 612 CB THR A 52 17.306 -1.933 11.919 1.00 30.52 C ATOM 613 OG1 THR A 52 17.689 -0.890 11.016 1.00 21.31 O ATOM 614 CG2 THR A 52 18.409 -2.978 11.993 1.00 65.01 C ATOM 0 H THR A 52 16.001 -1.698 9.552 1.00 50.20 H new ATOM 0 HA THR A 52 15.941 -3.602 11.804 1.00 43.52 H new ATOM 0 HB THR A 52 17.157 -1.514 12.914 1.00 30.52 H new ATOM 0 HG1 THR A 52 16.894 -0.545 10.559 1.00 21.31 H new ATOM 0 HG21 THR A 52 19.336 -2.506 12.320 1.00 65.01 H new ATOM 0 HG22 THR A 52 18.127 -3.755 12.704 1.00 65.01 H new ATOM 0 HG23 THR A 52 18.556 -3.423 11.009 1.00 65.01 H new ATOM 622 N ASP A 53 14.837 -1.645 13.387 1.00 44.31 N ATOM 623 CA ASP A 53 13.786 -0.920 14.091 1.00 41.41 C ATOM 624 C ASP A 53 14.268 0.466 14.509 1.00 51.10 C ATOM 625 O ASP A 53 13.622 1.144 15.308 1.00 2.51 O ATOM 626 CB ASP A 53 13.329 -1.707 15.320 1.00 4.32 C ATOM 627 CG ASP A 53 11.833 -1.612 15.545 1.00 21.13 C ATOM 628 OD1 ASP A 53 11.250 -0.556 15.221 1.00 34.33 O ATOM 629 OD2 ASP A 53 11.245 -2.594 16.045 1.00 65.15 O ATOM 0 H ASP A 53 15.568 -2.020 13.991 1.00 44.31 H new ATOM 0 HA ASP A 53 12.942 -0.802 13.411 1.00 41.41 H new ATOM 0 HB2 ASP A 53 13.610 -2.754 15.203 1.00 4.32 H new ATOM 0 HB3 ASP A 53 13.850 -1.334 16.201 1.00 4.32 H new ATOM 634 N PHE A 54 15.407 0.880 13.964 1.00 2.12 N ATOM 635 CA PHE A 54 15.977 2.184 14.282 1.00 1.21 C ATOM 636 C PHE A 54 15.260 3.292 13.516 1.00 4.32 C ATOM 637 O PHE A 54 14.217 3.064 12.903 1.00 41.10 O ATOM 638 CB PHE A 54 17.471 2.205 13.953 1.00 2.40 C ATOM 639 CG PHE A 54 18.240 1.081 14.586 1.00 45.21 C ATOM 640 CD1 PHE A 54 18.348 0.988 15.964 1.00 31.42 C ATOM 641 CD2 PHE A 54 18.856 0.118 13.803 1.00 74.12 C ATOM 642 CE1 PHE A 54 19.056 -0.045 16.549 1.00 72.30 C ATOM 643 CE2 PHE A 54 19.565 -0.918 14.382 1.00 14.30 C ATOM 644 CZ PHE A 54 19.664 -1.000 15.757 1.00 12.21 C ATOM 0 H PHE A 54 15.953 0.331 13.300 1.00 2.12 H new ATOM 0 HA PHE A 54 15.845 2.360 15.350 1.00 1.21 H new ATOM 0 HB2 PHE A 54 17.597 2.157 12.871 1.00 2.40 H new ATOM 0 HB3 PHE A 54 17.894 3.154 14.282 1.00 2.40 H new ATOM 0 HD1 PHE A 54 17.874 1.731 16.588 1.00 31.42 H new ATOM 0 HD2 PHE A 54 18.781 0.177 12.727 1.00 74.12 H new ATOM 0 HE1 PHE A 54 19.134 -0.106 17.624 1.00 72.30 H new ATOM 0 HE2 PHE A 54 20.041 -1.662 13.760 1.00 14.30 H new ATOM 0 HZ PHE A 54 20.216 -1.809 16.212 1.00 12.21 H new ATOM 654 N HIS A 55 15.827 4.494 13.557 1.00 65.12 N ATOM 655 CA HIS A 55 15.243 5.639 12.867 1.00 64.41 C ATOM 656 C HIS A 55 16.322 6.457 12.164 1.00 51.25 C ATOM 657 O HIS A 55 16.088 7.598 11.762 1.00 63.32 O ATOM 658 CB HIS A 55 14.480 6.521 13.855 1.00 50.22 C ATOM 659 CG HIS A 55 13.130 5.984 14.219 1.00 63.31 C ATOM 660 ND1 HIS A 55 12.833 5.478 15.467 1.00 62.12 N ATOM 661 CD2 HIS A 55 11.994 5.876 13.491 1.00 42.40 C ATOM 662 CE1 HIS A 55 11.573 5.081 15.490 1.00 4.12 C ATOM 663 NE2 HIS A 55 11.042 5.312 14.303 1.00 14.55 N ATOM 0 H HIS A 55 16.690 4.700 14.061 1.00 65.12 H new ATOM 0 HA HIS A 55 14.548 5.264 12.115 1.00 64.41 H new ATOM 0 HB2 HIS A 55 15.074 6.634 14.762 1.00 50.22 H new ATOM 0 HB3 HIS A 55 14.362 7.516 13.425 1.00 50.22 H new ATOM 0 HD2 HIS A 55 11.861 6.178 12.462 1.00 42.40 H new ATOM 0 HE1 HIS A 55 11.064 4.642 16.335 1.00 4.12 H new ATOM 0 HE2 HIS A 55 10.080 5.105 14.033 1.00 14.55 H new ATOM 671 N THR A 56 17.505 5.868 12.018 1.00 12.10 N ATOM 672 CA THR A 56 18.620 6.543 11.365 1.00 34.24 C ATOM 673 C THR A 56 19.866 5.666 11.361 1.00 65.13 C ATOM 674 O THR A 56 20.003 4.762 12.184 1.00 30.21 O ATOM 675 CB THR A 56 18.949 7.880 12.056 1.00 71.13 C ATOM 676 OG1 THR A 56 20.273 8.298 11.707 1.00 42.20 O ATOM 677 CG2 THR A 56 18.834 7.751 13.567 1.00 13.41 C ATOM 0 H THR A 56 17.716 4.925 12.343 1.00 12.10 H new ATOM 0 HA THR A 56 18.314 6.739 10.337 1.00 34.24 H new ATOM 0 HB THR A 56 18.231 8.626 11.716 1.00 71.13 H new ATOM 0 HG1 THR A 56 20.253 9.230 11.404 1.00 42.20 H new ATOM 0 HG21 THR A 56 19.071 8.708 14.033 1.00 13.41 H new ATOM 0 HG22 THR A 56 17.817 7.461 13.831 1.00 13.41 H new ATOM 0 HG23 THR A 56 19.532 6.992 13.922 1.00 13.41 H new ATOM 685 N GLU A 57 20.774 5.940 10.428 1.00 34.13 N ATOM 686 CA GLU A 57 22.010 5.174 10.318 1.00 53.22 C ATOM 687 C GLU A 57 22.817 5.255 11.610 1.00 44.40 C ATOM 688 O GLU A 57 23.370 4.258 12.075 1.00 74.25 O ATOM 689 CB GLU A 57 22.850 5.686 9.146 1.00 75.24 C ATOM 690 CG GLU A 57 22.054 5.880 7.866 1.00 71.13 C ATOM 691 CD GLU A 57 22.004 7.330 7.424 1.00 32.40 C ATOM 692 OE1 GLU A 57 21.267 8.116 8.055 1.00 54.13 O ATOM 693 OE2 GLU A 57 22.701 7.678 6.448 1.00 30.44 O ATOM 0 H GLU A 57 20.677 6.686 9.739 1.00 34.13 H new ATOM 0 HA GLU A 57 21.747 4.131 10.139 1.00 53.22 H new ATOM 0 HB2 GLU A 57 23.309 6.634 9.426 1.00 75.24 H new ATOM 0 HB3 GLU A 57 23.661 4.983 8.957 1.00 75.24 H new ATOM 0 HG2 GLU A 57 22.496 5.277 7.073 1.00 71.13 H new ATOM 0 HG3 GLU A 57 21.038 5.514 8.015 1.00 71.13 H new ATOM 700 N LYS A 58 22.882 6.451 12.186 1.00 43.01 N ATOM 701 CA LYS A 58 23.621 6.665 13.425 1.00 41.04 C ATOM 702 C LYS A 58 23.168 5.687 14.504 1.00 2.11 C ATOM 703 O LYS A 58 23.963 5.262 15.341 1.00 23.14 O ATOM 704 CB LYS A 58 23.433 8.103 13.913 1.00 51.21 C ATOM 705 CG LYS A 58 22.068 8.364 14.526 1.00 20.43 C ATOM 706 CD LYS A 58 21.605 9.789 14.273 1.00 64.53 C ATOM 707 CE LYS A 58 20.862 10.355 15.473 1.00 74.25 C ATOM 708 NZ LYS A 58 21.315 11.734 15.806 1.00 73.32 N ATOM 0 H LYS A 58 22.432 7.287 11.814 1.00 43.01 H new ATOM 0 HA LYS A 58 24.678 6.492 13.223 1.00 41.04 H new ATOM 0 HB2 LYS A 58 24.203 8.331 14.650 1.00 51.21 H new ATOM 0 HB3 LYS A 58 23.582 8.784 13.075 1.00 51.21 H new ATOM 0 HG2 LYS A 58 21.342 7.666 14.110 1.00 20.43 H new ATOM 0 HG3 LYS A 58 22.109 8.179 15.599 1.00 20.43 H new ATOM 0 HD2 LYS A 58 22.466 10.418 14.047 1.00 64.53 H new ATOM 0 HD3 LYS A 58 20.956 9.812 13.398 1.00 64.53 H new ATOM 0 HE2 LYS A 58 19.792 10.364 15.266 1.00 74.25 H new ATOM 0 HE3 LYS A 58 21.015 9.705 16.334 1.00 74.25 H new ATOM 0 HZ1 LYS A 58 20.785 12.084 16.629 1.00 73.32 H new ATOM 0 HZ2 LYS A 58 22.331 11.722 16.028 1.00 73.32 H new ATOM 0 HZ3 LYS A 58 21.146 12.361 14.993 1.00 73.32 H new ATOM 722 N GLU A 59 21.887 5.334 14.477 1.00 52.32 N ATOM 723 CA GLU A 59 21.330 4.406 15.453 1.00 31.35 C ATOM 724 C GLU A 59 21.826 2.985 15.198 1.00 3.45 C ATOM 725 O GLU A 59 22.188 2.265 16.130 1.00 11.20 O ATOM 726 CB GLU A 59 19.801 4.439 15.408 1.00 52.11 C ATOM 727 CG GLU A 59 19.179 5.317 16.481 1.00 31.53 C ATOM 728 CD GLU A 59 18.562 4.511 17.608 1.00 31.01 C ATOM 729 OE1 GLU A 59 19.280 3.686 18.211 1.00 52.31 O ATOM 730 OE2 GLU A 59 17.360 4.706 17.887 1.00 42.11 O ATOM 0 H GLU A 59 21.216 5.677 13.790 1.00 52.32 H new ATOM 0 HA GLU A 59 21.664 4.717 16.443 1.00 31.35 H new ATOM 0 HB2 GLU A 59 19.482 4.796 14.429 1.00 52.11 H new ATOM 0 HB3 GLU A 59 19.421 3.423 15.516 1.00 52.11 H new ATOM 0 HG2 GLU A 59 19.941 5.981 16.889 1.00 31.53 H new ATOM 0 HG3 GLU A 59 18.414 5.949 16.030 1.00 31.53 H new ATOM 737 N LEU A 60 21.840 2.589 13.931 1.00 64.23 N ATOM 738 CA LEU A 60 22.292 1.254 13.551 1.00 13.45 C ATOM 739 C LEU A 60 23.742 1.031 13.969 1.00 35.32 C ATOM 740 O LEU A 60 24.073 0.013 14.576 1.00 12.33 O ATOM 741 CB LEU A 60 22.148 1.056 12.042 1.00 74.24 C ATOM 742 CG LEU A 60 21.916 -0.381 11.573 1.00 70.13 C ATOM 743 CD1 LEU A 60 21.762 -0.431 10.061 1.00 55.24 C ATOM 744 CD2 LEU A 60 23.058 -1.280 12.024 1.00 40.12 C ATOM 0 H LEU A 60 21.544 3.172 13.149 1.00 64.23 H new ATOM 0 HA LEU A 60 21.668 0.525 14.068 1.00 13.45 H new ATOM 0 HB2 LEU A 60 21.318 1.670 11.693 1.00 74.24 H new ATOM 0 HB3 LEU A 60 23.049 1.434 11.558 1.00 74.24 H new ATOM 0 HG LEU A 60 20.993 -0.745 12.024 1.00 70.13 H new ATOM 0 HD11 LEU A 60 21.598 -1.461 9.746 1.00 55.24 H new ATOM 0 HD12 LEU A 60 20.911 0.180 9.762 1.00 55.24 H new ATOM 0 HD13 LEU A 60 22.667 -0.048 9.590 1.00 55.24 H new ATOM 0 HD21 LEU A 60 22.876 -2.299 11.682 1.00 40.12 H new ATOM 0 HD22 LEU A 60 23.995 -0.917 11.602 1.00 40.12 H new ATOM 0 HD23 LEU A 60 23.122 -1.269 13.112 1.00 40.12 H new ATOM 756 N ASN A 61 24.601 1.990 13.641 1.00 22.13 N ATOM 757 CA ASN A 61 26.016 1.898 13.984 1.00 12.30 C ATOM 758 C ASN A 61 26.219 2.021 15.491 1.00 4.40 C ATOM 759 O ASN A 61 27.036 1.311 16.077 1.00 4.24 O ATOM 760 CB ASN A 61 26.809 2.988 13.260 1.00 11.32 C ATOM 761 CG ASN A 61 28.066 2.450 12.605 1.00 3.14 C ATOM 762 OD1 ASN A 61 29.141 3.039 12.721 1.00 10.45 O ATOM 763 ND2 ASN A 61 27.937 1.325 11.912 1.00 20.11 N ATOM 0 H ASN A 61 24.343 2.839 13.139 1.00 22.13 H new ATOM 0 HA ASN A 61 26.380 0.921 13.665 1.00 12.30 H new ATOM 0 HB2 ASN A 61 26.177 3.450 12.502 1.00 11.32 H new ATOM 0 HB3 ASN A 61 27.079 3.770 13.970 1.00 11.32 H new ATOM 0 HD21 ASN A 61 28.748 0.915 11.449 1.00 20.11 H new ATOM 0 HD22 ASN A 61 27.027 0.870 11.842 1.00 20.11 H new ATOM 770 N ASP A 62 25.471 2.927 16.112 1.00 72.55 N ATOM 771 CA ASP A 62 25.567 3.142 17.551 1.00 44.04 C ATOM 772 C ASP A 62 25.179 1.881 18.316 1.00 13.11 C ATOM 773 O ASP A 62 25.696 1.616 19.402 1.00 51.34 O ATOM 774 CB ASP A 62 24.672 4.307 17.975 1.00 40.35 C ATOM 775 CG ASP A 62 25.329 5.655 17.748 1.00 24.43 C ATOM 776 OD1 ASP A 62 26.514 5.678 17.353 1.00 40.31 O ATOM 777 OD2 ASP A 62 24.659 6.685 17.966 1.00 42.31 O ATOM 0 H ASP A 62 24.791 3.524 15.641 1.00 72.55 H new ATOM 0 HA ASP A 62 26.603 3.385 17.789 1.00 44.04 H new ATOM 0 HB2 ASP A 62 23.736 4.264 17.418 1.00 40.35 H new ATOM 0 HB3 ASP A 62 24.420 4.202 19.030 1.00 40.35 H new ATOM 782 N LYS A 63 24.263 1.106 17.744 1.00 3.41 N ATOM 783 CA LYS A 63 23.804 -0.127 18.371 1.00 22.32 C ATOM 784 C LYS A 63 24.833 -1.241 18.199 1.00 14.41 C ATOM 785 O LYS A 63 24.978 -2.105 19.065 1.00 41.41 O ATOM 786 CB LYS A 63 22.464 -0.560 17.773 1.00 52.24 C ATOM 787 CG LYS A 63 22.253 -2.064 17.777 1.00 15.14 C ATOM 788 CD LYS A 63 22.733 -2.699 16.483 1.00 3.42 C ATOM 789 CE LYS A 63 23.290 -4.094 16.720 1.00 21.11 C ATOM 790 NZ LYS A 63 22.211 -5.083 16.991 1.00 34.41 N ATOM 0 H LYS A 63 23.824 1.311 16.846 1.00 3.41 H new ATOM 0 HA LYS A 63 23.675 0.063 19.436 1.00 22.32 H new ATOM 0 HB2 LYS A 63 21.657 -0.087 18.332 1.00 52.24 H new ATOM 0 HB3 LYS A 63 22.398 -0.195 16.748 1.00 52.24 H new ATOM 0 HG2 LYS A 63 22.787 -2.505 18.619 1.00 15.14 H new ATOM 0 HG3 LYS A 63 21.195 -2.283 17.920 1.00 15.14 H new ATOM 0 HD2 LYS A 63 21.907 -2.752 15.774 1.00 3.42 H new ATOM 0 HD3 LYS A 63 23.501 -2.071 16.031 1.00 3.42 H new ATOM 0 HE2 LYS A 63 23.861 -4.410 15.847 1.00 21.11 H new ATOM 0 HE3 LYS A 63 23.981 -4.071 17.562 1.00 21.11 H new ATOM 0 HZ1 LYS A 63 22.582 -6.046 16.863 1.00 34.41 H new ATOM 0 HZ2 LYS A 63 21.873 -4.969 17.968 1.00 34.41 H new ATOM 0 HZ3 LYS A 63 21.422 -4.926 16.332 1.00 34.41 H new ATOM 804 N LEU A 64 25.545 -1.214 17.078 1.00 13.41 N ATOM 805 CA LEU A 64 26.562 -2.220 16.793 1.00 34.12 C ATOM 806 C LEU A 64 27.532 -2.360 17.962 1.00 35.21 C ATOM 807 O LEU A 64 27.988 -3.459 18.274 1.00 31.13 O ATOM 808 CB LEU A 64 27.328 -1.854 15.521 1.00 12.40 C ATOM 809 CG LEU A 64 27.033 -2.711 14.289 1.00 11.45 C ATOM 810 CD1 LEU A 64 26.241 -1.916 13.263 1.00 12.42 C ATOM 811 CD2 LEU A 64 28.326 -3.232 13.680 1.00 23.04 C ATOM 0 H LEU A 64 25.437 -0.506 16.351 1.00 13.41 H new ATOM 0 HA LEU A 64 26.060 -3.176 16.645 1.00 34.12 H new ATOM 0 HB2 LEU A 64 27.110 -0.814 15.276 1.00 12.40 H new ATOM 0 HB3 LEU A 64 28.395 -1.914 15.734 1.00 12.40 H new ATOM 0 HG LEU A 64 26.431 -3.565 14.600 1.00 11.45 H new ATOM 0 HD11 LEU A 64 26.040 -2.542 12.394 1.00 12.42 H new ATOM 0 HD12 LEU A 64 25.297 -1.593 13.703 1.00 12.42 H new ATOM 0 HD13 LEU A 64 26.817 -1.043 12.956 1.00 12.42 H new ATOM 0 HD21 LEU A 64 28.097 -3.840 12.805 1.00 23.04 H new ATOM 0 HD22 LEU A 64 28.953 -2.391 13.384 1.00 23.04 H new ATOM 0 HD23 LEU A 64 28.855 -3.839 14.414 1.00 23.04 H new ATOM 823 N ASN A 65 27.840 -1.239 18.606 1.00 62.21 N ATOM 824 CA ASN A 65 28.755 -1.237 19.742 1.00 73.20 C ATOM 825 C ASN A 65 28.296 -2.224 20.812 1.00 54.45 C ATOM 826 O ASN A 65 29.114 -2.852 21.484 1.00 52.53 O ATOM 827 CB ASN A 65 28.857 0.168 20.338 1.00 1.04 C ATOM 828 CG ASN A 65 29.590 1.132 19.425 1.00 33.20 C ATOM 829 OD1 ASN A 65 30.671 0.827 18.922 1.00 4.33 O ATOM 830 ND2 ASN A 65 29.002 2.302 19.207 1.00 52.35 N ATOM 0 H ASN A 65 27.470 -0.321 18.361 1.00 62.21 H new ATOM 0 HA ASN A 65 29.738 -1.546 19.386 1.00 73.20 H new ATOM 0 HB2 ASN A 65 27.855 0.549 20.535 1.00 1.04 H new ATOM 0 HB3 ASN A 65 29.373 0.116 21.297 1.00 1.04 H new ATOM 0 HD21 ASN A 65 29.447 2.991 18.601 1.00 52.35 H new ATOM 0 HD22 ASN A 65 28.105 2.512 19.645 1.00 52.35 H new ATOM 837 N ASP A 66 26.982 -2.355 20.963 1.00 43.32 N ATOM 838 CA ASP A 66 26.413 -3.266 21.949 1.00 5.22 C ATOM 839 C ASP A 66 26.811 -4.708 21.650 1.00 41.20 C ATOM 840 O ASP A 66 27.329 -5.412 22.517 1.00 71.31 O ATOM 841 CB ASP A 66 24.889 -3.138 21.973 1.00 25.43 C ATOM 842 CG ASP A 66 24.351 -2.889 23.369 1.00 44.45 C ATOM 843 OD1 ASP A 66 24.438 -1.736 23.840 1.00 40.43 O ATOM 844 OD2 ASP A 66 23.845 -3.846 23.990 1.00 75.44 O ATOM 0 H ASP A 66 26.292 -1.842 20.415 1.00 43.32 H new ATOM 0 HA ASP A 66 26.808 -2.995 22.928 1.00 5.22 H new ATOM 0 HB2 ASP A 66 24.586 -2.321 21.319 1.00 25.43 H new ATOM 0 HB3 ASP A 66 24.444 -4.049 21.572 1.00 25.43 H new ATOM 849 N TYR A 67 26.565 -5.141 20.419 1.00 54.55 N ATOM 850 CA TYR A 67 26.894 -6.500 20.006 1.00 54.31 C ATOM 851 C TYR A 67 28.403 -6.723 20.021 1.00 73.44 C ATOM 852 O TYR A 67 28.875 -7.835 20.261 1.00 12.21 O ATOM 853 CB TYR A 67 26.339 -6.779 18.608 1.00 60.10 C ATOM 854 CG TYR A 67 27.410 -6.947 17.554 1.00 21.11 C ATOM 855 CD1 TYR A 67 28.084 -8.153 17.407 1.00 45.25 C ATOM 856 CD2 TYR A 67 27.747 -5.900 16.705 1.00 10.00 C ATOM 857 CE1 TYR A 67 29.064 -8.310 16.446 1.00 62.35 C ATOM 858 CE2 TYR A 67 28.724 -6.049 15.740 1.00 4.11 C ATOM 859 CZ TYR A 67 29.380 -7.256 15.615 1.00 44.34 C ATOM 860 OH TYR A 67 30.355 -7.409 14.655 1.00 32.01 O ATOM 0 H TYR A 67 26.139 -4.570 19.689 1.00 54.55 H new ATOM 0 HA TYR A 67 26.436 -7.190 20.715 1.00 54.31 H new ATOM 0 HB2 TYR A 67 25.729 -7.682 18.642 1.00 60.10 H new ATOM 0 HB3 TYR A 67 25.680 -5.960 18.318 1.00 60.10 H new ATOM 0 HD1 TYR A 67 27.838 -8.981 18.055 1.00 45.25 H new ATOM 0 HD2 TYR A 67 27.236 -4.953 16.801 1.00 10.00 H new ATOM 0 HE1 TYR A 67 29.580 -9.253 16.346 1.00 62.35 H new ATOM 0 HE2 TYR A 67 28.973 -5.225 15.087 1.00 4.11 H new ATOM 0 HH TYR A 67 31.045 -8.022 14.984 1.00 32.01 H new ATOM 870 N TYR A 68 29.154 -5.659 19.762 1.00 2.03 N ATOM 871 CA TYR A 68 30.610 -5.738 19.744 1.00 40.43 C ATOM 872 C TYR A 68 31.134 -6.441 20.992 1.00 13.22 C ATOM 873 O TYR A 68 32.104 -7.195 20.932 1.00 20.23 O ATOM 874 CB TYR A 68 31.216 -4.337 19.642 1.00 40.23 C ATOM 875 CG TYR A 68 31.835 -4.042 18.294 1.00 3.42 C ATOM 876 CD1 TYR A 68 31.042 -3.864 17.167 1.00 10.03 C ATOM 877 CD2 TYR A 68 33.213 -3.941 18.148 1.00 62.33 C ATOM 878 CE1 TYR A 68 31.603 -3.595 15.934 1.00 42.21 C ATOM 879 CE2 TYR A 68 33.783 -3.671 16.919 1.00 50.13 C ATOM 880 CZ TYR A 68 32.974 -3.499 15.815 1.00 50.31 C ATOM 881 OH TYR A 68 33.538 -3.231 14.589 1.00 52.35 O ATOM 0 H TYR A 68 28.779 -4.732 19.562 1.00 2.03 H new ATOM 0 HA TYR A 68 30.906 -6.320 18.871 1.00 40.43 H new ATOM 0 HB2 TYR A 68 30.440 -3.599 19.846 1.00 40.23 H new ATOM 0 HB3 TYR A 68 31.976 -4.222 20.415 1.00 40.23 H new ATOM 0 HD1 TYR A 68 29.968 -3.937 17.257 1.00 10.03 H new ATOM 0 HD2 TYR A 68 33.849 -4.076 19.010 1.00 62.33 H new ATOM 0 HE1 TYR A 68 30.972 -3.461 15.068 1.00 42.21 H new ATOM 0 HE2 TYR A 68 34.856 -3.595 16.823 1.00 50.13 H new ATOM 0 HH TYR A 68 34.513 -3.195 14.678 1.00 52.35 H new ATOM 891 N ALA A 69 30.483 -6.187 22.123 1.00 73.52 N ATOM 892 CA ALA A 69 30.880 -6.797 23.386 1.00 75.31 C ATOM 893 C ALA A 69 30.940 -8.316 23.267 1.00 63.41 C ATOM 894 O ALA A 69 31.726 -8.972 23.953 1.00 73.34 O ATOM 895 CB ALA A 69 29.919 -6.391 24.493 1.00 14.32 C ATOM 0 H ALA A 69 29.679 -5.563 22.190 1.00 73.52 H new ATOM 0 HA ALA A 69 31.878 -6.438 23.636 1.00 75.31 H new ATOM 0 HB1 ALA A 69 30.227 -6.854 25.430 1.00 14.32 H new ATOM 0 HB2 ALA A 69 29.928 -5.307 24.603 1.00 14.32 H new ATOM 0 HB3 ALA A 69 28.912 -6.721 24.240 1.00 14.32 H new ATOM 901 N LEU A 70 30.107 -8.870 22.394 1.00 74.44 N ATOM 902 CA LEU A 70 30.065 -10.314 22.185 1.00 11.31 C ATOM 903 C LEU A 70 31.406 -10.829 21.673 1.00 41.35 C ATOM 904 O LEU A 70 31.685 -12.027 21.726 1.00 50.32 O ATOM 905 CB LEU A 70 28.955 -10.674 21.196 1.00 64.13 C ATOM 906 CG LEU A 70 28.473 -12.125 21.227 1.00 11.35 C ATOM 907 CD1 LEU A 70 27.038 -12.199 21.725 1.00 33.10 C ATOM 908 CD2 LEU A 70 28.595 -12.758 19.849 1.00 10.30 C ATOM 0 H LEU A 70 29.451 -8.342 21.819 1.00 74.44 H new ATOM 0 HA LEU A 70 29.857 -10.789 23.143 1.00 11.31 H new ATOM 0 HB2 LEU A 70 28.101 -10.024 21.387 1.00 64.13 H new ATOM 0 HB3 LEU A 70 29.307 -10.450 20.189 1.00 64.13 H new ATOM 0 HG LEU A 70 29.105 -12.683 21.917 1.00 11.35 H new ATOM 0 HD11 LEU A 70 26.711 -13.239 21.741 1.00 33.10 H new ATOM 0 HD12 LEU A 70 26.981 -11.785 22.732 1.00 33.10 H new ATOM 0 HD13 LEU A 70 26.392 -11.626 21.060 1.00 33.10 H new ATOM 0 HD21 LEU A 70 28.247 -13.790 19.891 1.00 10.30 H new ATOM 0 HD22 LEU A 70 27.988 -12.199 19.137 1.00 10.30 H new ATOM 0 HD23 LEU A 70 29.637 -12.739 19.531 1.00 10.30 H new ATOM 920 N LYS A 71 32.235 -9.915 21.178 1.00 73.53 N ATOM 921 CA LYS A 71 33.549 -10.275 20.658 1.00 32.35 C ATOM 922 C LYS A 71 34.292 -11.179 21.637 1.00 12.02 C ATOM 923 O LYS A 71 35.062 -12.050 21.231 1.00 35.43 O ATOM 924 CB LYS A 71 34.374 -9.016 20.384 1.00 53.12 C ATOM 925 CG LYS A 71 34.771 -8.263 21.642 1.00 41.24 C ATOM 926 CD LYS A 71 35.690 -7.094 21.325 1.00 34.42 C ATOM 927 CE LYS A 71 34.938 -5.772 21.349 1.00 22.24 C ATOM 928 NZ LYS A 71 34.437 -5.444 22.713 1.00 71.03 N ATOM 0 H LYS A 71 32.020 -8.919 21.126 1.00 73.53 H new ATOM 0 HA LYS A 71 33.406 -10.819 19.724 1.00 32.35 H new ATOM 0 HB2 LYS A 71 35.275 -9.294 19.838 1.00 53.12 H new ATOM 0 HB3 LYS A 71 33.802 -8.350 19.738 1.00 53.12 H new ATOM 0 HG2 LYS A 71 33.876 -7.898 22.146 1.00 41.24 H new ATOM 0 HG3 LYS A 71 35.270 -8.943 22.332 1.00 41.24 H new ATOM 0 HD2 LYS A 71 36.505 -7.064 22.048 1.00 34.42 H new ATOM 0 HD3 LYS A 71 36.141 -7.240 20.343 1.00 34.42 H new ATOM 0 HE2 LYS A 71 35.595 -4.974 21.002 1.00 22.24 H new ATOM 0 HE3 LYS A 71 34.099 -5.819 20.655 1.00 22.24 H new ATOM 0 HZ1 LYS A 71 33.414 -5.261 22.672 1.00 71.03 H new ATOM 0 HZ2 LYS A 71 34.621 -6.244 23.352 1.00 71.03 H new ATOM 0 HZ3 LYS A 71 34.926 -4.598 23.068 1.00 71.03 H new ATOM 942 N HIS A 72 34.055 -10.967 22.928 1.00 44.20 N ATOM 943 CA HIS A 72 34.701 -11.764 23.965 1.00 61.34 C ATOM 944 C HIS A 72 34.527 -13.255 23.691 1.00 73.12 C ATOM 945 O HIS A 72 35.426 -14.054 23.952 1.00 43.04 O ATOM 946 CB HIS A 72 34.127 -11.415 25.338 1.00 75.51 C ATOM 947 CG HIS A 72 35.158 -10.945 26.317 1.00 52.54 C ATOM 948 ND1 HIS A 72 35.674 -11.748 27.311 1.00 64.32 N ATOM 949 CD2 HIS A 72 35.770 -9.745 26.449 1.00 42.33 C ATOM 950 CE1 HIS A 72 36.559 -11.063 28.013 1.00 14.23 C ATOM 951 NE2 HIS A 72 36.636 -9.844 27.510 1.00 13.12 N ATOM 0 H HIS A 72 33.421 -10.250 23.281 1.00 44.20 H new ATOM 0 HA HIS A 72 35.766 -11.533 23.956 1.00 61.34 H new ATOM 0 HB2 HIS A 72 33.370 -10.639 25.220 1.00 75.51 H new ATOM 0 HB3 HIS A 72 33.624 -12.292 25.746 1.00 75.51 H new ATOM 0 HD2 HIS A 72 35.607 -8.872 25.834 1.00 42.33 H new ATOM 0 HE1 HIS A 72 37.123 -11.436 28.855 1.00 14.23 H new ATOM 0 HE2 HIS A 72 37.240 -9.098 27.854 1.00 13.12 H new ATOM 959 N VAL A 73 33.363 -13.623 23.164 1.00 31.13 N ATOM 960 CA VAL A 73 33.071 -15.018 22.855 1.00 54.41 C ATOM 961 C VAL A 73 33.200 -15.288 21.360 1.00 2.31 C ATOM 962 O VAL A 73 32.339 -14.920 20.561 1.00 42.34 O ATOM 963 CB VAL A 73 31.654 -15.410 23.315 1.00 1.44 C ATOM 964 CG1 VAL A 73 31.351 -16.852 22.941 1.00 20.52 C ATOM 965 CG2 VAL A 73 31.503 -15.196 24.814 1.00 3.00 C ATOM 0 H VAL A 73 32.607 -12.975 22.942 1.00 31.13 H new ATOM 0 HA VAL A 73 33.801 -15.621 23.395 1.00 54.41 H new ATOM 0 HB VAL A 73 30.935 -14.769 22.805 1.00 1.44 H new ATOM 0 HG11 VAL A 73 30.346 -17.111 23.274 1.00 20.52 H new ATOM 0 HG12 VAL A 73 31.416 -16.969 21.859 1.00 20.52 H new ATOM 0 HG13 VAL A 73 32.073 -17.512 23.421 1.00 20.52 H new ATOM 0 HG21 VAL A 73 30.496 -15.478 25.122 1.00 3.00 H new ATOM 0 HG22 VAL A 73 32.230 -15.811 25.344 1.00 3.00 H new ATOM 0 HG23 VAL A 73 31.674 -14.146 25.051 1.00 3.00 H new ATOM 975 N PRO A 74 34.302 -15.947 20.971 1.00 13.22 N ATOM 976 CA PRO A 74 34.570 -16.282 19.570 1.00 61.33 C ATOM 977 C PRO A 74 33.623 -17.353 19.038 1.00 1.13 C ATOM 978 O PRO A 74 33.349 -17.415 17.840 1.00 65.15 O ATOM 979 CB PRO A 74 36.008 -16.807 19.600 1.00 73.14 C ATOM 980 CG PRO A 74 36.199 -17.309 20.989 1.00 31.11 C ATOM 981 CD PRO A 74 35.370 -16.416 21.870 1.00 52.31 C ATOM 0 HA PRO A 74 34.428 -15.425 18.912 1.00 61.33 H new ATOM 