USER MOD reduce.3.24.130724 H: found=0, std=0, add=1236, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1236 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 56 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.3: A 123 LYS NZ :NH3+ 169:sc= 0.0821 (180deg=-0.0399) USER MOD Set 2.1: A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 160 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 15 SER OG : rot 107:sc= 1.11 USER MOD Set 3.2: A 17 SER OG : rot 180:sc= 0 USER MOD Set 3.3: A 23 SER OG : rot 170:sc= 0 USER MOD Single : A 0 GLY N :NH3+ 174:sc= 0 (180deg=-0.0447) USER MOD Single : A 1 SER OG : rot 48:sc= 0.665 USER MOD Single : A 2 SER OG : rot 150:sc= -0.624 USER MOD Single : A 4 THR OG1 : rot 50:sc= 0.397 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot -27:sc= -0.896 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -1.07! K(o=-1.1!,f=0.76) USER MOD Single : A 22 GLN : amide:sc= -1.81! K(o=-1.8!,f=-0.9) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 TYR OH : rot 6:sc= 1 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 177:sc= -1.81 (180deg=-1.83) USER MOD Single : A 48 LYS NZ :NH3+ -127:sc= 0.37 (180deg=-2.37!) USER MOD Single : A 52 SER OG : rot -106:sc= 0.206 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -1.13 K(o=-1.1,f=-0.00023) USER MOD Single : A 58 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -1.04 K(o=-1,f=-0.0018) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 160:sc= -0.0338 (180deg=-0.24) USER MOD Single : A 73 MET CE :methyl -146:sc= -0.137 (180deg=-1.95) USER MOD Single : A 75 THR OG1 : rot 180:sc= -1.1 USER MOD Single : A 77 SER OG : rot -78:sc= 0.356 USER MOD Single : A 79 THR OG1 : rot 100:sc= -2! USER MOD Single : A 80 LYS NZ :NH3+ 165:sc= -0.041 (180deg=-0.277) USER MOD Single : A 85 HIS : no HD1:sc= -1.39 K(o=-1.4,f=-3!) USER MOD Single : A 87 ASN : amide:sc= -1.59 K(o=-1.6,f=-5.4!) USER MOD Single : A 88 ASN : amide:sc= -0.136 X(o=-0.14,f=-0.18) USER MOD Single : A 89 LYS NZ :NH3+ 165:sc= -0.06 (180deg=-0.319) USER MOD Single : A 91 HIS : no HD1:sc= -0.0365 X(o=-0.036,f=-0.012) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 HIS : no HD1:sc= -0.0448 X(o=-0.045,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 CYS SG : rot -2:sc= 0.0843 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -2.6 K(o=-2.6,f=-4.8!) USER MOD Single : A 111 HIS : no HD1:sc= -0.608 K(o=-0.61,f=-1.9) USER MOD Single : A 112 ASN : amide:sc= -0.091 X(o=-0.091,f=0) USER MOD Single : A 113 MET CE :methyl -160:sc= -0.116 (180deg=-0.646) USER MOD Single : A 114 HIS : no HD1:sc= -0.269 K(o=-0.27,f=-2.6!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -0.438 K(o=-0.44,f=-5.7!) USER MOD Single : A 117 CYS SG : rot 180:sc= -0.523 USER MOD Single : A 119 SER OG : rot -139:sc= 0.642 USER MOD Single : A 122 CYS SG : rot -160:sc= -0.587 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 ASN : amide:sc= -0.589 K(o=-0.59,f=-2.4) USER MOD Single : A 136 HIS : no HE2:sc= -0.089 X(o=-0.089,f=-0.3) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot -36:sc= 0.786 USER MOD Single : A 147 ASN : amide:sc= -1.72! K(o=-1.7!,f=-0.76) USER MOD Single : A 149 CYS SG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 94:sc= 0.419 USER MOD Single : A 152 ASN : amide:sc= -1.91! K(o=-1.9!,f=1) USER MOD Single : A 156 LYS NZ :NH3+ 165:sc= -0.0163 (180deg=-0.241) USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 14.733 14.425 -6.793 1.00 7.74 N ATOM 2 CA GLY A 0 14.731 12.944 -6.951 1.00 7.29 C ATOM 3 C GLY A 0 15.470 12.242 -5.828 1.00 6.59 C ATOM 4 O GLY A 0 16.181 11.265 -6.060 1.00 6.87 O ATOM 0 H1 GLY A 0 14.306 14.864 -7.633 1.00 7.74 H new ATOM 0 H2 GLY A 0 14.183 14.685 -5.949 1.00 7.74 H new ATOM 0 H3 GLY A 0 15.711 14.761 -6.686 1.00 7.74 H new ATOM 0 HA2 GLY A 0 13.702 12.586 -6.984 1.00 7.29 H new ATOM 0 HA3 GLY A 0 15.191 12.682 -7.904 1.00 7.29 H new ATOM 10 N SER A 1 15.300 12.743 -4.609 1.00 5.98 N ATOM 11 CA SER A 1 15.955 12.158 -3.445 1.00 5.55 C ATOM 12 C SER A 1 15.185 12.478 -2.167 1.00 4.98 C ATOM 13 O SER A 1 15.526 13.416 -1.443 1.00 4.98 O ATOM 14 CB SER A 1 17.394 12.668 -3.332 1.00 5.73 C ATOM 15 OG SER A 1 17.427 14.083 -3.237 1.00 6.24 O ATOM 0 H SER A 1 14.715 13.552 -4.402 1.00 5.98 H new ATOM 0 HA SER A 1 15.971 11.076 -3.575 1.00 5.55 H new ATOM 0 HB2 SER A 1 17.871 12.230 -2.455 1.00 5.73 H new ATOM 0 HB3 