0 HB2 PRO A 74 36.155 -17.601 18.868 1.00 73.14 H new ATOM 0 HB3 PRO A 74 36.722 -16.019 19.362 1.00 73.14 H new ATOM 0 HG2 PRO A 74 35.880 -18.348 21.076 1.00 31.11 H new ATOM 0 HG3 PRO A 74 37.250 -17.273 21.276 1.00 31.11 H new ATOM 0 HD2 PRO A 74 34.966 -16.958 22.725 1.00 52.31 H new ATOM 0 HD3 PRO A 74 35.955 -15.586 22.266 1.00 52.31 H new ATOM 989 N LYS A 75 33.125 -18.194 19.938 1.00 74.43 N ATOM 990 CA LYS A 75 32.206 -19.262 19.561 1.00 62.25 C ATOM 991 C LYS A 75 30.985 -18.700 18.840 1.00 33.23 C ATOM 992 O LYS A 75 30.492 -19.291 17.879 1.00 51.12 O ATOM 993 CB LYS A 75 31.766 -20.045 20.799 1.00 34.24 C ATOM 994 CG LYS A 75 32.851 -20.941 21.371 1.00 61.15 C ATOM 995 CD LYS A 75 33.240 -22.038 20.394 1.00 73.32 C ATOM 996 CE LYS A 75 34.570 -21.739 19.720 1.00 23.33 C ATOM 997 NZ LYS A 75 34.565 -22.131 18.284 1.00 41.25 N ATOM 0 H LYS A 75 33.342 -18.157 20.934 1.00 74.43 H new ATOM 0 HA LYS A 75 32.729 -19.934 18.881 1.00 62.25 H new ATOM 0 HB2 LYS A 75 31.445 -19.342 21.568 1.00 34.24 H new ATOM 0 HB3 LYS A 75 30.900 -20.656 20.543 1.00 34.24 H new ATOM 0 HG2 LYS A 75 33.728 -20.342 21.615 1.00 61.15 H new ATOM 0 HG3 LYS A 75 32.502 -21.388 22.302 1.00 61.15 H new ATOM 0 HD2 LYS A 75 33.304 -22.990 20.921 1.00 73.32 H new ATOM 0 HD3 LYS A 75 32.463 -22.144 19.637 1.00 73.32 H new ATOM 0 HE2 LYS A 75 34.789 -20.675 19.805 1.00 23.33 H new ATOM 0 HE3 LYS A 75 35.368 -22.271 20.239 1.00 23.33 H new ATOM 0 HZ1 LYS A 75 35.489 -21.911 17.861 1.00 41.25 H new ATOM 0 HZ2 LYS A 75 34.381 -23.151 18.203 1.00 41.25 H new ATOM 0 HZ3 LYS A 75 33.821 -21.605 17.783 1.00 41.25 H new ATOM 1011 N CYS A 76 30.501 -17.555 19.310 1.00 22.24 N ATOM 1012 CA CYS A 76 29.338 -16.912 18.711 1.00 21.31 C ATOM 1013 C CYS A 76 29.758 -15.738 17.832 1.00 64.24 C ATOM 1014 O CYS A 76 29.149 -15.478 16.794 1.00 3.52 O ATOM 1015 CB CYS A 76 28.378 -16.430 19.800 1.00 2.24 C ATOM 1016 SG CYS A 76 26.646 -16.932 19.541 1.00 4.21 S ATOM 0 H CYS A 76 30.897 -17.053 20.105 1.00 22.24 H new ATOM 0 HA CYS A 76 28.829 -17.647 18.087 1.00 21.31 H new ATOM 0 HB2 CYS A 76 28.716 -16.813 20.763 1.00 2.24 H new ATOM 0 HB3 CYS A 76 28.425 -15.342 19.856 1.00 2.24 H new ATOM 1021 N TRP A 77 30.802 -15.034 18.254 1.00 65.52 N ATOM 1022 CA TRP A 77 31.305 -13.888 17.505 1.00 73.13 C ATOM 1023 C TRP A 77 31.618 -14.275 16.064 1.00 42.34 C ATOM 1024 O TRP A 77 31.119 -13.658 15.123 1.00 11.42 O ATOM 1025 CB TRP A 77 32.556 -13.322 18.178 1.00 50.44 C ATOM 1026 CG TRP A 77 33.438 -12.553 17.241 1.00 52.13 C ATOM 1027 CD1 TRP A 77 34.794 -12.659 17.120 1.00 40.55 C ATOM 1028 CD2 TRP A 77 33.025 -11.560 16.296 1.00 53.22 C ATOM 1029 NE1 TRP A 77 35.249 -11.791 16.156 1.00 11.21 N ATOM 1030 CE2 TRP A 77 34.183 -11.106 15.635 1.00 1.01 C ATOM 1031 CE3 TRP A 77 31.789 -11.011 15.942 1.00 61.31 C ATOM 1032 CZ2 TRP A 77 34.140 -10.130 14.644 1.00 52.45 C ATOM 1033 CZ3 TRP A 77 31.748 -10.042 14.958 1.00 71.22 C ATOM 1034 CH2 TRP A 77 32.917 -9.610 14.317 1.00 13.22 C ATOM 0 H TRP A 77 31.317 -15.237 19.111 1.00 65.52 H new ATOM 0 HA TRP A 77 30.529 -13.123 17.495 1.00 73.13 H new ATOM 0 HB2 TRP A 77 32.255 -12.671 18.999 1.00 50.44 H new ATOM 0 HB3 TRP A 77 33.128 -14.141 18.614 1.00 50.44 H new ATOM 0 HD1 TRP A 77 35.417 -13.326 17.697 1.00 40.55 H new ATOM 0 HE1 TRP A 77 36.223 -11.676 15.874 1.00 11.21 H new ATOM 0 HE3 TRP A 77 30.882 -11.338 16.429 1.00 61.31 H new ATOM 0 HZ2 TRP A 77 35.040 -9.795 14.150 1.00 52.45 H new ATOM 0 HZ3 TRP A 77 30.799 -9.610 14.678 1.00 71.22 H new ATOM 0 HH2 TRP A 77 32.852 -8.852 13.550 1.00 13.22 H new ATOM 1045 N ALA A 78 32.448 -15.300 15.897 1.00 12.44 N ATOM 1046 CA ALA A 78 32.826 -15.769 14.570 1.00 35.22 C ATOM 1047 C ALA A 78 31.616 -16.308 13.814 1.00 41.03 C ATOM 1048 O ALA A 78 31.673 -16.518 12.602 1.00 13.54 O ATOM 1049 CB ALA A 78 33.904 -16.838 14.676 1.00 54.35 C ATOM 0 H ALA A 78 32.871 -15.821 16.665 1.00 12.44 H new ATOM 0 HA ALA A 78 33.223 -14.922 14.011 1.00 35.22 H new ATOM 0 HB1 ALA A 78 34.177 -17.180 13.678 1.00 54.35 H new ATOM 0 HB2 ALA A 78 34.782 -16.422 15.170 1.00 54.35 H new ATOM 0 HB3 ALA A 78 33.526 -17.680 15.257 1.00 54.35 H new ATOM 1055 N ALA A 79 30.523 -16.531 14.536 1.00 2.23 N ATOM 1056 CA ALA A 79 29.300 -17.044 13.933 1.00 72.14 C ATOM 1057 C ALA A 79 28.553 -15.945 13.185 1.00 45.54 C ATOM 1058 O ALA A 79 27.898 -16.203 12.174 1.00 4.25 O ATOM 1059 CB ALA A 79 28.405 -17.662 14.997 1.00 61.12 C ATOM 0 H ALA A 79 30.460 -16.364 15.540 1.00 2.23 H new ATOM 0 HA ALA A 79 29.576 -17.815 13.213 1.00 72.14 H new ATOM 0 HB1 ALA A 79 27.495 -18.041 14.532 1.00 61.12 H new ATOM 0 HB2 ALA A 79 28.932 -18.482 15.484 1.00 61.12 H new ATOM 0 HB3 ALA A 79 28.146 -16.906 15.738 1.00 61.12 H new ATOM 1065 N ILE A 80 28.656 -14.719 13.687 1.00 4.21 N ATOM 1066 CA ILE A 80 27.991 -13.581 13.066 1.00 42.45 C ATOM 1067 C ILE A 80 28.949 -12.809 12.165 1.00 42.43 C ATOM 1068 O ILE A 80 28.649 -11.696 11.733 1.00 4.34 O ATOM 1069 CB ILE A 80 27.412 -12.621 14.122 1.00 22.10 C ATOM 1070 CG1 ILE A 80 26.315 -11.751 13.506 1.00 71.14 C ATOM 1071 CG2 ILE A 80 28.515 -11.754 14.711 1.00 31.10 C ATOM 1072 CD1 ILE A 80 25.813 -10.665 14.431 1.00 23.15 C ATOM 0 H ILE A 80 29.194 -14.489 14.522 1.00 4.21 H new ATOM 0 HA ILE A 80 27.175 -13.983 12.466 1.00 42.45 H new ATOM 0 HB ILE A 80 26.972 -13.212 14.926 1.00 22.10 H new ATOM 0 HG12 ILE A 80 26.696 -11.292 12.594 1.00 71.14 H new ATOM 0 HG13 ILE A 80 25.478 -12.387 13.217 1.00 71.14 H new ATOM 0 HG21 ILE A 80 28.090 -11.081 15.456 1.00 31.10 H new ATOM 0 HG22 ILE A 80 29.265 -12.389 15.182 1.00 31.10 H new ATOM 0 HG23 ILE A 80 28.981 -11.170 13.918 1.00 31.10 H new ATOM 0 HD11 ILE A 80 25.037 -10.088 13.928 1.00 23.15 H new ATOM 0 HD12 ILE A 80 25.401 -11.117 15.333 1.00 23.15 H new ATOM 0 HD13 ILE A 80 26.638 -10.006 14.700 1.00 23.15 H new ATOM 1084 N GLN A 81 30.102 -13.408 11.884 1.00 75.42 N ATOM 1085 CA GLN A 81 31.103 -12.777 11.033 1.00 62.12 C ATOM 1086 C GLN A 81 30.534 -12.483 9.649 1.00 64.25 C ATOM 1087 O GLN A 81 30.493 -11.338 9.198 1.00 71.20 O ATOM 1088 CB GLN A 81 32.337 -13.673 10.910 1.00 30.05 C ATOM 1089 CG GLN A 81 33.613 -13.024 11.423 1.00 70.55 C ATOM 1090 CD GLN A 81 34.615 -14.037 11.940 1.00 23.21 C ATOM 1091 OE1 GLN A 81 34.890 -15.045 11.288 1.00 43.20 O ATOM 1092 NE2 GLN A 81 35.168 -13.775 13.119 1.00 51.53 N ATOM 0 H GLN A 81 30.366 -14.329 12.233 1.00 75.42 H new ATOM 0 HA GLN A 81 31.393 -11.833 11.495 1.00 62.12 H new ATOM 0 HB2 GLN A 81 32.162 -14.597 11.462 1.00 30.05 H new ATOM 0 HB3 GLN A 81 32.474 -13.947 9.864 1.00 30.05 H new ATOM 0 HG2 GLN A 81 34.069 -12.444 10.621 1.00 70.55 H new ATOM 0 HG3 GLN A 81 33.365 -12.324 12.221 1.00 70.55 H new ATOM 0 HE21 GLN A 81 34.911 -12.928 13.626 1.00 51.53 H new ATOM 0 HE22 GLN A 81 35.849 -14.421 13.518 1.00 51.53 H new ATOM 1101 N PRO A 82 30.085 -13.541 8.956 1.00 4.41 N ATOM 1102 CA PRO A 82 29.511 -13.421 7.613 1.00 53.02 C ATOM 1103 C PRO A 82 28.153 -12.727 7.623 1.00 72.21 C ATOM 1104 O PRO A 82 27.792 -12.034 6.672 1.00 52.41 O ATOM 1105 CB PRO A 82 29.365 -14.875 7.159 1.00 74.53 C ATOM 1106 CG PRO A 82 29.256 -15.658 8.422 1.00 53.40 C ATOM 1107 CD PRO A 82 30.104 -14.934 9.431 1.00 33.23 C ATOM 0 HA PRO A 82 30.135 -12.815 6.956 1.00 53.02 H new ATOM 0 HB2 PRO A 82 28.482 -15.008 6.534 1.00 74.53 H new ATOM 0 HB3 PRO A 82 30.224 -15.193 6.569 1.00 74.53 H new ATOM 0 HG2 PRO A 82 28.220 -15.720 8.755 1.00 53.40 H new ATOM 0 HG3 PRO A 82 29.606 -16.680 8.279 1.00 53.40 H new ATOM 0 HD2 PRO A 82 29.694 -15.021 10.437 1.00 33.23 H new ATOM 0 HD3 PRO A 82 31.118 -15.333 9.464 1.00 33.23 H new ATOM 1115 N PHE A 83 27.404 -12.918 8.704 1.00 30.20 N ATOM 1116 CA PHE A 83 26.085 -12.311 8.837 1.00 10.24 C ATOM 1117 C PHE A 83 26.199 -10.852 9.269 1.00 3.31 C ATOM 1118 O PHE A 83 25.241 -10.085 9.167 1.00 74.03 O ATOM 1119 CB PHE A 83 25.242 -13.089 9.849 1.00 33.24 C ATOM 1120 CG PHE A 83 23.858 -12.533 10.031 1.00 4.31 C ATOM 1121 CD1 PHE A 83 23.114 -12.120 8.938 1.00 61.43 C ATOM 1122 CD2 PHE A 83 23.303 -12.421 11.296 1.00 72.55 C ATOM 1123 CE1 PHE A 83 21.841 -11.608 9.101 1.00 33.23 C ATOM 1124 CE2 PHE A 83 22.030 -11.911 11.465 1.00 11.53 C ATOM 1125 CZ PHE A 83 21.298 -11.502 10.367 1.00 24.20 C ATOM 0 H PHE A 83 27.688 -13.488 9.501 1.00 30.20 H new ATOM 0 HA PHE A 83 25.596 -12.347 7.863 1.00 10.24 H new ATOM 0 HB2 PHE A 83 25.168 -14.127 9.526 1.00 33.24 H new ATOM 0 HB3 PHE A 83 25.754 -13.090 10.811 1.00 33.24 H new ATOM 0 HD1 PHE A 83 23.534 -12.199 7.946 1.00 61.43 H new ATOM 0 HD2 PHE A 83 23.871 -12.736 12.159 1.00 72.55 H new ATOM 0 HE1 PHE A 83 21.271 -11.291 8.240 1.00 33.23 H new ATOM 0 HE2 PHE A 83 21.607 -11.832 12.456 1.00 11.53 H new ATOM 0 HZ PHE A 83 20.304 -11.100 10.498 1.00 24.20 H new ATOM 1135 N LEU A 84 27.378 -10.475 9.753 1.00 52.25 N ATOM 1136 CA LEU A 84 27.619 -9.108 10.201 1.00 40.31 C ATOM 1137 C LEU A 84 27.285 -8.107 9.100 1.00 44.54 C ATOM 1138 O LEU A 84 27.024 -6.934 9.370 1.00 73.00 O ATOM 1139 CB LEU A 84 29.077 -8.941 10.633 1.00 61.45 C ATOM 1140 CG LEU A 84 29.305 -8.239 11.972 1.00 72.43 C ATOM 1141 CD1 LEU A 84 29.040 -6.747 11.844 1.00 31.31 C ATOM 1142 CD2 LEU A 84 28.422 -8.849 13.051 1.00 73.45 C ATOM 0 H LEU A 84 28.181 -11.097 9.845 1.00 52.25 H new ATOM 0 HA LEU A 84 26.969 -8.912 11.054 1.00 40.31 H new ATOM 0 HB2 LEU A 84 29.536 -9.928 10.681 1.00 61.45 H new ATOM 0 HB3 LEU A 84 29.603 -8.382 9.859 1.00 61.45 H new ATOM 0 HG LEU A 84 30.347 -8.379 12.261 1.00 72.43 H new ATOM 0 HD11 LEU A 84 29.207 -6.264 12.807 1.00 31.31 H new ATOM 0 HD12 LEU A 84 29.714 -6.320 11.102 1.00 31.31 H new ATOM 0 HD13 LEU A 84 28.008 -6.586 11.532 1.00 31.31 H new ATOM 0 HD21 LEU A 84 28.598 -8.337 13.997 1.00 73.45 H new ATOM 0 HD22 LEU A 84 27.375 -8.741 12.769 1.00 73.45 H new ATOM 0 HD23 LEU A 84 28.660 -9.907 13.161 1.00 73.45 H new ATOM 1154 N CYS A 85 27.295 -8.577 7.857 1.00 55.01 N ATOM 1155 CA CYS A 85 26.991 -7.725 6.714 1.00 44.53 C ATOM 1156 C CYS A 85 25.530 -7.869 6.300 1.00 14.42 C ATOM 1157 O CYS A 85 24.876 -6.890 5.941 1.00 42.32 O ATOM 1158 CB CYS A 85 27.903 -8.073 5.535 1.00 11.23 C ATOM 1159 SG CYS A 85 29.536 -8.717 6.023 1.00 14.12 S ATOM 0 H CYS A 85 27.511 -9.544 7.616 1.00 55.01 H new ATOM 0 HA CYS A 85 27.166 -6.690 7.008 1.00 44.53 H new ATOM 0 HB2 CYS A 85 27.404 -8.814 4.910 1.00 11.23 H new ATOM 0 HB3 CYS A 85 28.044 -7.182 4.923 1.00 11.23 H new