SER A 1 17.967 12.345 -4.201 1.00 5.73 H new ATOM 0 HG SER A 1 16.782 14.381 -2.561 1.00 6.24 H new ATOM 21 N SER A 2 14.143 11.697 -1.893 1.00 4.86 N ATOM 22 CA SER A 2 13.329 11.899 -0.699 1.00 4.65 C ATOM 23 C SER A 2 13.975 11.235 0.513 1.00 3.55 C ATOM 24 O SER A 2 13.859 11.722 1.637 1.00 3.84 O ATOM 25 CB SER A 2 11.920 11.342 -0.913 1.00 5.55 C ATOM 26 OG SER A 2 11.958 9.965 -1.241 1.00 5.99 O ATOM 0 H SER A 2 13.843 10.920 -2.481 1.00 4.86 H new ATOM 0 HA SER A 2 13.260 12.971 -0.512 1.00 4.65 H new ATOM 0 HB2 SER A 2 11.328 11.487 -0.010 1.00 5.55 H new ATOM 0 HB3 SER A 2 11.425 11.895 -1.711 1.00 5.55 H new ATOM 0 HG SER A 2 11.140 9.530 -0.922 1.00 5.99 H new ATOM 32 N ILE A 3 14.653 10.117 0.273 1.00 2.69 N ATOM 33 CA ILE A 3 15.325 9.384 1.340 1.00 1.87 C ATOM 34 C ILE A 3 16.809 9.220 1.035 1.00 1.35 C ATOM 35 O ILE A 3 17.657 9.839 1.678 1.00 1.91 O ATOM 36 CB ILE A 3 14.692 8.000 1.558 1.00 2.23 C ATOM 37 CG1 ILE A 3 13.217 8.157 1.939 1.00 2.35 C ATOM 38 CG2 ILE A 3 15.451 7.229 2.633 1.00 2.72 C ATOM 39 CD1 ILE A 3 12.515 6.844 2.197 1.00 2.23 C ATOM 0 H ILE A 3 14.752 9.699 -0.652 1.00 2.69 H new ATOM 0 HA ILE A 3 15.208 9.968 2.253 1.00 1.87 H new ATOM 0 HB ILE A 3 14.753 7.432 0.630 1.00 2.23 H new ATOM 0 HG12 ILE A 3 13.145 8.779 2.831 1.00 2.35 H new ATOM 0 HG13 ILE A 3 12.698 8.686 1.139 1.00 2.35 H new ATOM 0 HG21 ILE A 3 14.989 6.252 2.774 1.00 2.72 H new ATOM 0 HG22 ILE A 3 16.488 7.099 2.324 1.00 2.72 H new ATOM 0 HG23 ILE A 3 15.419 7.784 3.570 1.00 2.72 H new ATOM 0 HD11 ILE A 3 11.475 7.033 2.461 1.00 2.23 H new ATOM 0 HD12 ILE A 3 12.555 6.228 1.299 1.00 2.23 H new ATOM 0 HD13 ILE A 3 13.009 6.323 3.017 1.00 2.23 H new ATOM 51 N THR A 4 17.117 8.384 0.047 1.00 1.51 N ATOM 52 CA THR A 4 18.501 8.139 -0.346 1.00 1.85 C ATOM 53 C THR A 4 18.620 7.925 -1.853 1.00 1.58 C ATOM 54 O THR A 4 18.701 6.792 -2.324 1.00 1.84 O ATOM 55 CB THR A 4 19.086 6.914 0.381 1.00 3.01 C ATOM 56 OG1 THR A 4 18.227 5.782 0.205 1.00 3.60 O ATOM 57 CG2 THR A 4 19.262 7.198 1.865 1.00 3.68 C ATOM 0 H THR A 4 16.427 7.865 -0.496 1.00 1.51 H new ATOM 0 HA THR A 4 19.068 9.026 -0.062 1.00 1.85 H new ATOM 0 HB THR A 4 20.064 6.697 -0.050 1.00 3.01 H new ATOM 0 HG1 THR A 4 18.020 5.673 -0.747 1.00 3.60 H new ATOM 0 HG21 THR A 4 19.676 6.318 2.357 1.00 3.68 H new ATOM 0 HG22 THR A 4 19.941 8.041 1.996 1.00 3.68 H new ATOM 0 HG23 THR A 4 18.295 7.439 2.307 1.00 3.68 H new ATOM 65 N GLY A 5 18.632 9.026 -2.600 1.00 1.36 N ATOM 66 CA GLY A 5 18.749 8.950 -4.047 1.00 1.29 C ATOM 67 C GLY A 5 17.746 8.000 -4.676 1.00 1.13 C ATOM 68 O GLY A 5 18.107 7.180 -5.520 1.00 1.34 O ATOM 0 H GLY A 5 18.563 9.973 -2.228 1.00 1.36 H new ATOM 0 HA2 GLY A 5 18.612 9.945 -4.469 1.00 1.29 H new ATOM 0 HA3 GLY A 5 19.758 8.629 -4.308 1.00 1.29 H new ATOM 72 N ILE A 6 16.483 8.108 -4.269 1.00 0.84 N ATOM 73 CA ILE A 6 15.435 7.249 -4.809 1.00 0.72 C ATOM 74 C ILE A 6 14.492 8.031 -5.719 1.00 0.71 C ATOM 75 O ILE A 6 14.158 9.183 -5.439 1.00 0.85 O ATOM 76 CB ILE A 6 14.619 6.575 -3.687 1.00 0.64 C ATOM 77 CG1 ILE A 6 14.004 7.630 -2.761 1.00 0.78 C ATOM 78 CG2 ILE A 6 15.503 5.618 -2.899 1.00 0.90 C ATOM 79 CD1 ILE A 6 13.065 7.055 -1.723 1.00 0.88 C ATOM 0 H ILE A 6 16.163 8.779 -3.570 1.00 0.84 H new ATOM 0 HA ILE A 6 15.934 6.475 -5.393 1.00 0.72 H new ATOM 0 HB ILE A 6 13.807 6.005 -4.139 1.00 0.64 H new ATOM 0 HG12 ILE A 6 14.806 8.168 -2.255 1.00 0.78 H new ATOM 0 HG13 ILE A 6 13.462 8.359 -3.364 1.00 0.78 H new ATOM 0 HG21 ILE A 6 14.917 5.148 -2.109 1.00 0.90 H new ATOM 0 HG22 ILE A 6 15.894 4.850 -3.567 1.00 0.90 H new ATOM 0 HG23 ILE A 6 16.332 6.170 -2.456 1.00 0.90 H new ATOM 0 HD11 ILE A 6 12.669 7.861 -1.105 1.00 0.88 H new ATOM 0 HD12 ILE A 6 12.242 6.542 -2.221 1.00 0.88 H new ATOM 0 HD13 ILE A 6 13.606 6.348 -1.094 1.00 0.88 H new ATOM 91 N SER A 7 14.070 7.398 -6.810 1.00 0.67 N ATOM 92 CA SER A 7 13.170 8.034 -7.767 1.00 0.69 C ATOM 93 C SER A 7 12.136 7.037 -8.291 1.00 0.58 C ATOM 94 O SER A 7 12.389 5.834 -8.325 1.00 0.54 O ATOM 95 CB SER A 7 13.971 8.619 -8.933 1.00 0.81 C ATOM 96 OG SER A 7 14.903 9.586 -8.480 1.00 1.60 O ATOM 0 H SER A 7 14.337 6.444 -7.053 1.00 0.67 H new ATOM 0 HA SER A 7 12.642 8.838 -7.255 1.00 0.69 H new ATOM 0 HB2 SER A 7 14.497 7.819 -9.454 1.00 0.81 H new ATOM 0 HB3 SER A 7 13.291 9.075 -9.653 1.00 0.81 H new ATOM 0 HG SER A 7 15.402 9.942 -9.244 1.00 1.60 H new ATOM 102 N PRO A 8 10.953 7.528 -8.712 1.00 0.57 N ATOM 103 CA PRO A 8 9.883 6.671 -9.235 1.00 0.48 C ATOM 104 C PRO A 8 10.236 6.056 -10.585 1.00 0.47 C ATOM 105 O PRO A 8 10.835 6.710 -11.439 1.00 0.58 O ATOM 106 CB PRO A 8 8.696 7.626 -9.379 1.00 0.49 C ATOM 107 CG PRO A 8 9.313 8.972 -9.541 1.00 0.69 C ATOM 108 CD PRO A 8 10.565 8.954 -8.712 1.00 0.67 C ATOM 0 HA PRO A 8 9.688 5.823 -8.579 1.00 0.48 H new ATOM 0 HB2 PRO A 8 8.080 7.366 -10.240 1.00 0.49 H new ATOM 0 HB3 PRO A 8 8.049 7.589 -8.502 1.00 0.49 H new ATOM 0 HG2 PRO A 8 9.541 9.174 -10.588 1.00 0.69 H new ATOM 0 HG3 PRO A 8 8.634 9.756 -9.206 1.00 0.69 H new ATOM 0 HD2 PRO A 8 11.343 9.582 -9.145 1.00 0.67 H new ATOM 0 HD3 PRO A 8 10.384 9.322 -7.702 1.00 0.67 H new ATOM 116 N ILE A 9 9.857 4.795 -10.770 1.00 0.41 N ATOM 117 CA ILE A 9 10.131 4.086 -12.013 1.00 0.46 C ATOM 118 C ILE A 9 8.959 4.211 -12.981 1.00 0.45 C ATOM 119 O ILE A 9 9.150 4.398 -14.182 1.00 0.53 O ATOM 120 CB ILE A 9 10.413 2.591 -11.755 1.00 0.48 C ATOM 121 CG1 ILE A 9 11.377 2.423 -10.577 1.00 0.51 C ATOM 122 CG2 ILE A 9 10.972 1.930 -13.007 1.00 0.65 C ATOM 123 CD1 ILE A 9 12.699 3.143 -10.757 1.00 1.53 C ATOM 0 H ILE A 9 9.358 4.243 -10.072 1.00 0.41 H new ATOM 0 HA ILE A 9 11.016 4.544 -12.454 1.00 0.46 H new ATOM 0 HB ILE A 9 9.473 2.101 -11.500 1.00 0.48 H new ATOM 0 HG12 ILE A 9 10.895 2.790 -9.671 1.00 0.51 H new ATOM 0 HG13 ILE A 9 11.570 1.361 -10.427 1.00 0.51 H new ATOM 0 HG21 ILE A 9 11.165 0.876 -12.807 1.00 0.65 H new ATOM 0 HG22 ILE A 9 10.250 2.019 -13.819 1.00 0.65 H new ATOM 0 HG23 ILE A 9 11.902 2.421 -13.293 1.00 0.65 H new ATOM 0 HD11 ILE A 9 13.326 2.976 -9.881 1.00 1.53 H new ATOM 0 HD12 ILE A 9 13.204 2.760 -11.644 1.00 1.53 H new ATOM 0 HD13 ILE A 9 12.518 4.211 -10.875 1.00 1.53 H new ATOM 135 N THR A 10 7.747 4.104 -12.445 1.00 0.41 N ATOM 136 CA THR A 10 6.538 4.206 -13.254 1.00 0.42 C ATOM 137 C THR A 10 5.295 4.310 -12.379 1.00 0.31 C ATOM 138 O THR A 10 5.186 3.637 -11.353 1.00 0.28 O ATOM 139 CB THR A 10 6.384 2.998 -14.200 1.00 0.52 C ATOM 140 OG1 THR A 10 5.098 3.032 -14.832 1.00 0.54 O ATOM 141 CG2 THR A 10 6.548 1.690 -13.443 1.00 0.53 C ATOM 0 H THR A 10 7.576 3.946 -11.452 1.00 0.41 H new ATOM 0 HA THR A 10 6.638 5.113 -13.850 1.00 0.42 H new ATOM 0 HB THR A 10 7.164 3.058 -14.959 1.00 0.52 H new ATOM 0 HG1 THR A 10 5.008 2.263 -15.433 1.00 0.54 H new ATOM 0 HG21 THR A 10 6.435 0.854 -14.133 1.00 0.53 H new ATOM 0 HG22 THR A 10 7.538 1.654 -12.989 1.00 0.53 H new ATOM 0 HG23 THR A 10 5.789 1.623 -12.664 1.00 0.53 H new ATOM 149 N GLU A 11 4.365 5.165 -12.789 1.00 0.34 N ATOM 150 CA GLU A 11 3.121 5.359 -12.052 1.00 0.27 C ATOM 151 C GLU A 11 1.983 4.607 -12.732 1.00 0.23 C ATOM 152 O GLU A 11 1.542 4.981 -13.819 1.00 0.32 O ATOM 153 CB GLU A 11 2.784 6.848 -11.957 1.00 0.35 C ATOM 154 CG GLU A 11 3.856 7.673 -11.265 1.00 1.07 C ATOM 155 CD GLU A 11 3.485 9.140 -11.166 1.00 1.05 C ATOM 156 OE1 GLU A 11 3.765 9.890 -12.124 1.00 1.46 O ATOM 157 OE2 GLU A 11 2.916 9.540 -10.127 1.00 0.76 O ATOM 0 H GLU A 11 4.449 5.736 -13.630 1.00 0.34 H new ATOM 0 HA GLU A 11 3.251 4.965 -11.044 1.00 0.27 H new ATOM 0 HB2 GLU A 11 2.627 7.241 -12.962 1.00 0.35 H new ATOM 0 HB3 GLU A 11 1.844 6.965 -11.419 1.00 0.35 H new ATOM 0 HG2 GLU A 11 4.026 7.276 -10.264 1.00 1.07 H new ATOM 0 HG3 GLU A 11 4.794 7.575 -11.811 1.00 1.07 H new ATOM 164 N TYR A 12 1.510 3.546 -12.087 1.00 0.33 N ATOM 165 CA TYR A 12 0.430 2.738 -12.639 1.00 0.46 C ATOM 166 C TYR A 12 -0.907 3.079 -11.992 1.00 0.33 C ATOM 167 O TYR A 12 -0.956 3.674 -10.916 1.00 0.28 O ATOM 168 CB TYR A 12 0.734 1.252 -12.448 1.00 0.67 C ATOM 169 CG TYR A 12 0.618 0.444 -13.719 1.00 0.46 C ATOM 170 CD1 TYR A 12 1.697 0.322 -14.588 1.00 0.71 C ATOM 171 CD2 TYR A 12 -0.570 -0.195 -14.054 1.00 0.62 C ATOM 172 CE1 TYR A 12 1.595 -0.414 -15.752 1.00 1.26 C ATOM 173 CE2 TYR A 12 -0.678 -0.933 -15.218 1.00 1.16 C ATOM 174 CZ TYR A 12 0.406 -1.040 -16.062 1.00 1.50 C ATOM 175 OH TYR A 12 0.300 -1.775 -17.220 1.00 2.11 O ATOM 0 H TYR A 12 1.857 3.226 -11.183 1.00 0.33 H new ATOM 0 HA TYR A 12 0.358 2.960 -13.704 1.00 0.46 H new ATOM 0 HB2 TYR A 12 1.743 1.144 -12.049 1.00 0.67 H new ATOM 0 HB3 TYR A 12 0.051 0.843 -11.703 1.00 0.67 H new ATOM 0 HD1 TYR A 12 2.630 0.811 -14.349 1.00 0.71 H new ATOM 0 HD2 TYR A 12 -1.422 -0.114 -13.395 1.00 0.62 H new ATOM 0 HE1 TYR A 12 2.442 -0.499 -16.416 1.00 1.26 