ATOM 1164 N ALA A 86 25.023 -9.096 6.354 1.00 24.24 N ATOM 1165 CA ALA A 86 23.639 -9.369 5.988 1.00 1.52 C ATOM 1166 C ALA A 86 22.697 -9.089 7.155 1.00 64.24 C ATOM 1167 O ALA A 86 21.496 -9.345 7.071 1.00 41.22 O ATOM 1168 CB ALA A 86 23.490 -10.809 5.521 1.00 44.24 C ATOM 0 H ALA A 86 25.551 -9.918 6.648 1.00 24.24 H new ATOM 0 HA ALA A 86 23.368 -8.703 5.168 1.00 1.52 H new ATOM 0 HB1 ALA A 86 22.451 -10.998 5.251 1.00 44.24 H new ATOM 0 HB2 ALA A 86 24.127 -10.978 4.653 1.00 44.24 H new ATOM 0 HB3 ALA A 86 23.785 -11.484 6.324 1.00 44.24 H new ATOM 1174 N VAL A 87 23.251 -8.563 8.243 1.00 33.50 N ATOM 1175 CA VAL A 87 22.460 -8.249 9.427 1.00 72.01 C ATOM 1176 C VAL A 87 22.285 -6.743 9.587 1.00 75.05 C ATOM 1177 O VAL A 87 21.237 -6.273 10.031 1.00 3.35 O ATOM 1178 CB VAL A 87 23.109 -8.817 10.703 1.00 70.42 C ATOM 1179 CG1 VAL A 87 24.400 -8.078 11.020 1.00 14.34 C ATOM 1180 CG2 VAL A 87 22.139 -8.741 11.873 1.00 64.45 C ATOM 0 H VAL A 87 24.244 -8.346 8.329 1.00 33.50 H new ATOM 0 HA VAL A 87 21.484 -8.713 9.287 1.00 72.01 H new ATOM 0 HB VAL A 87 23.352 -9.865 10.531 1.00 70.42 H new ATOM 0 HG11 VAL A 87 24.844 -8.493 11.925 1.00 14.34 H new ATOM 0 HG12 VAL A 87 25.097 -8.190 10.189 1.00 14.34 H new ATOM 0 HG13 VAL A 87 24.186 -7.020 11.173 1.00 14.34 H new ATOM 0 HG21 VAL A 87 22.614 -9.147 12.766 1.00 64.45 H new ATOM 0 HG22 VAL A 87 21.862 -7.702 12.049 1.00 64.45 H new ATOM 0 HG23 VAL A 87 21.245 -9.320 11.643 1.00 64.45 H new ATOM 1190 N PHE A 88 23.317 -5.991 9.220 1.00 12.40 N ATOM 1191 CA PHE A 88 23.278 -4.537 9.323 1.00 54.51 C ATOM 1192 C PHE A 88 23.267 -3.894 7.939 1.00 4.51 C ATOM 1193 O PHE A 88 22.588 -2.892 7.712 1.00 72.43 O ATOM 1194 CB PHE A 88 24.477 -4.028 10.125 1.00 64.30 C ATOM 1195 CG PHE A 88 24.657 -4.727 11.442 1.00 2.03 C ATOM 1196 CD1 PHE A 88 23.596 -4.855 12.324 1.00 71.52 C ATOM 1197 CD2 PHE A 88 25.887 -5.256 11.799 1.00 2.30 C ATOM 1198 CE1 PHE A 88 23.759 -5.497 13.537 1.00 71.21 C ATOM 1199 CE2 PHE A 88 26.056 -5.899 13.011 1.00 41.02 C ATOM 1200 CZ PHE A 88 24.990 -6.021 13.880 1.00 1.33 C ATOM 0 H PHE A 88 24.191 -6.364 8.849 1.00 12.40 H new ATOM 0 HA PHE A 88 22.360 -4.259 9.841 1.00 54.51 H new ATOM 0 HB2 PHE A 88 25.382 -4.153 9.530 1.00 64.30 H new ATOM 0 HB3 PHE A 88 24.358 -2.959 10.303 1.00 64.30 H new ATOM 0 HD1 PHE A 88 22.631 -4.448 12.061 1.00 71.52 H new ATOM 0 HD2 PHE A 88 26.724 -5.165 11.122 1.00 2.30 H new ATOM 0 HE1 PHE A 88 22.924 -5.589 14.216 1.00 71.21 H new ATOM 0 HE2 PHE A 88 27.020 -6.305 13.278 1.00 41.02 H new ATOM 0 HZ PHE A 88 25.119 -6.525 14.826 1.00 1.33 H new ATOM 1210 N LYS A 89 24.027 -4.476 7.017 1.00 14.22 N ATOM 1211 CA LYS A 89 24.106 -3.962 5.655 1.00 61.21 C ATOM 1212 C LYS A 89 23.471 -4.936 4.668 1.00 34.41 C ATOM 1213 O LYS A 89 24.156 -5.664 3.949 1.00 35.53 O ATOM 1214 CB LYS A 89 25.565 -3.707 5.268 1.00 32.24 C ATOM 1215 CG LYS A 89 26.236 -2.632 6.105 1.00 44.34 C ATOM 1216 CD LYS A 89 26.915 -3.221 7.330 1.00 50.30 C ATOM 1217 CE LYS A 89 27.124 -2.171 8.410 1.00 15.44 C ATOM 1218 NZ LYS A 89 27.799 -0.954 7.879 1.00 73.42 N ATOM 0 H LYS A 89 24.597 -5.304 7.189 1.00 14.22 H new ATOM 0 HA LYS A 89 23.556 -3.022 5.616 1.00 61.21 H new ATOM 0 HB2 LYS A 89 26.126 -4.636 5.367 1.00 32.24 H new ATOM 0 HB3 LYS A 89 25.609 -3.418 4.218 1.00 32.24 H new ATOM 0 HG2 LYS A 89 26.972 -2.104 5.499 1.00 44.34 H new ATOM 0 HG3 LYS A 89 25.494 -1.897 6.417 1.00 44.34 H new ATOM 0 HD2 LYS A 89 26.310 -4.036 7.726 1.00 50.30 H new ATOM 0 HD3 LYS A 89 27.877 -3.647 7.045 1.00 50.30 H new ATOM 0 HE2 LYS A 89 26.161 -1.894 8.838 1.00 15.44 H new ATOM 0 HE3 LYS A 89 27.722 -2.595 9.217 1.00 15.44 H new ATOM 0 HZ1 LYS A 89 28.135 -0.370 8.671 1.00 73.42 H new ATOM 0 HZ2 LYS A 89 28.608 -1.235 7.289 1.00 73.42 H new ATOM 0 HZ3 LYS A 89 27.126 -0.406 7.306 1.00 73.42 H new ATOM 1232 N PRO A 90 22.130 -4.951 4.630 1.00 70.10 N ATOM 1233 CA PRO A 90 21.373 -5.830 3.734 1.00 62.15 C ATOM 1234 C PRO A 90 21.508 -5.421 2.271 1.00 70.12 C ATOM 1235 O PRO A 90 21.675 -4.242 1.958 1.00 64.34 O ATOM 1236 CB PRO A 90 19.927 -5.658 4.206 1.00 63.33 C ATOM 1237 CG PRO A 90 19.894 -4.311 4.840 1.00 14.15 C ATOM 1238 CD PRO A 90 21.250 -4.110 5.459 1.00 73.44 C ATOM 0 HA PRO A 90 21.730 -6.859 3.776 1.00 62.15 H new ATOM 0 HB2 PRO A 90 19.228 -5.720 3.372 1.00 63.33 H new ATOM 0 HB3 PRO A 90 19.647 -6.437 4.915 1.00 63.33 H new ATOM 0 HG2 PRO A 90 19.684 -3.537 4.101 1.00 14.15 H new ATOM 0 HG3 PRO A 90 19.109 -4.254 5.594 1.00 14.15 H new ATOM 0 HD2 PRO A 90 21.553 -3.063 5.433 1.00 73.44 H new ATOM 0 HD3 PRO A 90 21.265 -4.420 6.504 1.00 73.44 H new ATOM 1246 N LYS A 91 21.434 -6.402 1.378 1.00 74.23 N ATOM 1247 CA LYS A 91 21.545 -6.145 -0.053 1.00 64.01 C ATOM 1248 C LYS A 91 20.277 -5.488 -0.589 1.00 5.55 C ATOM 1249 O LYS A 91 19.300 -6.166 -0.905 1.00 31.34 O ATOM 1250 CB LYS A 91 21.814 -7.449 -0.807 1.00 73.52 C ATOM 1251 CG LYS A 91 21.975 -7.264 -2.306 1.00 12.50 C ATOM 1252 CD LYS A 91 22.602 -8.486 -2.955 1.00 41.33 C ATOM 1253 CE LYS A 91 22.120 -8.666 -4.387 1.00 2.44 C ATOM 1254 NZ LYS A 91 22.650 -9.916 -4.997 1.00 74.51 N ATOM 0 H LYS A 91 21.297 -7.383 1.620 1.00 74.23 H new ATOM 0 HA LYS A 91 22.380 -5.463 -0.210 1.00 64.01 H new ATOM 0 HB2 LYS A 91 22.717 -7.910 -0.407 1.00 73.52 H new ATOM 0 HB3 LYS A 91 20.993 -8.142 -0.621 1.00 73.52 H new ATOM 0 HG2 LYS A 91 21.001 -7.071 -2.756 1.00 12.50 H new ATOM 0 HG3 LYS A 91 22.595 -6.389 -2.501 1.00 12.50 H new ATOM 0 HD2 LYS A 91 23.688 -8.388 -2.945 1.00 41.33 H new ATOM 0 HD3 LYS A 91 22.357 -9.374 -2.373 1.00 41.33 H new ATOM 0 HE2 LYS A 91 21.030 -8.687 -4.403 1.00 2.44 H new ATOM 0 HE3 LYS A 91 22.431 -7.810 -4.985 1.00 2.44 H new ATOM 0 HZ1 LYS A 91 22.299 -10.002 -5.972 1.00 74.51 H new ATOM 0 HZ2 LYS A 91 23.690 -9.885 -5.005 1.00 74.51 H new ATOM 0 HZ3 LYS A 91 22.332 -10.735 -4.441 1.00 74.51 H new ATOM 1268 N CYS A 92 20.301 -4.163 -0.689 1.00 53.23 N ATOM 1269 CA CYS A 92 19.154 -3.413 -1.187 1.00 71.04 C ATOM 1270 C CYS A 92 19.322 -3.082 -2.668 1.00 0.35 C ATOM 1271 O CYS A 92 20.255 -2.379 -3.054 1.00 23.12 O ATOM 1272 CB CYS A 92 18.972 -2.125 -0.383 1.00 13.33 C ATOM 1273 SG CYS A 92 17.259 -1.504 -0.351 1.00 4.22 S ATOM 0 H CYS A 92 21.102 -3.587 -0.432 1.00 53.23 H new ATOM 0 HA CYS A 92 18.266 -4.035 -1.070 1.00 71.04 H new ATOM 0 HB2 CYS A 92 19.303 -2.299 0.641 1.00 13.33 H new ATOM 0 HB3 CYS A 92 19.619 -1.354 -0.801 1.00 13.33 H new ATOM 1278 N GLU A 93 18.411 -3.593 -3.490 1.00 22.01 N ATOM 1279 CA GLU A 93 18.459 -3.352 -4.927 1.00 44.42 C ATOM 1280 C GLU A 93 17.066 -3.058 -5.477 1.00 4.04 C ATOM 1281 O GLU A 93 16.069 -3.165 -4.762 1.00 42.23 O ATOM 1282 CB GLU A 93 19.061 -4.559 -5.650 1.00 35.13 C ATOM 1283 CG GLU A 93 18.333 -5.862 -5.366 1.00 31.42 C ATOM 1284 CD GLU A 93 18.151 -6.712 -6.609 1.00 13.52 C ATOM 1285 OE1 GLU A 93 18.885 -6.485 -7.594 1.00 33.42 O ATOM 1286 OE2 GLU A 93 17.275 -7.601 -6.597 1.00 72.31 O ATOM 0 H GLU A 93 17.631 -4.176 -3.186 1.00 22.01 H new ATOM 0 HA GLU A 93 19.091 -2.481 -5.102 1.00 44.42 H new ATOM 0 HB2 GLU A 93 19.049 -4.372 -6.724 1.00 35.13 H new ATOM 0 HB3 GLU A 93 20.105 -4.664 -5.356 1.00 35.13 H new ATOM 0 HG2 GLU A 93 18.890 -6.430 -4.621 1.00 31.42 H new ATOM 0 HG3 GLU A 93 17.356 -5.642 -4.935 1.00 31.42 H new ATOM 1293 N LYS A 94 17.006 -2.687 -6.751 1.00 13.41 N ATOM 1294 CA LYS A 94 15.736 -2.378 -7.399 1.00 5.43 C ATOM 1295 C LYS A 94 15.311 -3.509 -8.330 1.00 2.43 C ATOM 1296 O LYS A 94 15.844 -3.652 -9.431 1.00 15.42 O ATOM 1297 CB LYS A 94 15.847 -1.070 -8.185 1.00 50.52 C ATOM 1298 CG LYS A 94 14.987 0.051 -7.626 1.00 61.22 C ATOM 1299 CD LYS A 94 15.016 1.277 -8.524 1.00 34.52 C ATOM 1300 CE LYS A 94 16.423 1.837 -8.658 1.00 24.33 C ATOM 1301 NZ LYS A 94 16.423 3.324 -8.736 1.00 65.21 N ATOM 0 H LYS A 94 17.822 -2.593 -7.356 1.00 13.41 H new ATOM 0 HA LYS A 94 14.978 -2.266 -6.624 1.00 5.43 H new ATOM 0 HB2 LYS A 94 16.888 -0.748 -8.193 1.00 50.52 H new ATOM 0 HB3 LYS A 94 15.562 -1.253 -9.221 1.00 50.52 H new ATOM 0 HG2 LYS A 94 13.960 -0.297 -7.517 1.00 61.22 H new ATOM 0 HG3 LYS A 94 15.340 0.320 -6.630 1.00 61.22 H new ATOM 0 HD2 LYS A 94 14.632 1.016 -9.510 1.00 34.52 H new ATOM 0 HD3 LYS A 94 14.356 2.043 -8.117 1.00 34.52 H new ATOM 0 HE2 LYS A 94 17.023 1.518 -7.806 1.00 24.33 H new ATOM 0 HE3 LYS A 94 16.894 1.426 -9.551 1.00 24.33 H new ATOM 0 HZ1 LYS A 94 17.401 3.667 -8.827 1.00 65.21 H new ATOM 0 HZ2 LYS A 94 15.871 3.628 -9.563 1.00 65.21 H new ATOM 0 HZ3 LYS A 94 15.997 3.717 -7.872 1.00 65.21 H new ATOM 1315 N ILE A 95 14.349 -4.308 -7.881 1.00 42.12 N ATOM 1316 CA ILE A 95 13.852 -5.424 -8.676 1.00 14.11 C ATOM 1317 C ILE A 95 12.813 -4.957 -9.690 1.00 13.33 C ATOM 1318 O ILE A 95 11.736 -4.490 -9.320 1.00 42.10 O ATOM 1319 CB ILE A 95 13.229 -6.516 -7.786 1.00 1.53 C ATOM 1320 CG1 ILE A 95 14.308 -7.183 -6.930 1.00 73.11 C ATOM 1321 CG2 ILE A 95 12.508 -7.548 -8.639 1.00 63.05 C ATOM 1322 CD1 ILE A 95 14.682 -6.387 -5.700 1.00 11.42 C ATOM 0 H ILE A 95 13.899 -4.203 -6.972 1.00 42.12 H new ATOM 0 HA ILE A 95 14.709 -5.842 -9.204 1.00 14.11 H new ATOM 0 HB ILE A 95 12.501 -6.051 -7.122 1.00 1.53 H new ATOM 0 HG12 ILE A 95 13.958 -8.169 -6.622 1.00 73.11 H new ATOM 0 HG13 ILE A 95 15.199 -7.336 -7.538 1.00 73.11 H new ATOM 0 HG21 ILE A 95 12.073 -8.313 -7.995 1.00 63.05 H new ATOM 0 HG22 ILE A 95 11.717 -7.061 -9.209 1.00 63.05 H new ATOM 0 HG23 ILE A 95 13.216 -8.012 -9.326 1.00 63.05 H new ATOM 0 HD11 ILE A 95 15.452 -6.920 -5.142 1.00 11.42 H new ATOM 0 HD12 ILE A 95 15.062 -5.411 -6.000 1.00 11.42 H new ATOM 0 HD13 ILE A 95 13.802 -6.256 -5.070 1.00 11.42 H new ATOM 1334 N ASN A 96 13.143 -5.088 -10.970 1.00 51.44 N ATOM 1335 CA ASN A 96 12.238 -4.680 -12.039 1.00 13.03 C ATOM 1336 C ASN A 96 11.799 -3.230 -11.856 1.00 61.14 C ATOM 1337 O ASN A 96 10.714 -2.840 -12.285 1.00 71.33 O ATOM 1338 CB ASN A 96 11.012 -5.595 -12.074 1.00 12.14 C ATOM 1339 CG ASN A 96 10.289 -5.542 -13.406 1.00 31.44 C ATOM 1340 OD1 ASN A 96 10.709 -6.170 -14.378 1.00 3.12 O ATOM 1341 ND2 ASN A 96 9.195 -4.791 -13.456 1.00 21.02 N ATOM 0 H ASN A 96 14.030 -5.473 -11.293 1.00 51.44 H new ATOM 0 HA ASN A 96 12.772 -4.763 -12.985 1.00 13.03 H new ATOM 0 HB2 ASN A 96 11.321 -6.620 -11.872 1.00 12.14 H new ATOM 0 HB3 ASN A 96 10.324 -5.307 -11.279 1.00 12.14 H new ATOM 0 HD21 ASN A 96 8.666 -4.718 -14.325 1.00 21.02 H new ATOM 0 HD22 ASN A 96 8.884 -4.288 -12.625 1.00 