H new ATOM 0 HE2 TYR A 12 -1.608 -1.424 -15.465 1.00 1.16 H new ATOM 0 HH TYR A 12 -0.603 -2.151 -17.288 1.00 2.11 H new ATOM 185 N LEU A 13 -1.988 2.697 -12.665 1.00 0.42 N ATOM 186 CA LEU A 13 -3.336 2.953 -12.170 1.00 0.35 C ATOM 187 C LEU A 13 -4.071 1.642 -11.907 1.00 0.29 C ATOM 188 O LEU A 13 -4.268 0.836 -12.815 1.00 0.35 O ATOM 189 CB LEU A 13 -4.121 3.795 -13.179 1.00 0.45 C ATOM 190 CG LEU A 13 -3.582 5.210 -13.404 1.00 0.59 C ATOM 191 CD1 LEU A 13 -4.298 5.870 -14.571 1.00 1.17 C ATOM 192 CD2 LEU A 13 -3.735 6.047 -12.143 1.00 0.93 C ATOM 0 H LEU A 13 -1.956 2.207 -13.559 1.00 0.42 H new ATOM 0 HA LEU A 13 -3.256 3.503 -11.232 1.00 0.35 H new ATOM 0 HB2 LEU A 13 -4.132 3.271 -14.135 1.00 0.45 H new ATOM 0 HB3 LEU A 13 -5.155 3.866 -12.842 1.00 0.45 H new ATOM 0 HG LEU A 13 -2.521 5.141 -13.643 1.00 0.59 H new ATOM 0 HD11 LEU A 13 -3.904 6.875 -14.718 1.00 1.17 H new ATOM 0 HD12 LEU A 13 -4.139 5.282 -15.475 1.00 1.17 H new ATOM 0 HD13 LEU A 13 -5.365 5.927 -14.358 1.00 1.17 H new ATOM 0 HD21 LEU A 13 -3.346 7.049 -12.322 1.00 0.93 H new ATOM 0 HD22 LEU A 13 -4.789 6.109 -11.873 1.00 0.93 H new ATOM 0 HD23 LEU A 13 -3.179 5.583 -11.328 1.00 0.93 H new ATOM 204 N ALA A 14 -4.480 1.439 -10.657 1.00 0.22 N ATOM 205 CA ALA A 14 -5.190 0.227 -10.272 1.00 0.20 C ATOM 206 C ALA A 14 -5.891 0.408 -8.931 1.00 0.20 C ATOM 207 O ALA A 14 -5.458 1.201 -8.095 1.00 0.32 O ATOM 208 CB ALA A 14 -4.229 -0.951 -10.214 1.00 0.30 C ATOM 0 H ALA A 14 -4.331 2.100 -9.895 1.00 0.22 H new ATOM 0 HA ALA A 14 -5.950 0.023 -11.026 1.00 0.20 H new ATOM 0 HB1 ALA A 14 -4.773 -1.850 -9.925 1.00 0.30 H new ATOM 0 HB2 ALA A 14 -3.776 -1.100 -11.194 1.00 0.30 H new ATOM 0 HB3 ALA A 14 -3.448 -0.748 -9.481 1.00 0.30 H new ATOM 214 N SER A 15 -6.975 -0.335 -8.730 1.00 0.27 N ATOM 215 CA SER A 15 -7.742 -0.253 -7.492 1.00 0.32 C ATOM 216 C SER A 15 -7.452 -1.443 -6.583 1.00 0.30 C ATOM 217 O SER A 15 -7.334 -2.578 -7.048 1.00 0.29 O ATOM 218 CB SER A 15 -9.239 -0.196 -7.802 1.00 0.40 C ATOM 219 OG SER A 15 -10.005 -0.144 -6.610 1.00 1.30 O ATOM 0 H SER A 15 -7.342 -1.001 -9.409 1.00 0.27 H new ATOM 0 HA SER A 15 -7.443 0.658 -6.973 1.00 0.32 H new ATOM 0 HB2 SER A 15 -9.454 0.680 -8.415 1.00 0.40 H new ATOM 0 HB3 SER A 15 -9.526 -1.071 -8.385 1.00 0.40 H new ATOM 0 HG SER A 15 -10.369 0.758 -6.494 1.00 1.30 H new ATOM 225 N LEU A 16 -7.337 -1.174 -5.286 1.00 0.31 N ATOM 226 CA LEU A 16 -7.070 -2.223 -4.307 1.00 0.30 C ATOM 227 C LEU A 16 -8.347 -3.006 -4.010 1.00 0.29 C ATOM 228 O LEU A 16 -9.354 -2.432 -3.597 1.00 0.37 O ATOM 229 CB LEU A 16 -6.520 -1.623 -3.006 1.00 0.34 C ATOM 230 CG LEU A 16 -5.079 -1.093 -3.062 1.00 0.35 C ATOM 231 CD1 LEU A 16 -4.113 -2.182 -3.506 1.00 1.11 C ATOM 232 CD2 LEU A 16 -4.976 0.116 -3.980 1.00 0.98 C ATOM 0 H LEU A 16 -7.424 -0.239 -4.888 1.00 0.31 H new ATOM 0 HA LEU A 16 -6.324 -2.897 -4.727 1.00 0.30 H new ATOM 0 HB2 LEU A 16 -7.174 -0.806 -2.701 1.00 0.34 H new ATOM 0 HB3 LEU A 16 -6.576 -2.383 -2.227 1.00 0.34 H new ATOM 0 HG LEU A 16 -4.803 -0.781 -2.055 1.00 0.35 H new ATOM 0 HD11 LEU A 16 -3.100 -1.780 -3.537 1.00 1.11 H new ATOM 0 HD12 LEU A 16 -4.152 -3.013 -2.801 1.00 1.11 H new ATOM 0 HD13 LEU A 16 -4.394 -2.535 -4.498 1.00 1.11 H new ATOM 0 HD21 LEU A 16 -3.945 0.470 -4.001 1.00 0.98 H new ATOM 0 HD22 LEU A 16 -5.284 -0.165 -4.987 1.00 0.98 H new ATOM 0 HD23 LEU A 16 -5.625 0.910 -3.610 1.00 0.98 H new ATOM 244 N SER A 17 -8.304 -4.317 -4.235 1.00 0.21 N ATOM 245 CA SER A 17 -9.462 -5.169 -3.982 1.00 0.21 C ATOM 246 C SER A 17 -9.082 -6.366 -3.115 1.00 0.19 C ATOM 247 O SER A 17 -8.133 -7.087 -3.419 1.00 0.22 O ATOM 248 CB SER A 17 -10.061 -5.653 -5.304 1.00 0.25 C ATOM 249 OG SER A 17 -10.475 -4.561 -6.107 1.00 0.98 O ATOM 0 H SER A 17 -7.485 -4.810 -4.590 1.00 0.21 H new ATOM 0 HA SER A 17 -10.205 -4.579 -3.446 1.00 0.21 H new ATOM 0 HB2 SER A 17 -9.324 -6.247 -5.845 1.00 0.25 H new ATOM 0 HB3 SER A 17 -10.912 -6.305 -5.104 1.00 0.25 H new ATOM 0 HG SER A 17 -10.852 -4.897 -6.947 1.00 0.98 H new ATOM 255 N THR A 18 -9.834 -6.573 -2.036 1.00 0.18 N ATOM 256 CA THR A 18 -9.577 -7.685 -1.126 1.00 0.19 C ATOM 257 C THR A 18 -9.724 -9.023 -1.841 1.00 0.21 C ATOM 258 O THR A 18 -10.260 -9.092 -2.947 1.00 0.31 O ATOM 259 CB THR A 18 -10.537 -7.659 0.078 1.00 0.18 C ATOM 260 OG1 THR A 18 -11.874 -7.933 -0.356 1.00 0.23 O ATOM 261 CG2 THR A 18 -10.494 -6.309 0.775 1.00 0.18 C ATOM 0 H THR A 18 -10.625 -5.986 -1.771 1.00 0.18 H new ATOM 0 HA THR A 18 -8.553 -7.572 -0.771 1.00 0.19 H new ATOM 0 HB THR A 18 -10.219 -8.426 0.784 1.00 0.18 H new ATOM 0 HG1 THR A 18 -11.978 -7.656 -1.290 1.00 0.23 H new ATOM 0 HG21 THR A 18 -11.180 -6.315 1.622 1.00 0.18 H new ATOM 0 HG22 THR A 18 -9.482 -6.115 1.129 1.00 0.18 H new ATOM 0 HG23 THR A 18 -10.789 -5.528 0.074 1.00 0.18 H new ATOM 269 N TYR A 19 -9.247 -10.086 -1.199 1.00 0.21 N ATOM 270 CA TYR A 19 -9.326 -11.424 -1.772 1.00 0.23 C ATOM 271 C TYR A 19 -10.773 -11.903 -1.836 1.00 0.24 C ATOM 272 O TYR A 19 -11.076 -12.914 -2.471 1.00 0.29 O ATOM 273 CB TYR A 19 -8.483 -12.401 -0.948 1.00 0.28 C ATOM 274 CG TYR A 19 -8.314 -13.757 -1.595 1.00 0.33 C ATOM 275 CD1 TYR A 19 -7.434 -13.937 -2.655 1.00 0.39 C ATOM 276 CD2 TYR A 19 -9.039 -14.855 -1.149 1.00 0.36 C ATOM 277 CE1 TYR A 19 -7.279 -15.175 -3.250 1.00 0.45 C ATOM 278 CE2 TYR A 19 -8.890 -16.094 -1.739 1.00 0.42 C ATOM 279 CZ TYR A 19 -7.999 -16.248 -2.789 1.00 0.45 C ATOM 280 OH TYR A 19 -7.857 -17.483 -3.378 1.00 0.52 O ATOM 0 H TYR A 19 -8.802 -10.046 -0.282 1.00 0.21 H new ATOM 0 HA TYR A 19 -8.933 -11.385 -2.788 1.00 0.23 H new ATOM 0 HB2 TYR A 19 -7.499 -11.964 -0.779 1.00 0.28 H new ATOM 0 HB3 TYR A 19 -8.946 -12.531 0.030 1.00 0.28 H new ATOM 0 HD1 TYR A 19 -6.862 -13.097 -3.020 1.00 0.39 H new ATOM 0 HD2 TYR A 19 -9.730 -14.737 -0.328 1.00 0.36 H new ATOM 0 HE1 TYR A 19 -6.593 -15.297 -4.075 1.00 0.45 H new ATOM 0 HE2 TYR A 19 -9.464 -16.938 -1.385 1.00 0.42 H new ATOM 0 HH TYR A 19 -8.439 -18.129 -2.927 1.00 0.52 H new ATOM 290 N ASN A 20 -11.665 -11.169 -1.178 1.00 0.22 N ATOM 291 CA ASN A 20 -13.082 -11.517 -1.159 1.00 0.27 C ATOM 292 C ASN A 20 -13.819 -10.881 -2.334 1.00 0.26 C ATOM 293 O ASN A 20 -15.026 -10.646 -2.267 1.00 0.30 O ATOM 294 CB ASN A 20 -13.721 -11.077 0.159 1.00 0.32 C ATOM 295 CG ASN A 20 -13.166 -11.827 1.356 1.00 1.21 C ATOM 296 OD1 ASN A 20 -13.089 -11.288 2.459 1.00 2.23 O ATOM 297 ND2 ASN A 20 -12.780 -13.081 1.143 1.00 1.58 N ATOM 0 H ASN A 20 -11.431 -10.328 -0.650 1.00 0.22 H new ATOM 0 HA ASN A 20 -13.163 -12.600 -1.249 1.00 0.27 H new ATOM 0 HB2 ASN A 20 -13.559 -10.008 0.298 1.00 0.32 H new ATOM 0 HB3 ASN A 20 -14.799 -11.232 0.106 1.00 0.32 H new ATOM 0 HD21 ASN A 20 -12.402 -13.636 1.911 1.00 1.58 H new ATOM 0 HD22 ASN A 20 -12.862 -13.489 0.212 1.00 1.58 H new ATOM 304 N ASP A 21 -13.083 -10.602 -3.408 1.00 0.26 N ATOM 305 CA ASP A 21 -13.657 -9.995 -4.606 1.00 0.30 C ATOM 306 C ASP A 21 -14.244 -8.617 -4.303 1.00 0.31 C ATOM 307 O ASP A 21 -14.916 -8.016 -5.144 1.00 0.54 O ATOM 308 CB ASP A 21 -14.735 -10.908 -5.200 1.00 0.36 C ATOM 309 CG ASP A 21 -15.220 -10.433 -6.555 1.00 1.14 C ATOM 310 OD1 ASP A 21 -14.512 -10.673 -7.557 1.00 1.01 O ATOM 311 OD2 ASP A 21 -16.310 -9.825 -6.618 1.00 2.07 O ATOM 0 H ASP A 21 -12.082 -10.788 -3.472 1.00 0.26 H new ATOM 0 HA ASP A 21 -12.856 -9.869 -5.334 1.00 0.30 H new ATOM 0 HB2 ASP A 21 -14.338 -11.919 -5.294 1.00 0.36 H new ATOM 0 HB3 ASP A 21 -15.580 -10.960 -4.514 1.00 0.36 H new ATOM 316 N GLN A 22 -13.982 -8.115 -3.100 1.00 0.22 N ATOM 317 CA GLN A 22 -14.481 -6.807 -2.694 1.00 0.21 C ATOM 318 C GLN A 22 -13.451 -5.723 -2.990 1.00 0.20 C ATOM 319 O GLN A 22 -12.248 -5.974 -2.964 1.00 0.29 O ATOM 320 CB GLN A 22 -14.824 -6.806 -1.203 1.00 0.22 C ATOM 321 CG GLN A 22 -15.940 -7.771 -0.836 1.00 0.30 C ATOM 322 CD GLN A 22 -16.298 -7.718 0.636 1.00 0.37 C ATOM 323 OE1 GLN A 22 -15.453 -7.427 1.483 1.00 1.13 O ATOM 324 NE2 GLN A 22 -17.557 -7.999 0.949 1.00 1.17 N ATOM 0 H GLN A 22 -13.428 -8.594 -2.391 1.00 0.22 H new ATOM 0 HA GLN A 22 -15.385 -6.596 -3.265 1.00 0.21 H new ATOM 0 HB2 GLN A 22 -13.931 -7.062 -0.633 1.00 0.22 H new ATOM 0 HB3 GLN A 22 -15.114 -5.798 -0.906 1.00 0.22 H new ATOM 0 HG2 GLN A 22 -16.825 -7.540 -1.429 1.00 0.30 H new ATOM 0 HG3 GLN A 22 -15.638 -8.785 -1.096 1.00 0.30 H new ATOM 0 HE21 GLN A 22 -18.225 -8.235 0.215 1.00 1.17 H new ATOM 0 HE22 GLN A 22 -17.857 -7.979 1.924 1.00 1.17 H new ATOM 333 N SER A 23 -13.931 -4.517 -3.273 1.00 0.29 N ATOM 334 CA SER A 23 -13.048 -3.396 -3.576 1.00 0.31 C ATOM 335 C SER A 23 -12.985 -2.421 -2.408 1.00 0.26 C ATOM 336 O SER A 23 -13.910 -2.342 -1.599 1.00 0.23 O ATOM 337 CB SER A 23 -13.521 -2.664 -4.831 1.00 0.37 C ATOM 338 OG SER A 23 -12.564 -1.708 -5.255 1.00 1.17 O ATOM 0 H SER A 23 -14.925 -4.290 -3.299 1.00 0.29 