21.02 H new ATOM 1348 N GLY A 97 12.652 -2.435 -11.217 1.00 31.30 N ATOM 1349 CA GLY A 97 12.335 -1.037 -10.989 1.00 62.55 C ATOM 1350 C GLY A 97 11.627 -0.811 -9.668 1.00 43.04 C ATOM 1351 O GLY A 97 10.933 0.190 -9.493 1.00 62.20 O ATOM 0 H GLY A 97 13.557 -2.734 -10.853 1.00 31.30 H new ATOM 0 HA2 GLY A 97 13.254 -0.451 -11.010 1.00 62.55 H new ATOM 0 HA3 GLY A 97 11.706 -0.673 -11.802 1.00 62.55 H new ATOM 1355 N GLU A 98 11.802 -1.744 -8.738 1.00 11.15 N ATOM 1356 CA GLU A 98 11.172 -1.641 -7.427 1.00 34.54 C ATOM 1357 C GLU A 98 12.209 -1.759 -6.314 1.00 32.05 C ATOM 1358 O GLU A 98 12.824 -2.810 -6.132 1.00 50.12 O ATOM 1359 CB GLU A 98 10.106 -2.727 -7.262 1.00 72.03 C ATOM 1360 CG GLU A 98 9.027 -2.688 -8.332 1.00 1.33 C ATOM 1361 CD GLU A 98 7.989 -3.778 -8.153 1.00 73.21 C ATOM 1362 OE1 GLU A 98 7.997 -4.437 -7.092 1.00 1.52 O ATOM 1363 OE2 GLU A 98 7.168 -3.974 -9.074 1.00 3.41 O ATOM 0 H GLU A 98 12.374 -2.579 -8.868 1.00 11.15 H new ATOM 0 HA GLU A 98 10.698 -0.662 -7.356 1.00 34.54 H new ATOM 0 HB2 GLU A 98 10.589 -3.704 -7.280 1.00 72.03 H new ATOM 0 HB3 GLU A 98 9.639 -2.620 -6.283 1.00 72.03 H new ATOM 0 HG2 GLU A 98 8.535 -1.716 -8.311 1.00 1.33 H new ATOM 0 HG3 GLU A 98 9.490 -2.790 -9.314 1.00 1.33 H new ATOM 1370 N ASP A 99 12.397 -0.673 -5.572 1.00 23.22 N ATOM 1371 CA ASP A 99 13.359 -0.653 -4.476 1.00 23.41 C ATOM 1372 C ASP A 99 12.963 -1.646 -3.387 1.00 63.03 C ATOM 1373 O ASP A 99 12.092 -1.365 -2.565 1.00 4.14 O ATOM 1374 CB ASP A 99 13.464 0.754 -3.886 1.00 42.05 C ATOM 1375 CG ASP A 99 14.193 1.714 -4.806 1.00 61.01 C ATOM 1376 OD1 ASP A 99 15.440 1.747 -4.760 1.00 4.41 O ATOM 1377 OD2 ASP A 99 13.516 2.432 -5.571 1.00 42.54 O ATOM 0 H ASP A 99 11.896 0.205 -5.710 1.00 23.22 H new ATOM 0 HA ASP A 99 14.331 -0.945 -4.874 1.00 23.41 H new ATOM 0 HB2 ASP A 99 12.463 1.137 -3.686 1.00 42.05 H new ATOM 0 HB3 ASP A 99 13.984 0.706 -2.929 1.00 42.05 H new ATOM 1382 N MET A 100 13.608 -2.808 -3.390 1.00 44.01 N ATOM 1383 CA MET A 100 13.323 -3.842 -2.402 1.00 62.23 C ATOM 1384 C MET A 100 14.594 -4.257 -1.668 1.00 32.44 C ATOM 1385 O MET A 100 15.704 -3.972 -2.116 1.00 50.45 O ATOM 1386 CB MET A 100 12.689 -5.060 -3.076 1.00 72.35 C ATOM 1387 CG MET A 100 11.680 -4.701 -4.155 1.00 61.13 C ATOM 1388 SD MET A 100 10.250 -5.800 -4.163 1.00 4.30 S ATOM 1389 CE MET A 100 10.932 -7.237 -4.986 1.00 42.12 C ATOM 0 H MET A 100 14.331 -3.057 -4.065 1.00 44.01 H new ATOM 0 HA MET A 100 12.622 -3.432 -1.675 1.00 62.23 H new ATOM 0 HB2 MET A 100 13.476 -5.673 -3.516 1.00 72.35 H new ATOM 0 HB3 MET A 100 12.197 -5.669 -2.318 1.00 72.35 H new ATOM 0 HG2 MET A 100 11.344 -3.675 -4.006 1.00 61.13 H new ATOM 0 HG3 MET A 100 12.167 -4.738 -5.129 1.00 61.13 H new ATOM 0 HE1 MET A 100 10.577 -8.142 -4.492 1.00 42.12 H new ATOM 0 HE2 MET A 100 10.614 -7.244 -6.029 1.00 42.12 H new ATOM 0 HE3 MET A 100 12.020 -7.201 -4.939 1.00 42.12 H new ATOM 1399 N VAL A 101 14.424 -4.933 -0.535 1.00 73.15 N ATOM 1400 CA VAL A 101 15.557 -5.388 0.261 1.00 70.21 C ATOM 1401 C VAL A 101 15.680 -6.907 0.224 1.00 70.31 C ATOM 1402 O VAL A 101 14.727 -7.610 -0.115 1.00 42.40 O ATOM 1403 CB VAL A 101 15.434 -4.930 1.726 1.00 15.42 C ATOM 1404 CG1 VAL A 101 15.478 -3.412 1.816 1.00 12.14 C ATOM 1405 CG2 VAL A 101 14.155 -5.472 2.348 1.00 43.23 C ATOM 0 H VAL A 101 13.512 -5.177 -0.149 1.00 73.15 H new ATOM 0 HA VAL A 101 16.450 -4.943 -0.177 1.00 70.21 H new ATOM 0 HB VAL A 101 16.280 -5.328 2.285 1.00 15.42 H new ATOM 0 HG11 VAL A 101 15.390 -3.107 2.859 1.00 12.14 H new ATOM 0 HG12 VAL A 101 16.423 -3.051 1.411 1.00 12.14 H new ATOM 0 HG13 VAL A 101 14.653 -2.989 1.243 1.00 12.14 H new ATOM 0 HG21 VAL A 101 14.084 -5.139 3.383 1.00 43.23 H new ATOM 0 HG22 VAL A 101 13.294 -5.105 1.789 1.00 43.23 H new ATOM 0 HG23 VAL A 101 14.169 -6.561 2.318 1.00 43.23 H new ATOM 1415 N TYR A 102 16.859 -7.408 0.575 1.00 31.42 N ATOM 1416 CA TYR A 102 17.108 -8.845 0.580 1.00 32.15 C ATOM 1417 C TYR A 102 17.390 -9.344 1.994 1.00 3.23 C ATOM 1418 O TYR A 102 18.490 -9.166 2.520 1.00 20.31 O ATOM 1419 CB TYR A 102 18.284 -9.183 -0.336 1.00 65.43 C ATOM 1420 CG TYR A 102 17.881 -9.437 -1.771 1.00 52.23 C ATOM 1421 CD1 TYR A 102 16.883 -10.353 -2.081 1.00 54.51 C ATOM 1422 CD2 TYR A 102 18.498 -8.762 -2.817 1.00 52.30 C ATOM 1423 CE1 TYR A 102 16.511 -10.588 -3.391 1.00 12.13 C ATOM 1424 CE2 TYR A 102 18.131 -8.990 -4.129 1.00 44.43 C ATOM 1425 CZ TYR A 102 17.138 -9.904 -4.411 1.00 53.31 C ATOM 1426 OH TYR A 102 16.771 -10.135 -5.717 1.00 51.41 O ATOM 0 H TYR A 102 17.657 -6.841 0.860 1.00 31.42 H new ATOM 0 HA TYR A 102 16.213 -9.344 0.210 1.00 32.15 H new ATOM 0 HB2 TYR A 102 19.002 -8.363 -0.309 1.00 65.43 H new ATOM 0 HB3 TYR A 102 18.793 -10.066 0.051 1.00 65.43 H new ATOM 0 HD1 TYR A 102 16.390 -10.890 -1.285 1.00 54.51 H new ATOM 0 HD2 TYR A 102 19.278 -8.047 -2.601 1.00 52.30 H new ATOM 0 HE1 TYR A 102 15.733 -11.303 -3.615 1.00 12.13 H new ATOM 0 HE2 TYR A 102 18.619 -8.455 -4.930 1.00 44.43 H new ATOM 0 HH TYR A 102 16.938 -9.330 -6.251 1.00 51.41 H new ATOM 1436 N LEU A 103 16.390 -9.969 2.605 1.00 71.33 N ATOM 1437 CA LEU A 103 16.529 -10.496 3.958 1.00 11.21 C ATOM 1438 C LEU A 103 17.493 -11.678 3.986 1.00 14.24 C ATOM 1439 O LEU A 103 17.733 -12.339 2.976 1.00 53.22 O ATOM 1440 CB LEU A 103 15.165 -10.922 4.503 1.00 33.22 C ATOM 1441 CG LEU A 103 14.239 -9.792 4.955 1.00 5.15 C ATOM 1442 CD1 LEU A 103 13.492 -9.206 3.767 1.00 4.15 C ATOM 1443 CD2 LEU A 103 13.262 -10.292 6.009 1.00 73.23 C ATOM 0 H LEU A 103 15.473 -10.123 2.185 1.00 71.33 H new ATOM 0 HA LEU A 103 16.935 -9.706 4.589 1.00 11.21 H new ATOM 0 HB2 LEU A 103 14.652 -11.498 3.733 1.00 33.22 H new ATOM 0 HB3 LEU A 103 15.327 -11.592 5.348 1.00 33.22 H new ATOM 0 HG LEU A 103 14.848 -9.004 5.398 1.00 5.15 H new ATOM 0 HD11 LEU A 103 12.838 -8.403 4.108 1.00 4.15 H new ATOM 0 HD12 LEU A 103 14.208 -8.809 3.047 1.00 4.15 H new ATOM 0 HD13 LEU A 103 12.894 -9.985 3.293 1.00 4.15 H new ATOM 0 HD21 LEU A 103 12.611 -9.474 6.319 1.00 73.23 H new ATOM 0 HD22 LEU A 103 12.658 -11.098 5.592 1.00 73.23 H new ATOM 0 HD23 LEU A 103 13.816 -10.662 6.872 1.00 73.23 H new ATOM 1455 N PRO A 104 18.057 -11.953 5.171 1.00 3.05 N ATOM 1456 CA PRO A 104 19.002 -13.058 5.361 1.00 74.12 C ATOM 1457 C PRO A 104 18.327 -14.422 5.255 1.00 1.41 C ATOM 1458 O PRO A 104 17.158 -14.575 5.608 1.00 72.22 O ATOM 1459 CB PRO A 104 19.532 -12.832 6.779 1.00 60.42 C ATOM 1460 CG PRO A 104 18.453 -12.072 7.470 1.00 24.32 C ATOM 1461 CD PRO A 104 17.817 -11.207 6.418 1.00 11.10 C ATOM 0 HA PRO A 104 19.780 -13.065 4.597 1.00 74.12 H new ATOM 0 HB2 PRO A 104 19.734 -13.778 7.282 1.00 60.42 H new ATOM 0 HB3 PRO A 104 20.466 -12.271 6.768 1.00 60.42 H new ATOM 0 HG2 PRO A 104 17.722 -12.748 7.914 1.00 24.32 H new ATOM 0 HG3 PRO A 104 18.860 -11.466 8.280 1.00 24.32 H new ATOM 0 HD2 PRO A 104 16.752 -11.066 6.603 1.00 11.10 H new ATOM 0 HD3 PRO A 104 18.269 -10.215 6.386 1.00 11.10 H new ATOM 1469 N SER A 105 19.072 -15.409 4.768 1.00 53.12 N ATOM 1470 CA SER A 105 18.544 -16.759 4.613 1.00 60.44 C ATOM 1471 C SER A 105 18.720 -17.562 5.898 1.00 34.21 C ATOM 1472 O SER A 105 19.542 -17.221 6.749 1.00 61.54 O ATOM 1473 CB SER A 105 19.242 -17.472 3.453 1.00 24.52 C ATOM 1474 OG SER A 105 19.171 -16.704 2.265 1.00 73.24 O ATOM 0 H SER A 105 20.043 -15.299 4.474 1.00 53.12 H new ATOM 0 HA SER A 105 17.479 -16.683 4.396 1.00 60.44 H new ATOM 0 HB2 SER A 105 20.285 -17.655 3.710 1.00 24.52 H new ATOM 0 HB3 SER A 105 18.779 -18.445 3.289 1.00 24.52 H new ATOM 0 HG SER A 105 19.626 -17.181 1.540 1.00 73.24 H new ATOM 1480 N TYR A 106 17.941 -18.630 6.032 1.00 13.21 N ATOM 1481 CA TYR A 106 18.007 -19.481 7.214 1.00 1.22 C ATOM 1482 C TYR A 106 19.445 -19.901 7.503 1.00 61.23 C ATOM 1483 O TYR A 106 19.835 -20.066 8.658 1.00 14.43 O ATOM 1484 CB TYR A 106 17.130 -20.720 7.027 1.00 53.45 C ATOM 1485 CG TYR A 106 17.737 -21.758 6.111 1.00 74.33 C ATOM 1486 CD1 TYR A 106 17.972 -21.479 4.770 1.00 34.21 C ATOM 1487 CD2 TYR A 106 18.076 -23.019 6.587 1.00 70.05 C ATOM 1488 CE1 TYR A 106 18.525 -22.426 3.930 1.00 41.42 C ATOM 1489 CE2 TYR A 106 18.631 -23.971 5.754 1.00 63.23 C ATOM 1490 CZ TYR A 106 18.853 -23.670 4.426 1.00 5.12 C ATOM 1491 OH TYR A 106 19.406 -24.615 3.593 1.00 44.14 O ATOM 0 H TYR A 106 17.257 -18.927 5.336 1.00 13.21 H new ATOM 0 HA TYR A 106 17.637 -18.908 8.064 1.00 1.22 H new ATOM 0 HB2 TYR A 106 16.942 -21.172 8.001 1.00 53.45 H new ATOM 0 HB3 TYR A 106 16.164 -20.414 6.626 1.00 53.45 H new ATOM 0 HD1 TYR A 106 17.718 -20.505 4.378 1.00 34.21 H new ATOM 0 HD2 TYR A 106 17.903 -23.259 7.626 1.00 70.05 H new ATOM 0 HE1 TYR A 106 18.700 -22.193 2.890 1.00 41.42 H new ATOM 0 HE2 TYR A 106 18.890 -24.946 6.140 1.00 63.23 H new ATOM 0 HH TYR A 106 19.579 -25.436 4.099 1.00 44.14 H new ATOM 1501 N GLU A 107 20.229 -20.073 6.443 1.00 53.44 N ATOM 1502 CA GLU A 107 21.624 -20.474 6.582 1.00 54.15 C ATOM 1503 C GLU A 107 22.435 -19.389 7.284 1.00 14.22 C ATOM 1504 O GLU A 107 23.073 -19.640 8.306 1.00 71.12 O ATOM 1505 CB GLU A 107 22.231 -20.772 5.209 1.00 51.40 C ATOM 1506 CG GLU A 107 23.369 -21.778 5.252 1.00 11.51 C ATOM 1507 CD GLU A 107 24.617 -21.277 4.552 1.00 40.25 C ATOM 1508 OE1 GLU A 107 24.554 -21.037 3.327 1.00 32.54 O ATOM 1509 OE2 GLU A 107 25.656 -21.125 5.227 1.00 43.54 O ATOM 0 H GLU A 107 19.922 -19.941 5.479 1.00 53.44 H new ATOM 0 HA GLU A 107 21.657 -21.378 7.190 1.00 54.15 H new ATOM 0 HB2 GLU A 107 21.449 -21.149 4.549 1.00 51.40 H new ATOM 0 HB3 GLU A 107 22.596 -19.842 4.773 1.00 51.40 H new ATOM 0 HG2 GLU A 107 23.607 -22.008 6.291 1.00 11.51 H new ATOM 0 HG3 GLU A 107 23.044 -22.708 4.786 1.00 11.51 H new ATOM 1516 N MET A 108 22.404 -18.182 6.728 1.00 22.20 N ATOM 1517 CA MET A 108 23.136 -17.058 7.301 1.00 33.33 C ATOM 1518 C MET A 108 22.810 -16.896 8.783 1.00 74.34 C ATOM 1519 O MET A 108 23.698 -16.664 9.603 1.00 65.34 O ATOM 1520 CB MET A 108 22.802 -15.768 6.550 1.00 61.35 C ATOM 1521 CG MET A 108 23.731 -15.489 5.379 1.00 25.24 C ATOM 1522 SD MET A 108 25.363 -14.932 5.906 1.00 3.42 S ATOM 1523 CE MET A 108 25.466 -13.350 5.073 1.00 52.44 C ATOM 0 H MET A 108 21.880 -17.957 5.882 1.00 22.20 H new ATOM 0 HA MET A 108 24.202 -17.262 7.201 1.00 33.33 H new ATOM 0 HB2 MET A 108 21.777 -15.825 6.184 1.00 61.35 H new ATOM 0 HB3 MET A 108 22.846 -14.930 7.246 1.00 61.35 H new ATOM 0 HG2 MET A 108 23.836 -16.393 4.780 1.00 25.24 H new ATOM 0 HG3 MET A 108 23.282 -14.731 4.737 1.00 25.24 H new ATOM 0 HE1 MET A 108 26.339 -13.338 4.421 1.00 52.44 H new ATOM 0 HE2 MET A 108 24.566 -13.193 4.478 1.00 52.44 H new ATOM 0 HE3 MET A 108 25.555 -12.554 5.813 1.00 52.44 H new ATOM 1533 N CYS A 109 21.530 -17.019 9.119 1.00 20.41 N ATOM 1534 CA CYS A 109 21.086 -16.886 10.501 1.00 10.12 C ATOM 1535 C CYS A 109 21.405 -18.147 11.299 1.00 13.02 C ATOM 1536 O CYS A 109 21.529 -18.105 12.523 1.00 12.53 O ATOM 1537 CB CYS A 109 19.583 -16.604 10.551 1.00 1.21 C ATOM 1538 SG CYS A 109 19.033 -15.772 12.076 1.00 72.43 S ATOM 0 H CYS A 109 20.782 -17.211 8.453 1.00 20.41 H new ATOM 0 HA CYS A 109 21.621 -16.049 10.949 1.00 10.12 H new ATOM 0 HB2 CYS A 109 19.311 -15.987 9.695 1.00 1.21 H new ATOM 0 HB3 CYS A 109 19.044 -17.546 10.449 1.00 1.21 H new ATOM 1543 N ARG A 110 21.536 -19.268 10.597 1.00 40.53 N ATOM 1544 CA ARG A 110 21.839 -20.541 11.239 1.00 3.30 C ATOM 1545 C ARG A 110 23.291 -20.581 11.708 1.00 52.01 C ATOM 1546 O ARG A 110 23.630 -21.300 12.649 1.00 55.52 O ATOM 1547 CB ARG A 110 21.571 -21.699 10.276 1.00 11.30 C ATOM 1548 CG ARG A 110 22.038 -23.047 10.799 1.00 3.15 C ATOM 1549 CD ARG A 110 21.126 -24.172 10.335 1.00 45.44 C ATOM 1550 NE ARG A 110 21.866 -25.403 10.072 1.00 44.01 N ATOM 1551 CZ ARG A 110 22.580 -25.611 8.971 1.00 3.22 C ATOM 1552 NH1 ARG A 110 22.651 -24.674 8.036 1.00 52.31 N ATOM 1553 NH2 ARG A 110 23.226 -26.758 8.805 1.00 42.14 N ATOM 0 H ARG A 110 21.437 -19.320 9.583 1.00 40.53 H new ATOM 0 HA ARG A 110 21.191 -20.644 12.109 1.00 3.30 H new ATOM 0 HB2 ARG A 110 20.502 -21.749 10.070 1.00 11.30 H new ATOM 0 HB3 ARG A 110 22.069 -21.494 9.328 1.00 11.30 H new ATOM 0 HG2 ARG A 110 23.055 -23.238 10.458 1.00 3.15 H new ATOM 0 HG3 ARG A 110 22.066 -23.026 11.888 1.00 3.15 H new ATOM 0 HD2 ARG A 110 20.367 -24.360 11.095 1.00 45.44 H new ATOM 0 HD3 ARG A 110 20.602 -23.864 9.430 1.00 45.44 H new ATOM 0 HE ARG A 110 21.833 -26.144 10.772 1.00 44.01 H new ATOM 0 HH11 ARG A 110 22.157 -23.791 8.161 1.00 52.31 H new ATOM 0 HH12 ARG A 110 23.200 -24.836 7.192 1.00 52.31 H new ATOM 0 HH21 ARG A 110 23.175 -27.481 9.523 1.00 42.14 H new ATOM 0 HH22 ARG A 110 23.774 -26.917 7.959 1.00 42.14 H new ATOM 1567 N ILE A 111 24.143 -19.806 11.046 1.00 53.33 N ATOM 1568 CA ILE A 111 25.557 -19.753 11.395 1.00 12.22 C ATOM 1569 C ILE A 111 25.745 -19.465 12.881 1.00 65.22 C ATOM 1570 O ILE A 111 26.696 -19.943 13.502 1.00 52.31 O ATOM 1571 CB ILE A 111 26.299 -18.679 10.578 1.00 70.13 C ATOM 1572 CG1 ILE A 111 26.003 -18.847 9.086 1.00 31.51 C ATOM 1573 CG2 ILE A 111 27.796 -18.756 10.838 1.00 11.32 C ATOM 1574 CD1 ILE A 111 26.237 -20.253 8.579 1.00 61.15 C ATOM 0 H ILE A 111 23.879 -19.206 10.265 1.00 53.33 H new ATOM 0 HA ILE A 111 25.977 -20.731 11.160 1.00 12.22 H new ATOM 0 HB ILE A 111 25.945 -17.697 10.891 1.00 70.13 H new ATOM 0 HG12 ILE A 111 24.967 -18.568 8.896 1.00 31.51 H new ATOM 0 HG13 ILE A 111 26.628 -18.156 8.520 1.00 31.51 H new ATOM 0 HG21 ILE A 111 28.307 -17.991 10.253 1.00 11.32 H new ATOM 0 HG22 ILE A 111 27.990 -18.593 11.898 1.00 11.32 H new ATOM 0 HG23 ILE A 111 28.165 -19.740 10.549 1.00 11.32 H new ATOM 0 HD11 ILE A 111 26.007 -20.299 7.514 1.00 61.15 H new ATOM 0 HD12 ILE A 111 27.280 -20.528 8.738 1.00 61.15 H new ATOM 0 HD13 ILE A 111 25.593 -20.947 9.119 1.00 61.15 H new ATOM 1586 N THR A 112 24.832 -18.682 13.447 1.00 24.22 N ATOM 1587 CA THR A 112 24.897 -18.331 14.860 1.00 20.22 C ATOM 1588 C THR A 112 24.106 -19.320 15.709 1.00 12.41 C ATOM 1589 O THR A 112 24.257 -19.364 16.930 1.00 51.24 O ATOM 1590 CB THR A 112 24.358 -16.910 15.111 1.00 22.12 C ATOM 1591 OG1 THR A 112 22.935 -16.891 14.956 1.00 72.32 O ATOM 1592 CG2 THR A 112 24.991 -15.914 14.152 1.00 44.04 C ATOM 0 H THR A 112 24.039 -18.279 12.948 1.00 24.22 H new ATOM 0 HA THR A 112 25.948 -18.369 15.147 1.00 20.22 H new ATOM 0 HB THR A 112 24.616 -16.623 16.130 1.00 22.12 H new ATOM 0 HG1 THR A 112 22.692 -17.328 14.113 1.00 72.32 H new ATOM 0 HG21 THR A 112 24.595 -14.918 14.348 1.00 44.04 H new ATOM 0 HG22 THR A 112 26.072 -15.909 14.293 1.00 44.04 H new ATOM 0 HG23 THR A 112 24.761 -16.200 13.126 1.00 44.04 H new ATOM 1600 N MET A 113 23.263 -20.112 15.055 1.00 15.31 N ATOM 1601 CA MET A 113 22.449 -21.102 15.751 1.00 13.42 C ATOM 1602 C MET A 113 23.303 -22.275 16.219 1.00 30.45 C ATOM 1603 O MET A 113 23.048 -22.858 17.273 1.00 71.33 O ATOM 1604 CB MET A 113 21.327 -21.604 14.839 1.00 4.55 C ATOM 1605 CG MET A 113 20.033 -20.818 14.979 1.00 64.21 C ATOM 1606 SD MET A 113 18.756 -21.376 13.835 1.00 12.23 S ATOM 1607 CE MET A 113 18.736 -20.022 12.663 1.00 44.11 C ATOM 0 H MET A 113 23.126 -20.088 14.045 1.00 15.31 H new ATOM 0 HA MET A 113 22.009 -20.624 16.626 1.00 13.42 H new ATOM 0 HB2 MET A 113 21.662 -21.555 13.803 1.00 4.55 H new ATOM 0 HB3 MET A 113 21.131 -22.653 15.061 1.00 4.55 H new ATOM 0 HG2 MET A 113 19.665 -20.910 16.001 1.00 64.21 H new ATOM 0 HG3 MET A 113 20.234 -19.761 14.806 1.00 64.21 H new ATOM 0 HE1 MET A 113 17.720 -19.639 12.567 1.00 44.11 H new ATOM 0 HE2 MET A 113 19.392 -19.226 13.015 1.00 44.11 H new ATOM 0 HE3 MET A 113 19.083 -20.376 11.692 1.00 44.11 H new ATOM 1617 N GLU A 114 24.317 -22.616 15.430 1.00 74.33 N ATOM 1618 CA GLU A 114 25.207 -23.722 15.765 1.00 52.44 C ATOM 1619 C GLU A 114 25.818 -23.528 17.149 1.00 13.25 C ATOM 1620 O GLU A 114 25.650 -24.350 18.050 1.00 31.03 O ATOM 1621 CB GLU A 114 26.316 -23.847 14.719 1.00 44.14 C ATOM 1622 CG GLU A 114 27.624 -24.380 15.279 1.00 2.44 C ATOM 1623 CD GLU A 114 28.587 -24.821 14.195 1.00 45.14 C ATOM 1624 OE1 GLU A 114 29.111 -23.946 13.474 1.00 60.35 O ATOM 1625 OE2 GLU A 114 28.818 -26.042 14.067 1.00 13.14 O ATOM 0 H GLU A 114 24.543 -22.143 14.555 1.00 74.33 H new ATOM 0 HA GLU A 114 24.619 -24.640 15.772 1.00 52.44 H new ATOM 0 HB2 GLU A 114 25.977 -24.506 13.920 1.00 44.14 H new ATOM 0 HB3 GLU A 114 26.494 -22.869 14.272 1.00 44.14 H new ATOM 0 HG2 GLU A 114 28.096 -23.608 15.887 1.00 2.44 H new ATOM 0 HG3 GLU A 114 27.416 -25.222 15.939 1.00 2.44 H new ATOM 1632 N PRO A 115 26.545 -22.414 17.324 1.00 32.34 N ATOM 1633 CA PRO A 115 27.196 -22.086 18.596 1.00 52.50 C ATOM 1634 C PRO A 115 26.192 -21.718 19.683 1.00 32.44 C ATOM 1635 O PRO A 115 26.253 -22.235 20.799 1.00 21.14 O ATOM 1636 CB PRO A 115 28.070 -20.879 18.245 1.00 13.45 C ATOM 1637 CG PRO A 115 27.402 -20.257 17.068 1.00 40.22 C ATOM 1638 CD PRO A 115 26.787 -21.390 16.294 1.00 33.14 C ATOM 0 HA PRO A 115 27.754 -22.931 18.999 1.00 52.50 H new ATOM 0 HB2 PRO A 115 28.133 -20.180 19.079 1.00 13.45 H new ATOM 0 HB3 PRO A 115 29.089 -21.184 18.006 1.00 13.45 H new ATOM 0 HG2 PRO A 115 26.642 -19.542 17.383 1.00 40.22 H new ATOM 0 HG3 PRO A 115 28.119 -19.710 16.456 1.00 40.22 H new ATOM 0 HD2 PRO A 115 25.862 -21.086 15.804 1.00 33.14 H new ATOM 0 HD3 PRO A 115 27.456 -21.754 15.514 1.00 33.14 H new ATOM 1646 N CYS A 116 25.267 -20.823 19.351 1.00 65.50 N ATOM 1647 CA CYS A 116 24.250 -20.387 20.299 1.00 55.32 C ATOM 1648 C CYS A 116 22.855 -20.776 19.817 1.00 51.31 C ATOM 1649 O CYS A 116 22.126 -19.952 19.262 1.00 24.55 O ATOM 1650 CB CYS A 116 24.327 -18.872 20.501 1.00 62.12 C ATOM 1651 SG CYS A 116 26.007 -18.252 20.837 1.00 32.11 S ATOM 0 H CYS A 116 25.201 -20.386 18.432 1.00 65.50 H new ATOM 0 HA CYS A 116 24.439 -20.884 21.250 1.00 55.32 H new ATOM 0 HB2 CYS A 116 23.940 -18.377 19.610 1.00 62.12 H new ATOM 0 HB3 CYS A 116 23.676 -18.593 21.329 1.00 62.12 H new ATOM 1656 N ARG A 117 22.490 -22.035 20.033 1.00 63.43 N ATOM 1657 CA ARG A 117 21.184 -22.534 19.620 1.00 60.11 C ATOM 1658 C ARG A 117 20.112 -22.160 20.640 1.00 63.52 C ATOM 1659 O ARG A 117 18.920 -22.168 20.333 1.00 51.14 O ATOM 1660 CB ARG A 117 21.227 -24.053 19.443 1.00 41.03 C ATOM 1661 CG ARG A 117 19.852 -24.696 19.365 1.00 62.32 C ATOM 1662 CD ARG A 117 19.946 -26.170 19.002 1.00 24.11 C ATOM 1663 NE ARG A 117 18.799 -26.615 18.215 1.00 1.53 N ATOM 1664 CZ ARG A 117 18.662 -27.851 17.750 1.00 33.21 C ATOM 1665 NH1 ARG A 117 19.595 -28.761 17.992 1.00 71.41 N ATOM 1666 NH2 ARG A 117 17.589 -28.179 17.042 1.00 72.52 N ATOM 0 H ARG A 117 23.081 -22.729 20.492 1.00 63.43 H new ATOM 0 HA ARG A 117 20.931 -22.071 18.666 1.00 60.11 H new ATOM 0 HB2 ARG A 117 21.781 -24.289 18.535 1.00 41.03 H new ATOM 0 HB3 ARG A 117 21.777 -24.492 20.275 1.00 41.03 H new ATOM 0 HG2 ARG A 117 19.344 -24.588 20.323 1.00 62.32 H new ATOM 0 HG3 ARG A 117 19.247 -24.175 18.623 1.00 62.32 H new ATOM 0 HD2 ARG A 117 20.862 -26.347 18.439 1.00 24.11 H new ATOM 0 HD3 ARG A 117 20.012 -26.764 19.913 1.00 24.11 H new ATOM 0 HE ARG A 117 18.063 -25.939 18.011 1.00 1.53 H new ATOM 0 HH11 ARG A 117 20.421 -28.512 18.537 1.00 71.41 H new ATOM 0 HH12 ARG A 117 19.487 -29.710 17.634 1.00 71.41 H new ATOM 0 HH21 ARG A 117 16.869 -27.481 16.855 1.00 72.52 H new ATOM 0 HH22 ARG A 117 17.484 -29.129 16.685 1.00 72.52 H new ATOM 1680 N ILE A 118 20.545 -21.835 21.853 1.00 24.01 N ATOM 1681 CA ILE A 118 19.623 -21.458 22.917 1.00 23.22 C ATOM 1682 C ILE A 118 18.706 -20.324 22.474 1.00 40.34 C ATOM 1683 O ILE A 118 17.616 -20.142 23.019 1.00 63.45 O ATOM 1684 CB ILE A 118 20.377 -21.026 24.189 1.00 63.42 C ATOM 1685 CG1 ILE A 118 21.249 -22.173 24.705 1.00 2.11 C ATOM 1686 CG2 ILE A 118 19.395 -20.577 25.260 1.00 0.20 C ATOM 1687 CD1 ILE A 118 20.473 -23.437 24.999 1.00 33.31 C ATOM 0 H ILE A 118 21.528 -21.825 22.124 1.00 24.01 H new ATOM 0 HA ILE A 118 19.023 -22.340 23.142 1.00 23.22 H new ATOM 0 HB ILE A 118 21.024 -20.185 23.942 1.00 63.42 H new ATOM 0 HG12 ILE A 118 22.020 -22.393 23.966 1.00 2.11 H new ATOM 0 HG13 ILE A 118 21.760 -21.851 25.612 1.00 2.11 H new ATOM 0 HG21 ILE A 118 19.943 -20.275 26.152 1.00 0.20 H new ATOM 0 HG22 ILE A 118 18.813 -19.734 24.889 1.00 0.20 H new ATOM 0 HG23 ILE A 118 18.725 -21.400 25.507 1.00 0.20 H new ATOM 0 HD11 ILE A 118 21.155 -24.207 25.361 1.00 33.31 H new ATOM 0 HD12 ILE A 118 19.720 -23.233 25.760 1.00 33.31 H new ATOM 0 HD13 ILE A 118 19.984 -23.784 24.089 1.00 33.31 H new ATOM 1699 N LEU A 119 19.153 -19.563 21.480 1.00 31.14 N ATOM 1700 CA LEU A 119 18.372 -18.446 20.961 1.00 75.11 C ATOM 1701 C LEU A 119 17.627 -18.846 19.691 1.00 22.21 C ATOM 1702 O LEU A 119 17.393 -18.019 18.810 1.00 52.21 O ATOM 1703 CB LEU A 119 19.282 -17.250 20.677 1.00 54.12 C ATOM 1704 CG LEU A 119 19.702 -16.422 21.892 1.00 33.52 C ATOM 1705 CD1 LEU A 119 21.197 -16.555 22.137 1.00 12.21 C ATOM 