H new ATOM 0 HA SER A 23 -12.050 -3.797 -3.751 1.00 0.31 H new ATOM 0 HB2 SER A 23 -13.699 -3.384 -5.630 1.00 0.37 H new ATOM 0 HB3 SER A 23 -14.471 -2.168 -4.630 1.00 0.37 H new ATOM 0 HG SER A 23 -12.810 -1.369 -6.141 1.00 1.17 H new ATOM 344 N ILE A 24 -11.887 -1.680 -2.329 1.00 0.28 N ATOM 345 CA ILE A 24 -11.693 -0.707 -1.259 1.00 0.26 C ATOM 346 C ILE A 24 -12.184 0.672 -1.693 1.00 0.26 C ATOM 347 O ILE A 24 -12.048 1.051 -2.857 1.00 0.45 O ATOM 348 CB ILE A 24 -10.207 -0.599 -0.854 1.00 0.29 C ATOM 349 CG1 ILE A 24 -9.608 -1.990 -0.607 1.00 0.32 C ATOM 350 CG2 ILE A 24 -10.056 0.278 0.380 1.00 0.31 C ATOM 351 CD1 ILE A 24 -10.211 -2.724 0.569 1.00 0.31 C ATOM 0 H ILE A 24 -11.115 -1.734 -2.994 1.00 0.28 H new ATOM 0 HA ILE A 24 -12.270 -1.055 -0.402 1.00 0.26 H new ATOM 0 HB ILE A 24 -9.660 -0.136 -1.675 1.00 0.29 H new ATOM 0 HG12 ILE A 24 -9.739 -2.595 -1.504 1.00 0.32 H new ATOM 0 HG13 ILE A 24 -8.535 -1.888 -0.446 1.00 0.32 H new ATOM 0 HG21 ILE A 24 -9.003 0.344 0.653 1.00 0.31 H new ATOM 0 HG22 ILE A 24 -10.439 1.276 0.166 1.00 0.31 H new ATOM 0 HG23 ILE A 24 -10.618 -0.157 1.206 1.00 0.31 H new ATOM 0 HD11 ILE A 24 -9.732 -3.698 0.674 1.00 0.31 H new ATOM 0 HD12 ILE A 24 -10.056 -2.143 1.478 1.00 0.31 H new ATOM 0 HD13 ILE A 24 -11.280 -2.861 0.403 1.00 0.31 H new ATOM 363 N THR A 25 -12.755 1.417 -0.751 1.00 0.32 N ATOM 364 CA THR A 25 -13.265 2.753 -1.040 1.00 0.35 C ATOM 365 C THR A 25 -12.608 3.796 -0.146 1.00 0.38 C ATOM 366 O THR A 25 -12.433 3.580 1.054 1.00 0.46 O ATOM 367 CB THR A 25 -14.794 2.821 -0.858 1.00 0.40 C ATOM 368 OG1 THR A 25 -15.428 1.809 -1.649 1.00 0.40 O ATOM 369 CG2 THR A 25 -15.326 4.190 -1.258 1.00 0.44 C ATOM 0 H THR A 25 -12.876 1.119 0.217 1.00 0.32 H new ATOM 0 HA THR A 25 -13.022 2.968 -2.081 1.00 0.35 H new ATOM 0 HB THR A 25 -15.020 2.653 0.195 1.00 0.40 H new ATOM 0 HG1 THR A 25 -16.399 1.858 -1.526 1.00 0.40 H new ATOM 0 HG21 THR A 25 -16.407 4.214 -1.121 1.00 0.44 H new ATOM 0 HG22 THR A 25 -14.864 4.956 -0.635 1.00 0.44 H new ATOM 0 HG23 THR A 25 -15.088 4.381 -2.304 1.00 0.44 H new ATOM 377 N PHE A 26 -12.246 4.931 -0.738 1.00 0.37 N ATOM 378 CA PHE A 26 -11.609 6.014 0.002 1.00 0.40 C ATOM 379 C PHE A 26 -12.450 7.284 -0.070 1.00 0.48 C ATOM 380 O PHE A 26 -12.311 8.080 -1.000 1.00 0.52 O ATOM 381 CB PHE A 26 -10.208 6.283 -0.551 1.00 0.39 C ATOM 382 CG PHE A 26 -9.266 5.124 -0.395 1.00 0.36 C ATOM 383 CD1 PHE A 26 -8.557 4.943 0.782 1.00 0.37 C ATOM 384 CD2 PHE A 26 -9.090 4.215 -1.427 1.00 0.38 C ATOM 385 CE1 PHE A 26 -7.691 3.875 0.927 1.00 0.38 C ATOM 386 CE2 PHE A 26 -8.227 3.146 -1.287 1.00 0.40 C ATOM 387 CZ PHE A 26 -7.516 2.983 -0.111 1.00 0.39 C ATOM 0 H PHE A 26 -12.384 5.124 -1.730 1.00 0.37 H new ATOM 0 HA PHE A 26 -11.526 5.711 1.046 1.00 0.40 H new ATOM 0 HB2 PHE A 26 -10.287 6.536 -1.608 1.00 0.39 H new ATOM 0 HB3 PHE A 26 -9.788 7.152 -0.045 1.00 0.39 H new ATOM 0 HD1 PHE A 26 -8.682 5.644 1.594 1.00 0.37 H new ATOM 0 HD2 PHE A 26 -9.634 4.344 -2.351 1.00 0.38 H new ATOM 0 HE1 PHE A 26 -7.152 3.739 1.853 1.00 0.38 H new ATOM 0 HE2 PHE A 26 -8.107 2.438 -2.094 1.00 0.40 H new ATOM 0 HZ PHE A 26 -6.826 2.159 -0.006 1.00 0.39 H new ATOM 397 N ALA A 27 -13.322 7.467 0.916 1.00 0.53 N ATOM 398 CA ALA A 27 -14.185 8.642 0.965 1.00 0.62 C ATOM 399 C ALA A 27 -13.542 9.762 1.775 1.00 0.64 C ATOM 400 O ALA A 27 -13.688 9.819 2.996 1.00 0.65 O ATOM 401 CB ALA A 27 -15.541 8.274 1.547 1.00 0.65 C ATOM 0 H ALA A 27 -13.450 6.817 1.692 1.00 0.53 H new ATOM 0 HA ALA A 27 -14.326 9.004 -0.053 1.00 0.62 H new ATOM 0 HB1 ALA A 27 -16.176 9.159 1.578 1.00 0.65 H new ATOM 0 HB2 ALA A 27 -16.010 7.513 0.923 1.00 0.65 H new ATOM 0 HB3 ALA A 27 -15.410 7.886 2.557 1.00 0.65 H new ATOM 407 N LEU A 28 -12.830 10.650 1.089 1.00 0.79 N ATOM 408 CA LEU A 28 -12.165 11.769 1.745 1.00 0.88 C ATOM 409 C LEU A 28 -13.022 13.027 1.687 1.00 0.88 C ATOM 410 O LEU A 28 -13.281 13.566 0.608 1.00 1.02 O ATOM 411 CB LEU A 28 -10.804 12.038 1.101 1.00 1.22 C ATOM 412 CG LEU A 28 -9.738 10.973 1.365 1.00 1.08 C ATOM 413 CD1 LEU A 28 -9.940 9.774 0.453 1.00 1.52 C ATOM 414 CD2 LEU A 28 -8.348 11.561 1.183 1.00 1.17 C ATOM 0 H LEU A 28 -12.699 10.616 0.078 1.00 0.79 H new ATOM 0 HA LEU A 28 -12.017 11.500 2.791 1.00 0.88 H new ATOM 0 HB2 LEU A 28 -10.942 12.133 0.024 1.00 1.22 H new ATOM 0 HB3 LEU A 28 -10.433 12.998 1.460 1.00 1.22 H new ATOM 0 HG LEU A 28 -9.836 