1706 CD2 LEU A 119 19.318 -14.962 21.702 1.00 73.32 C ATOM 0 H LEU A 119 20.052 -19.700 21.018 1.00 31.14 H new ATOM 0 HA LEU A 119 17.639 -18.165 21.717 1.00 75.11 H new ATOM 0 HB2 LEU A 119 20.182 -17.614 20.182 1.00 54.12 H new ATOM 0 HB3 LEU A 119 18.774 -16.592 19.972 1.00 54.12 H new ATOM 0 HG LEU A 119 19.176 -16.803 22.767 1.00 33.52 H new ATOM 0 HD11 LEU A 119 21.478 -15.959 23.005 1.00 12.21 H new ATOM 0 HD12 LEU A 119 21.444 -17.601 22.319 1.00 12.21 H new ATOM 0 HD13 LEU A 119 21.742 -16.201 21.262 1.00 12.21 H new ATOM 0 HD21 LEU A 119 19.625 -14.388 22.577 1.00 73.32 H new ATOM 0 HD22 LEU A 119 19.816 -14.567 20.816 1.00 73.32 H new ATOM 0 HD23 LEU A 119 18.238 -14.883 21.577 1.00 73.32 H new ATOM 1718 N TYR A 120 17.257 -20.119 19.605 1.00 15.21 N ATOM 1719 CA TYR A 120 16.539 -20.629 18.443 1.00 14.11 C ATOM 1720 C TYR A 120 15.161 -19.983 18.327 1.00 44.23 C ATOM 1721 O TYR A 120 14.502 -20.083 17.293 1.00 32.52 O ATOM 1722 CB TYR A 120 16.395 -22.149 18.533 1.00 30.10 C ATOM 1723 CG TYR A 120 15.439 -22.604 19.613 1.00 63.23 C ATOM 1724 CD1 TYR A 120 15.832 -22.644 20.945 1.00 43.33 C ATOM 1725 CD2 TYR A 120 14.143 -22.994 19.301 1.00 55.04 C ATOM 1726 CE1 TYR A 120 14.963 -23.060 21.934 1.00 14.50 C ATOM 1727 CE2 TYR A 120 13.265 -23.410 20.284 1.00 45.14 C ATOM 1728 CZ TYR A 120 13.680 -23.441 21.599 1.00 63.43 C ATOM 1729 OH TYR A 120 12.811 -23.855 22.582 1.00 55.15 O ATOM 0 H TYR A 120 17.442 -20.816 20.326 1.00 15.21 H new ATOM 0 HA TYR A 120 17.115 -20.377 17.553 1.00 14.11 H new ATOM 0 HB2 TYR A 120 16.052 -22.531 17.571 1.00 30.10 H new ATOM 0 HB3 TYR A 120 17.375 -22.588 18.719 1.00 30.10 H new ATOM 0 HD1 TYR A 120 16.835 -22.344 21.211 1.00 43.33 H new ATOM 0 HD2 TYR A 120 13.816 -22.972 18.272 1.00 55.04 H new ATOM 0 HE1 TYR A 120 15.286 -23.087 22.964 1.00 14.50 H new ATOM 0 HE2 TYR A 120 12.260 -23.709 20.024 1.00 45.14 H new ATOM 0 HH TYR A 120 11.948 -24.087 22.179 1.00 55.15 H new ATOM 1739 N ASN A 121 14.735 -19.318 19.396 1.00 73.14 N ATOM 1740 CA ASN A 121 13.436 -18.654 19.415 1.00 61.52 C ATOM 1741 C ASN A 121 13.325 -17.710 20.608 1.00 24.31 C ATOM 1742 O ASN A 121 12.722 -16.641 20.514 1.00 3.45 O ATOM 1743 CB ASN A 121 12.311 -19.691 19.464 1.00 43.52 C ATOM 1744 CG ASN A 121 11.811 -19.935 20.875 1.00 41.45 C ATOM 1745 OD1 ASN A 121 10.716 -19.506 21.240 1.00 45.32 O ATOM 1746 ND2 ASN A 121 12.613 -20.626 21.675 1.00 25.41 N ATOM 0 H ASN A 121 15.270 -19.224 20.260 1.00 73.14 H new ATOM 0 HA ASN A 121 13.342 -18.068 18.501 1.00 61.52 H new ATOM 0 HB2 ASN A 121 11.482 -19.354 18.841 1.00 43.52 H new ATOM 0 HB3 ASN A 121 12.667 -20.630 19.040 1.00 43.52 H new ATOM 0 HD21 ASN A 121 12.331 -20.821 22.635 1.00 25.41 H new ATOM 0 HD22 ASN A 121 13.512 -20.962 21.329 1.00 25.41 H new ATOM 1753 N THR A 122 13.912 -18.113 21.731 1.00 44.00 N ATOM 1754 CA THR A 122 13.880 -17.304 22.943 1.00 72.30 C ATOM 1755 C THR A 122 14.541 -15.949 22.718 1.00 60.31 C ATOM 1756 O THR A 122 15.644 -15.867 22.176 1.00 10.22 O ATOM 1757 CB THR A 122 14.583 -18.018 24.113 1.00 15.44 C ATOM 1758 OG1 THR A 122 14.011 -19.315 24.311 1.00 74.55 O ATOM 1759 CG2 THR A 122 14.462 -17.205 25.394 1.00 55.24 C ATOM 0 H THR A 122 14.415 -18.995 21.826 1.00 44.00 H new ATOM 0 HA THR A 122 12.830 -17.155 23.196 1.00 72.30 H new ATOM 0 HB THR A 122 15.639 -18.121 23.864 1.00 15.44 H new ATOM 0 HG1 THR A 122 14.465 -19.763 25.055 1.00 74.55 H new ATOM 0 HG21 THR A 122 14.966 -17.729 26.206 1.00 55.24 H new ATOM 0 HG22 THR A 122 14.924 -16.228 25.250 1.00 55.24 H new ATOM 0 HG23 THR A 122 13.409 -17.075 25.644 1.00 55.24 H new ATOM 1767 N THR A 123 13.861 -14.887 23.138 1.00 51.14 N ATOM 1768 CA THR A 123 14.382 -13.535 22.981 1.00 3.04 C ATOM 1769 C THR A 123 15.345 -13.183 24.109 1.00 25.44 C ATOM 1770 O THR A 123 15.163 -12.185 24.806 1.00 2.12 O ATOM 1771 CB THR A 123 13.246 -12.495 22.949 1.00 64.14 C ATOM 1772 OG1 THR A 123 12.254 -12.823 23.927 1.00 12.23 O ATOM 1773 CG2 THR A 123 12.606 -12.436 21.570 1.00 44.01 C ATOM 0 H THR A 123 12.948 -14.937 23.590 1.00 51.14 H new ATOM 0 HA THR A 123 14.915 -13.510 22.030 1.00 3.04 H new ATOM 0 HB THR A 123 13.671 -11.518 23.177 1.00 64.14 H new ATOM 0 HG1 THR A 123 11.536 -12.156 23.901 1.00 12.23 H new ATOM 0 HG21 THR A 123 11.807 -11.695 21.571 1.00 44.01 H new ATOM 0 HG22 THR A 123 13.358 -12.157 20.832 1.00 44.01 H new ATOM 0 HG23 THR A 123 12.194 -13.413 21.318 1.00 44.01 H new ATOM 1781 N PHE A 124 16.372 -14.009 24.284 1.00 73.41 N ATOM 1782 CA PHE A 124 17.364 -13.785 25.328 1.00 24.34 C ATOM 1783 C PHE A 124 18.160 -12.512 25.058 1.00 4.11 C ATOM 1784 O PHE A 124 18.751 -11.931 25.968 1.00 3.45 O ATOM 1785 CB PHE A 124 18.313 -14.982 25.425 1.00 32.13 C ATOM 1786 CG PHE A 124 19.438 -14.778 26.399 1.00 43.34 C ATOM 1787 CD1 PHE A 124 19.197 -14.245 27.655 1.00 44.23 C ATOM 1788 CD2 PHE A 124 20.737 -15.119 26.058 1.00 62.03 C ATOM 1789 CE1 PHE A 124 20.231 -14.055 28.552 1.00 45.03 C ATOM 1790 CE2 PHE A 124 21.775 -14.932 26.951 1.00 44.12 C ATOM 1791 CZ PHE A 124 21.522 -14.400 28.200 1.00 72.11 C ATOM 0 H PHE A 124 16.538 -14.840 23.716 1.00 73.41 H new ATOM 0 HA PHE A 124 16.838 -13.669 26.275 1.00 24.34 H new ATOM 0 HB2 PHE A 124 17.744 -15.864 25.719 1.00 32.13 H new ATOM 0 HB3 PHE A 124 18.730 -15.186 24.439 1.00 32.13 H new ATOM 0 HD1 PHE A 124 18.190 -13.975 27.936 1.00 44.23 H new ATOM 0 HD2 PHE A 124 20.941 -15.536 25.083 1.00 62.03 H new ATOM 0 HE1 PHE A 124 20.030 -13.637 29.527 1.00 45.03 H new ATOM 0 HE2 PHE A 124 22.783 -15.202 26.672 1.00 44.12 H new ATOM 0 HZ PHE A 124 22.331 -14.254 28.900 1.00 72.11 H new ATOM 1801 N PHE A 125 18.172 -12.084 23.800 1.00 74.21 N ATOM 1802 CA PHE A 125 18.896 -10.881 23.408 1.00 51.30 C ATOM 1803 C PHE A 125 18.626 -10.535 21.947 1.00 55.14 C ATOM 1804 O PHE A 125 19.514 -10.585 21.096 1.00 70.22 O ATOM 1805 CB PHE A 125 20.398 -11.069 23.630 1.00 61.03 C ATOM 1806 CG PHE A 125 21.082 -9.846 24.171 1.00 61.20 C ATOM 1807 CD1 PHE A 125 20.812 -8.594 23.642 1.00 25.21 C ATOM 1808 CD2 PHE A 125 21.994 -9.949 25.209 1.00 41.41 C ATOM 1809 CE1 PHE A 125 21.441 -7.468 24.138 1.00 41.32 C ATOM 1810 CE2 PHE A 125 22.626 -8.825 25.709 1.00 34.42 C ATOM 1811 CZ PHE A 125 22.348 -7.583 25.173 1.00 32.24 C ATOM 0 H PHE A 125 17.688 -12.553 23.034 1.00 74.21 H new ATOM 0 HA PHE A 125 18.544 -10.057 24.029 1.00 51.30 H new ATOM 0 HB2 PHE A 125 20.554 -11.898 24.320 1.00 61.03 H new ATOM 0 HB3 PHE A 125 20.865 -11.349 22.685 1.00 61.03 H new ATOM 0 HD1 PHE A 125 20.102 -8.497 22.834 1.00 25.21 H new ATOM 0 HD2 PHE A 125 22.214 -10.918 25.632 1.00 41.41 H new ATOM 0 HE1 PHE A 125 21.223 -6.498 23.716 1.00 41.32 H new ATOM 0 HE2 PHE A 125 23.336 -8.918 26.517 1.00 34.42 H new ATOM 0 HZ PHE A 125 22.839 -6.703 25.562 1.00 32.24 H new ATOM 1821 N PRO A 126 17.368 -10.176 21.647 1.00 4.50 N ATOM 1822 CA PRO A 126 16.951 -9.814 20.289 1.00 33.32 C ATOM 1823 C PRO A 126 17.543 -8.485 19.835 1.00 42.32 C ATOM 1824 O PRO A 126 17.438 -8.113 18.666 1.00 74.02 O ATOM 1825 CB PRO A 126 15.428 -9.710 20.402 1.00 33.15 C ATOM 1826 CG PRO A 126 15.175 -9.395 21.836 1.00 3.25 C ATOM 1827 CD PRO A 126 16.258 -10.094 22.611 1.00 43.40 C ATOM 0 HA PRO A 126 17.289 -10.542 19.551 1.00 33.32 H new ATOM 0 HB2 PRO A 126 15.035 -8.930 19.750 1.00 33.15 H new ATOM 0 HB3 PRO A 126 14.945 -10.642 20.110 1.00 33.15 H new ATOM 0 HG2 PRO A 126 15.203 -8.319 22.010 1.00 3.25 H new ATOM 0 HG3 PRO A 126 14.189 -9.742 22.144 1.00 3.25 H new ATOM 0 HD2 PRO A 126 16.540 -9.533 23.502 1.00 43.40 H new ATOM 0 HD3 PRO A 126 15.940 -11.082 22.943 1.00 43.40 H new ATOM 1835 N LYS A 127 18.167 -7.771 20.766 1.00 64.41 N ATOM 1836 CA LYS A 127 18.779 -6.483 20.462 1.00 61.34 C ATOM 1837 C LYS A 127 20.006 -6.660 19.572 1.00 14.12 C ATOM 1838 O LYS A 127 20.072 -6.110 18.473 1.00 41.32 O ATOM 1839 CB LYS A 127 19.172 -5.764 21.754 1.00 63.20 C ATOM 1840 CG LYS A 127 19.314 -4.260 21.594 1.00 31.44 C ATOM 1841 CD LYS A 127 20.735 -3.801 21.876 1.00 74.10 C ATOM 1842 CE LYS A 127 20.900 -2.311 21.619 1.00 31.00 C ATOM 1843 NZ LYS A 127 20.999 -1.537 22.887 1.00 32.14 N ATOM 0 H LYS A 127 18.262 -8.063 21.739 1.00 64.41 H new ATOM 0 HA LYS A 127 18.047 -5.879 19.926 1.00 61.34 H new ATOM 0 HB2 LYS A 127 18.422 -5.971 22.517 1.00 63.20 H new ATOM 0 HB3 LYS A 127 20.115 -6.173 22.115 1.00 63.20 H new ATOM 0 HG2 LYS A 127 19.032 -3.973 20.581 1.00 31.44 H new ATOM 0 HG3 LYS A 127 18.626 -3.754 22.272 1.00 31.44 H new ATOM 0 HD2 LYS A 127 20.992 -4.023 22.912 1.00 74.10 H new ATOM 0 HD3 LYS A 127 21.430 -4.359 21.249 1.00 74.10 H new ATOM 0 HE2 LYS A 127 21.795 -2.143 21.020 1.00 31.00 H new ATOM 0 HE3 LYS A 127 20.054 -1.947 21.037 1.00 31.00 H new ATOM 0 HZ1 LYS A 127 21.111 -0.526 22.669 1.00 32.14 H new ATOM 0 HZ2 LYS A 127 20.134 -1.677 23.448 1.00 32.14 H new ATOM 0 HZ3 LYS A 127 21.822 -1.866 23.431 1.00 32.14 H new ATOM 1857 N PHE A 128 20.974 -7.432 20.054 1.00 1.22 N ATOM 1858 CA PHE A 128 22.198 -7.681 19.302 1.00 24.33 C ATOM 1859 C PHE A 128 21.978 -8.762 18.247 1.00 2.53 C ATOM 1860 O PHE A 128 22.890 -9.105 17.494 1.00 23.22 O ATOM 1861 CB PHE A 128 23.327 -8.098 20.248 1.00 73.51 C ATOM 1862 CG PHE A 128 23.540 -9.584 20.308 1.00 33.13 C ATOM 1863 CD1 PHE A 128 22.730 -10.382 21.100 1.00 12.23 C ATOM 1864 CD2 PHE A 128 24.550 -10.183 19.573 1.00 4.33 C ATOM 1865 CE1 PHE A 128 22.923 -11.749 21.158 1.00 72.31 C ATOM 1866 CE2 PHE A 128 24.748 -11.550 19.627 1.00 52.44 C ATOM 1867 CZ PHE A 128 23.934 -12.334 20.421 1.00 50.33 C ATOM 0 H PHE A 128 20.935 -7.896 20.962 1.00 1.22 H new ATOM 0 HA PHE A 128 22.479 -6.757 18.797 1.00 24.33 H new ATOM 0 HB2 PHE A 128 24.253 -7.619 19.930 1.00 73.51 H new ATOM 0 HB3 PHE A 128 23.106 -7.730 21.250 1.00 73.51 H new ATOM 0 HD1 PHE A 128 21.938 -9.930 21.679 1.00 12.23 H new ATOM 0 HD2 PHE A 128 25.190 -9.575 18.951 1.00 4.33 H new ATOM 0 HE1 PHE A 128 22.284 -12.359 21.779 1.00 72.31 H new ATOM 0 HE2 PHE A 128 25.539 -12.005 19.049 1.00 52.44 H new ATOM 0 HZ PHE A 128 24.088 -13.402 20.465 1.00 50.33 H new ATOM 1877 N LEU A 129 20.762 -9.294 18.199 1.00 0.34 N ATOM 1878 CA LEU A 129 20.420 -10.336 17.237 1.00 3.24 C ATOM 1879 C LEU A 129 19.772 -9.737 15.993 1.00 22.12 C ATOM 1880 O LEU A 129 20.354 -9.755 14.909 1.00 43.25 O ATOM 1881 CB LEU A 129 19.478 -11.357 17.876 1.00 73.51 C ATOM 1882 CG LEU A 129 20.000 -12.792 17.960 1.00 61.12 C ATOM 1883 CD1 LEU A 129 19.998 -13.442 16.585 1.00 34.30 C ATOM 1884 CD2 LEU A 129 21.398 -12.816 18.561 1.00 70.33 C ATOM 0 H LEU A 129 19.996 -9.021 18.815 1.00 0.34 H new ATOM 0 HA LEU A 129 21.341 -10.837 16.938 1.00 3.24 H new ATOM 0 HB2 LEU A 129 19.239 -11.019 18.884 1.00 73.51 H new ATOM 0 HB3 LEU A 129 18.545 -11.363 17.312 1.00 73.51 H new ATOM 0 HG LEU A 129 19.336 -13.362 18.610 1.00 61.12 H new ATOM 0 HD11 LEU A 129 20.373 -14.463 16.664 1.00 34.30 H new ATOM 0 HD12 LEU A 129 18.982 -13.458 16.192 1.00 34.30 H new ATOM 0 HD13 LEU A 129 20.638 -12.872 15.912 1.00 34.30 H new ATOM 0 HD21 LEU A 129 21.754 -13.845 18.613 1.00 70.33 H new ATOM 0 HD22 LEU A 129 22.073 -12.230 17.937 1.00 70.33 H new ATOM 0 HD23 LEU A 129 21.370 -12.390 19.564 1.00 70.33 H new ATOM 1896 N ARG A 130 18.565 -9.206 16.158 1.00 3.14 N ATOM 1897 CA ARG A 130 17.839 -8.601 15.049 1.00 54.52 C ATOM 1898 C ARG A 130 17.615 -9.613 13.929 1.00 14.50 C ATOM 1899 O ARG A 130 17.382 -9.240 12.779 1.00 73.34 O ATOM 1900 CB ARG A 130 18.603 -7.389 14.511 1.00 60.51 C ATOM 1901 CG ARG A 130 17.927 -6.061 14.808 1.00 35.20 C ATOM 1902 CD ARG A 130 18.907 -5.054 15.389 1.00 70.30 C ATOM 1903 NE ARG A 130 18.257 -3.792 15.730 1.00 42.41 N ATOM 1904 CZ ARG A 130 17.582 -3.593 16.856 1.00 30.25 C ATOM 1905 NH1 ARG A 130 17.469 -4.570 17.746 1.00 10.32 N ATOM 1906 NH2 ARG A 130 17.018 -2.416 17.095 1.00 5.11 N ATOM 0 H ARG A 130 18.070 -9.183 17.049 1.00 3.14 H new ATOM 0 HA ARG A 130 16.867 -8.274 15.419 1.00 54.52 H new ATOM 0 HB2 ARG A 130 19.604 -7.381 14.941 1.00 60.51 H new ATOM 0 HB3 ARG A 130 18.720 -7.494 13.432 1.00 60.51 H new ATOM 0 HG2 ARG A 130 17.492 -5.660 13.892 1.00 35.20 H new ATOM 0 HG3 ARG A 130 17.107 -6.218 15.509 1.00 35.20 H new ATOM 0 HD2 ARG A 130 19.373 -5.474 16.280 1.00 70.30 H new ATOM 0 HD3 ARG A 130 19.705 -4.868 14.670 1.00 70.30 H new ATOM 0 HE ARG A 130 18.325 -3.020 15.066 1.00 42.41 H new ATOM 0 HH11 ARG A 130 17.901 -5.476 17.566 1.00 10.32 H new ATOM 0 HH12 ARG A 130 16.950 -4.415 18.610 1.00 10.32 H new ATOM 0 HH21 ARG A 130 17.103 -1.662 16.413 1.00 5.11 H new ATOM 0 HH22 ARG A 130 16.500 -2.265 17.961 1.00 5.11 H new ATOM 1920 N CYS A 131 17.687 -10.894 14.273 1.00 3.13 N ATOM 1921 CA CYS A 131 17.494 -11.960 13.298 1.00 33.44 C ATOM 1922 C CYS A 131 16.166 -12.675 13.530 1.00 34.14 C ATOM 1923 O CYS A 131 15.610 -12.633 14.627 1.00 12.10 O ATOM 1924 CB CYS A 131 18.646 -12.964 13.374 1.00 33.31 C ATOM 1925 SG CYS A 131 19.002 -13.808 11.799 1.00 13.22 S ATOM 0 H CYS A 131 17.878 -11.219 15.221 1.00 3.13 H new ATOM 0 HA CYS A 131 17.477 -11.511 12.305 1.00 33.44 H new ATOM 0 HB2 CYS A 131 19.545 -12.445 13.707 1.00 33.31 H new ATOM 0 HB3 CYS A 131 18.412 -13.713 14.130 1.00 33.31 H new ATOM 1930 N ASN A 132 15.663 -13.331 12.489 1.00 22.14 N ATOM 1931 CA ASN A 132 14.400 -14.055 12.579 1.00 24.12 C ATOM 1932 C ASN A 132 14.623 -15.477 13.085 1.00 63.10 C ATOM 1933 O ASN A 132 15.583 -16.141 12.695 1.00 23.04 O ATOM 1934 CB ASN A 132 13.710 -14.090 11.214 1.00 2.41 C ATOM 1935 CG ASN A 132 14.017 -12.861 10.380 1.00 15.31 C ATOM 1936 OD1 ASN A 132 14.893 -12.886 9.516 1.00 74.14 O ATOM 1937 ND2 ASN A 132 13.294 -11.776 10.637 1.00 71.52 N ATOM 0 H ASN A 132 16.111 -13.376 11.574 1.00 22.14 H new ATOM 0 HA ASN A 132 13.760 -13.532 13.289 1.00 24.12 H new ATOM 0 HB2 ASN A 132 14.026 -14.982 10.673 1.00 2.41 H new ATOM 0 HB3 ASN A 132 12.632 -14.169 11.356 1.00 2.41 H new ATOM 0 HD21 ASN A 132 13.455 -10.919 10.108 1.00 71.52 H new ATOM 0 HD22 ASN A 132 12.578 -11.801 11.363 1.00 71.52 H new ATOM 1944 N GLU A 133 13.729 -15.937 13.954 1.00 21.33 N ATOM 1945 CA GLU A 133 13.829 -17.280 14.513 1.00 31.42 C ATOM 1946 C GLU A 133 12.565 -18.085 14.225 1.00 71.15 C ATOM 1947 O GLU A 133 12.555 -18.958 13.356 1.00 71.11 O ATOM 1948 CB GLU A 133 14.070 -17.212 16.023 1.00 73.23 C ATOM 1949 CG GLU A 133 13.579 -15.923 16.660 1.00 41.24 C ATOM 1950 CD GLU A 133 14.614 -14.816 16.608 1.00 42.14 C ATOM 1951 OE1 GLU A 133 15.822 -15.134 16.589 1.00 73.11 O ATOM 1952 OE2 GLU A 133 14.217 -13.632 16.586 1.00 62.20 O ATOM 0 H GLU A 133 12.928 -15.400 14.286 1.00 21.33 H new ATOM 0 HA GLU A 133 14.674 -17.780 14.040 1.00 31.42 H new ATOM 0 HB2 GLU A 133 13.572 -18.056 16.500 1.00 73.23 H new ATOM 0 HB3 GLU A 133 15.137 -17.320 16.217 1.00 73.23 H new ATOM 0 HG2 GLU A 133 12.673 -15.593 16.151 1.00 41.24 H new ATOM 0 HG3 GLU A 133 13.309 -16.115 17.699 1.00 41.24 H new ATOM 1959 N THR A 134 11.499 -17.786 14.960 1.00 13.51 N ATOM 1960 CA THR A 134 10.230 -18.481 14.786 1.00 52.14 C ATOM 1961 C THR A 134 9.626 -18.188 13.417 1.00 63.33 C ATOM 1962 O THR A 134 8.698 -18.869 12.978 1.00 40.32 O ATOM 1963 CB THR A 134 9.217 -18.084 15.876 1.00 0.21 C ATOM 1964 OG1 THR A 134 9.177 -16.659 16.012 1.00 2.13 O ATOM 1965 CG2 THR A 134 9.583 -18.716 17.211 1.00 40.24 C ATOM 0 H THR A 134 11.489 -17.066 15.683 1.00 13.51 H new ATOM 0 HA THR A 134 10.441 -19.547 14.867 1.00 52.14 H new ATOM 0 HB THR A 134 8.234 -18.448 15.577 1.00 0.21 H new ATOM 0 HG1 THR A 134 8.529 -16.415 16.706 1.00 2.13 H new ATOM 0 HG21 THR A 134 8.853 -18.421 17.965 1.00 40.24 H new ATOM 0 HG22 THR A 134 9.584 -19.801 17.112 1.00 40.24 H new ATOM 0 HG23 THR A 134 10.574 -18.379 17.514 1.00 40.24 H new ATOM 1973 N LEU A 135 10.159 -17.173 12.745 1.00 33.24 N ATOM 1974 CA LEU A 135 9.673 -16.791 11.424 1.00 14.32 C ATOM 1975 C LEU A 135 9.792 -17.952 10.443 1.00 72.31 C ATOM 1976 O LEU A 135 10.160 -19.064 10.822 1.00 21.25 O ATOM 1977 CB LEU A 135 10.454 -15.584 10.901 1.00 31.12 C ATOM 1978 CG LEU A 135 10.067 -14.227 11.491 1.00 62.33 C ATOM 1979 CD1 LEU A 135 8.602 -13.925 11.218 1.00 32.13 C ATOM 1980 CD2 LEU A 135 10.352 -14.195 12.985 1.00 15.53 C ATOM 0 H LEU A 135 10.928 -16.600 13.093 1.00 33.24 H new ATOM 0 HA LEU A 135 8.620 -16.523 11.515 1.00 14.32 H new ATOM 0 HB2 LEU A 135 11.514 -15.752 11.092 1.00 31.12 H new ATOM 0 HB3 LEU A 135 10.329 -15.536 9.819 1.00 31.12 H new ATOM 0 HG LEU A 135 10.670 -13.457 11.010 1.00 62.33 H new ATOM 0 HD11 LEU A 135 8.345 -12.956 11.645 1.00 32.13 H new ATOM 0 HD12 LEU A 135 8.429 -13.905 10.142 1.00 32.13 H new ATOM 0 HD13 LEU A 135 7.981 -14.698 11.671 1.00 32.13 H new ATOM 0 HD21 LEU A 135 10.071 -13.222 13.388 1.00 15.53 H new ATOM 0 HD22 LEU A 135 9.775 -14.975 13.482 1.00 15.53 H new ATOM 0 HD23 LEU A 135 11.415 -14.365 13.156 1.00 15.53 H new ATOM 1992 N PHE A 136 9.480 -17.687 9.179 1.00 51.43 N ATOM 1993 CA PHE A 136 9.553 -18.709 8.142 1.00 62.41 C ATOM 1994 C PHE A 136 10.635 -18.371 7.120 1.00 32.50 C ATOM 1995 O PHE A 136 10.354 -18.011 5.977 1.00 74.21 O ATOM 1996 CB PHE A 136 8.201 -18.853 7.441 1.00 33.21 C ATOM 1997 CG PHE A 136 7.139 -19.469 8.307 1.00 2.02 C ATOM 1998 CD1 PHE A 136 6.719 -18.836 9.466 1.00 30.41 C ATOM 1999 CD2 PHE A 136 6.561 -20.680 7.962 1.00 23.02 C ATOM 2000 CE1 PHE A 136 5.743 -19.401 10.265 1.00 20.31 C ATOM 2001 CE2 PHE A 136 5.585 -21.250 8.757 1.00 15.32 C ATOM 2002 CZ PHE A 136 5.174 -20.609 9.910 1.00 42.24 C ATOM 0 H PHE A 136 9.174 -16.772 8.848 1.00 51.43 H new ATOM 0 HA PHE A 136 9.810 -19.655 8.618 1.00 62.41 H new ATOM 0 HB2 PHE A 136 7.865 -17.870 7.112 1.00 33.21 H new ATOM 0 HB3 PHE A 136 8.328 -19.463 6.546 1.00 33.21 H new ATOM 0 HD1 PHE A 136 7.159 -17.891 9.748 1.00 30.41 H new ATOM 0 HD2 PHE A 136 6.877 -21.185 7.061 1.00 23.02 H new ATOM 0 HE1 PHE A 136 5.425 -18.898 11.167 1.00 20.31 H new ATOM 0 HE2 PHE A 136 5.144 -22.195 8.477 1.00 15.32 H new ATOM 0 HZ PHE A 136 4.410 -21.051 10.532 1.00 42.24 H new ATOM 2012 N PRO A 137 11.903 -18.490 7.541 1.00 40.44 N ATOM 2013 CA PRO A 137 13.053 -18.201 6.678 1.00 20.45 C ATOM 2014 C PRO A 137 13.221 -19.236 5.571 1.00 72.01 C ATOM 2015 O PRO A 137 13.422 -18.888 4.407 1.00 73.23 O ATOM 2016 CB PRO A 137 14.241 -18.253 7.643 1.00 51.24 C ATOM 2017 CG PRO A 137 13.792 -19.142 8.750 1.00 34.11 C ATOM 2018 CD PRO A 137 12.312 -18.914 8.890 1.00 11.01 C ATOM 0 HA PRO A 137 12.946 -17.247 6.162 1.00 20.45 H new ATOM 0 HB2 PRO A 137 15.131 -18.649 7.154 1.00 51.24 H new ATOM 0 HB3 PRO A 137 14.495 -17.259 8.012 1.00 51.24 H new ATOM 0 HG2 PRO A 137 14.006 -20.186 8.523 1.00 34.11 H new ATOM 0 HG3 PRO A 137 14.313 -18.904 9.677 1.00 34.11 H new ATOM 0 HD2 PRO A 137 11.793 -19.821 9.201 1.00 11.01 H new ATOM 0 HD3 PRO A 137 12.092 -18.150 9.635 1.00 11.01 H new ATOM 2026 N THR A 138 13.137 -20.510 5.940 1.00 32.50 N ATOM 2027 CA THR A 138 13.280 -21.596 4.978 1.00 50.10 C ATOM 2028 C THR A 138 11.921 -22.159 4.578 1.00 20.13 C ATOM 2029 O THR A 138 10.886 -21.533 4.808 1.00 71.34 O ATOM 2030 CB THR A 138 14.150 -22.735 5.542 1.00 74.31 C ATOM 2031 OG1 THR A 138 14.750 -22.328 6.776 1.00 23.24 O ATOM 2032 CG2 THR A 138 15.234 -23.130 4.550 1.00 33.25 C ATOM 0 H THR A 138 12.971 -20.815 6.899 1.00 32.50 H new ATOM 0 HA THR A 138 13.769 -21.177 4.099 1.00 50.10 H new ATOM 0 HB THR A 138 13.509 -23.599 5.718 1.00 74.31 H new ATOM 0 HG1 THR A 138 15.677 -22.645 6.809 1.00 23.24 H new ATOM 0 HG21 THR A 138 15.836 -23.936 4.970 1.00 33.25 H new ATOM 0 HG22 THR A 138 14.772 -23.468 3.622 1.00 33.25 H new ATOM 0 HG23 THR A 138 15.872 -22.270 4.346 1.00 33.25 H new ATOM 2040 N LYS A 139 11.930 -23.345 3.980 1.00 63.33 N ATOM 2041 CA LYS A 139 10.698 -23.995 3.549 1.00 22.32 C ATOM 2042 C LYS A 139 10.994 -25.338 2.888 1.00 54.44 C ATOM 2043 O LYS A 139 10.264 -26.310 3.082 1.00 61.31 O ATOM 2044 CB LYS A 139 9.934 -23.093 2.578 1.00 71.14 C ATOM 2045 CG LYS A 139 8.607 -22.597 3.125 1.00 54.15 C ATOM 2046 CD LYS A 139 7.587 -22.395 2.016 1.00 44.51 C ATOM 2047 CE LYS A 139 8.037 -21.324 1.034 1.00 42.22 C ATOM 2048 NZ LYS A 139 7.084 -21.176 -0.101 1.00 12.35 N ATOM 0 H LYS A 139 12.778 -23.876 3.782 1.00 63.33 H new ATOM 0 HA LYS A 139 10.082 -24.172 4.431 1.00 22.32 H new ATOM 0 HB2 LYS A 139 10.557 -22.235 2.326 1.00 71.14 H new ATOM 0 HB3 LYS A 139 9.754 -23.640 1.652 1.00 71.14 H new ATOM 0 HG2 LYS A 139 8.221 -23.313 3.850 1.00 54.15 H new ATOM 0 HG3 LYS A 139 8.760 -21.657 3.656 1.00 54.15 H new ATOM 0 HD2 LYS A 139 7.433 -23.335 1.486 1.00 44.51 H new ATOM 0 HD3 LYS A 139 6.628 -22.113 2.449 1.00 44.51 H new ATOM 0 HE2 LYS A 139 8.132 -20.371 1.555 1.00 42.22 H new ATOM 0 HE3 LYS A 139 9.025 -21.577 0.648 1.00 42.22 H new ATOM 0 HZ1 LYS A 139 7.426 -20.437 -0.748 1.00 12.35 H new ATOM 0 HZ2 LYS A 139 7.012 -22.078 -0.614 1.00 12.35 H new ATOM 0 HZ3 LYS A 139 6.147 -20.910 0.265 1.00 12.35 H new TER 2062 LYS A 139