10.633 2.396 1.00 1.08 H new ATOM 0 HD11 LEU A 28 -9.172 9.028 0.657 1.00 1.52 H new ATOM 0 HD12 LEU A 28 -10.924 9.341 0.634 1.00 1.52 H new ATOM 0 HD13 LEU A 28 -9.870 10.092 -0.587 1.00 1.52 H new ATOM 0 HD21 LEU A 28 -7.600 10.792 1.374 1.00 1.17 H new ATOM 0 HD22 LEU A 28 -8.239 11.928 0.162 1.00 1.17 H new ATOM 0 HD23 LEU A 28 -8.207 12.386 1.882 1.00 1.17 H new ATOM 426 N GLU A 29 -13.462 13.492 2.852 1.00 0.83 N ATOM 427 CA GLU A 29 -14.288 14.691 2.936 1.00 0.96 C ATOM 428 C GLU A 29 -13.418 15.944 2.933 1.00 1.04 C ATOM 429 O GLU A 29 -12.211 15.871 2.701 1.00 1.03 O ATOM 430 CB GLU A 29 -15.157 14.656 4.193 1.00 1.00 C ATOM 431 CG GLU A 29 -16.090 13.459 4.254 1.00 1.07 C ATOM 432 CD GLU A 29 -16.993 13.484 5.472 1.00 1.79 C ATOM 433 OE1 GLU A 29 -18.062 14.125 5.406 1.00 2.42 O ATOM 434 OE2 GLU A 29 -16.629 12.863 6.494 1.00 2.32 O ATOM 0 H GLU A 29 -13.260 13.056 3.752 1.00 0.83 H new ATOM 0 HA GLU A 29 -14.939 14.718 2.062 1.00 0.96 H new ATOM 0 HB2 GLU A 29 -14.511 14.648 5.071 1.00 1.00 H new ATOM 0 HB3 GLU A 29 -15.749 15.570 4.241 1.00 1.00 H new ATOM 0 HG2 GLU A 29 -16.703 13.434 3.353 1.00 1.07 H new ATOM 0 HG3 GLU A 29 -15.499 12.543 4.263 1.00 1.07 H new ATOM 441 N ASP A 30 -14.040 17.093 3.187 1.00 1.19 N ATOM 442 CA ASP A 30 -13.328 18.367 3.210 1.00 1.30 C ATOM 443 C ASP A 30 -12.051 18.285 4.046 1.00 1.12 C ATOM 444 O ASP A 30 -11.052 18.927 3.725 1.00 1.19 O ATOM 445 CB ASP A 30 -14.232 19.471 3.758 1.00 1.51 C ATOM 446 CG ASP A 30 -13.534 20.817 3.806 1.00 1.91 C ATOM 447 OD1 ASP A 30 -13.575 21.543 2.790 1.00 2.03 O ATOM 448 OD2 ASP A 30 -12.949 21.146 4.860 1.00 2.56 O ATOM 0 H ASP A 30 -15.039 17.167 3.380 1.00 1.19 H new ATOM 0 HA ASP A 30 -13.047 18.603 2.184 1.00 1.30 H new ATOM 0 HB2 ASP A 30 -15.124 19.549 3.136 1.00 1.51 H new ATOM 0 HB3 ASP A 30 -14.565 19.201 4.760 1.00 1.51 H new ATOM 453 N GLU A 31 -12.086 17.493 5.115 1.00 0.94 N ATOM 454 CA GLU A 31 -10.922 17.346 5.986 1.00 0.83 C ATOM 455 C GLU A 31 -10.956 16.024 6.748 1.00 0.75 C ATOM 456 O GLU A 31 -10.123 15.785 7.624 1.00 0.74 O ATOM 457 CB GLU A 31 -10.857 18.512 6.976 1.00 0.84 C ATOM 458 CG GLU A 31 -11.985 18.507 7.997 1.00 0.91 C ATOM 459 CD GLU A 31 -11.921 19.688 8.945 1.00 0.99 C ATOM 460 OE1 GLU A 31 -11.051 19.681 9.842 1.00 1.15 O ATOM 461 OE2 GLU A 31 -12.739 20.618 8.791 1.00 0.95 O ATOM 0 H GLU A 31 -12.900 16.947 5.398 1.00 0.94 H new ATOM 0 HA GLU A 31 -10.032 17.351 5.356 1.00 0.83 H new ATOM 0 HB2 GLU A 31 -9.902 18.479 7.501 1.00 0.84 H new ATOM 0 HB3 GLU A 31 -10.884 19.450 6.422 1.00 0.84 H new ATOM 0 HG2 GLU A 31 -12.942 18.517 7.475 1.00 0.91 H new ATOM 0 HG3 GLU A 31 -11.945 17.582 8.572 1.00 0.91 H new ATOM 468 N SER A 32 -11.915 15.165 6.413 1.00 0.75 N ATOM 469 CA SER A 32 -12.043 13.873 7.079 1.00 0.72 C ATOM 470 C SER A 32 -11.542 12.742 6.187 1.00 0.67 C ATOM 471 O SER A 32 -11.445 12.894 4.970 1.00 0.83 O ATOM 472 CB SER A 32 -13.497 13.614 7.478 1.00 0.84 C ATOM 473 OG SER A 32 -14.001 14.667 8.282 1.00 1.53 O ATOM 0 H SER A 32 -12.611 15.339 5.688 1.00 0.75 H new ATOM 0 HA SER A 32 -11.428 13.902 7.978 1.00 0.72 H new ATOM 0 HB2 SER A 32 -14.110 13.511 6.583 1.00 0.84 H new ATOM 0 HB3 SER A 32 -13.566 12.672 8.022 1.00 0.84 H new ATOM 0 HG SER A 32 -14.932 14.478 8.522 1.00 1.53 H new ATOM 479 N TYR A 33 -11.227 11.609 6.807 1.00 0.57 N ATOM 480 CA TYR A 33 -10.739 10.445 6.077 1.00 0.50 C ATOM 481 C TYR A 33 -11.559 9.209 6.426 1.00 0.46 C ATOM 482 O TYR A 33 -11.600 8.785 7.581 1.00 0.59 O ATOM 483 CB TYR A 33 -9.262 10.199 6.394 1.00 0.53 C ATOM 484 CG TYR A 33 -8.369 11.379 6.080 1.00 0.60 C ATOM 485 CD1 TYR A 33 -7.899 11.594 4.790 1.00 0.58 C ATOM 486 CD2 TYR A 33 -8.000 12.278 7.072 1.00 0.72 C ATOM 487 CE1 TYR A 33 -7.083 12.672 4.499 1.00 0.67 C ATOM 488 CE2 TYR A 33 -7.185 13.358 6.788 1.00 0.80 C ATOM 489 CZ TYR A 33 -6.730 13.550 5.502 1.00 0.76 C ATOM 490 OH TYR A 33 -5.919 14.625 5.217 1.00 0.86 O ATOM 0 H TYR A 33 -11.301 11.473 7.815 1.00 0.57 H new ATOM 0 HA TYR A 33 -10.844 10.643 5.010 1.00 0.50 H new ATOM 0 HB2 TYR A 33 -9.163 9.950 7.451 1.00 0.53 H new ATOM 0 HB3 TYR A 33 -8.917 9.333 5.829 1.00 0.53 H new ATOM 0 HD1 TYR A 33 -8.175 10.909 4.002 1.00 0.58 H new ATOM 0 HD2 TYR A 33 -8.355 12.131 8.081 1.00 0.72 H new ATOM 0 HE1 TYR A 33 -6.724 12.825 3.492 1.00 0.67 H new ATOM 0 HE2 TYR A 33 -6.906 14.048 7.571 1.00 0.80 H new ATOM 0 HH TYR A 33 -5.765 14.671 4.250 1.00 0.86 H new ATOM 500 N GLU A 34 -12.212 8.635 5.421 1.00 0.46 N ATOM 501 CA GLU A 34 -13.035 7.448 5.626 1.00 0.42 C ATOM 502 C GLU A 34 -12.649 6.339 4.653 1.00 0.39 C ATOM 503 O GLU A 34 -12.502 6.573 3.453 1.00 0.46 O ATOM 504 CB GLU A 34 -14.515 7.793 5.462 1.00 0.50 C ATOM 505 CG GLU A 34 -15.038 8.745 6.525 1.00 0.55 C ATOM 506 CD GLU A 34 -16.517 9.036 6.369 1.00 1.50 C ATOM 507 OE1 GLU A 34 -17.333 8.278 6.936 1.00 1.48 O ATOM 508 OE2 GLU A 34 -16.861 10.020 5.682 1.00 2.46 O ATOM 0 H GLU A 34 -12.188 8.971 4.458 1.00 0.46 H new ATOM 0 HA GLU A 34 -12.862 7.090 6.641 1.00 0.42 H new ATOM 0 HB2 GLU A 34 -14.669 8.239 4.479 1.00 0.50 H new ATOM 0 HB3 GLU A 34 -15.099 6.873 5.490 1.00 0.50 H new ATOM 0 HG2 GLU A 34 -14.858 8.317 7.511 1.00 0.55 H new ATOM 0 HG3 GLU A 34 -14.480 9.680 6.476 1.00 0.55 H new ATOM 515 N ILE A 35 -12.485 5.131 5.182 1.00 0.34 N ATOM 516 CA ILE A 35 -12.120 3.979 4.365 1.00 0.32 C ATOM 517 C ILE A 35 -13.016 2.786 4.680 1.00 0.26 C ATOM 518 O ILE A 35 -13.088 2.338 5.824 1.00 0.32 O ATOM 519 CB ILE A 35 -10.647 3.576 4.584 1.00 0.39 C ATOM 520 CG1 ILE A 35 -9.727 4.776 4.343 1.00 0.46 C ATOM 521 CG2 ILE A 35 -10.273 2.420 3.667 1.00 0.44 C ATOM 522 CD1 ILE A 35 -8.276 4.509 4.682 1.00 0.54 C ATOM 0 H ILE A 35 -12.599 4.924 6.174 1.00 0.34 H new ATOM 0 HA ILE A 35 -12.254 4.270 3.323 1.00 0.32 H new ATOM 0 HB ILE A 35 -10.523 3.249 5.616 1.00 0.39 H new ATOM 0 HG12 ILE A 35 -9.798 5.072 3.296 1.00 0.46 H new ATOM 0 HG13 ILE A 35 -10.081 5.619 4.937 1.00 0.46 H new ATOM 0 HG21 ILE A 35 -9.231 2.147 3.833 1.00 0.44 H new ATOM 0 HG22 ILE A 35 -10.912 1.563 3.883 1.00 0.44 H new ATOM 0 HG23 ILE A 35 -10.408 2.721 2.628 1.00 0.44 H new ATOM 0 HD11 ILE A 35 -7.686 5.404 4.486 1.00 0.54 H new ATOM 0 HD12 ILE A 35 -8.192 4.243 5.736 1.00 0.54 H new ATOM 0 HD13 ILE A 35 -7.904 3.688 4.069 1.00 0.54 H new ATOM 534 N TYR A 36 -13.700 2.278 3.659 1.00 0.21 N ATOM 535 CA TYR A 36 -14.591 1.135 3.829 1.00 0.21 C ATOM 536 C TYR A 36 -14.478 0.170 2.654 1.00 0.23 C ATOM 537 O TYR A 36 -14.230 0.579 1.521 1.00 0.48 O ATOM 538 CB TYR A 36 -16.040 1.604 3.979 1.00 0.29 C ATOM 539 CG TYR A 36 -16.300 2.363 5.259 1.00 1.07 C ATOM 540 CD1 TYR A 36 -16.611 1.693 6.435 1.00 2.26 C ATOM 541 CD2 TYR A 36 -16.236 3.750 5.290 1.00 0.96 C ATOM 542 CE1 TYR A 36 -16.851 2.384 7.607 1.00 3.30 C ATOM 543 CE2 TYR A 36 -16.475 4.449 6.458 1.00 1.97 C ATOM 544 CZ TYR A 36 -16.780 3.756 7.616 1.00 3.14 C ATOM 545 OH TYR A 36 -17.020 4.454 8.777 1.00 4.17 O ATOM 0 H TYR A 36 -13.654 2.639 2.706 1.00 0.21 H new ATOM 0 HA TYR A 36 -14.290 0.610 4.736 1.00 0.21 H new ATOM 0 HB2 TYR A 36 -16.297 2.239 3.131 1.00 0.29 H new ATOM 0 HB3 TYR A 36 -16.700 0.737 3.940 1.00 0.29 H new ATOM 0 HD1 TYR A 36 -16.666 0.614 6.433 1.00 2.26 H new ATOM 0 HD2 TYR A 36 -15.996 4.291 4.387 1.00 0.96 H new ATOM 0 HE1 TYR A 36 -17.093 1.848 8.513 1.00 3.30 H new ATOM 0 HE2 TYR A 36 -16.424 5.528 6.467 1.00 1.97 H new ATOM 0 HH TYR A 36 -16.927 5.415 8.606 1.00 4.17 H new ATOM 555 N VAL A 37 -14.666 -1.115 2.939 1.00 0.19 N ATOM 556 CA VAL A 37 -14.588 -2.150 1.914 1.00 0.17 C ATOM 557 C VAL A 37 -15.982 -2.543 1.426 1.00 0.18 C ATOM 558 O VAL A 37 -16.730 -3.214 2.138 1.00 0.27 O ATOM 559 CB VAL A 37 -13.874 -3.406 2.449 1.00 0.21 C ATOM 560 CG1 VAL A 37 -13.756 -4.465 1.361 1.00 0.24 C ATOM 561 CG2 VAL A 37 -12.505 -3.046 3.004 1.00 0.24 C ATOM 0 H VAL A 37 -14.874 -1.465 3.874 1.00 0.19 H new ATOM 0 HA VAL A 37 -14.017 -1.737 1.083 1.00 0.17 H new ATOM 0 HB VAL A 37 -14.473 -3.821 3.260 1.00 0.21 H new ATOM 0 HG11 VAL A 37 -13.249 -5.343 1.761 1.00 0.24 H new ATOM 0 HG12 VAL A 37 -14.751 -4.746 1.018 1.00 0.24 H new ATOM 0 HG13 VAL A 37 -13.183 -4.065 0.524 1.00 0.24 H new ATOM 0 HG21 VAL A 37 -12.016 -3.946 3.377 1.00 0.24 H new ATOM 0 HG22 VAL A 37 -11.897 -2.603 2.215 1.00 0.24 H new ATOM 0 HG23 VAL A 37 -12.619 -2.331 3.818 1.00 0.24 H new ATOM 571 N GLU A 38 -16.325 -2.119 0.215 1.00 0.24 N ATOM 572 CA GLU A 38 -17.630 -2.433 -0.363 1.00 0.27 C ATOM 573 C GLU A 38 -17.547 -3.666 -1.257 1.00 0.31 C ATOM 574 O GLU A 38 -16.491 -3.971 -1.812 1.00 0.39 O ATOM 575 CB GLU A 38 -18.158 -1.239 -1.162 1.00 0.29 C ATOM 576 CG GLU A 38 -18.537 -0.047 -0.298 1.00 0.33 C ATOM 577 CD GLU A 38 -19.648 -0.369 0.683 1.00 1.05 C ATOM 578 OE1 GLU A 38 -20.829 -0.272 0.293 1.00 0.89 O ATOM 579 OE2 GLU A 38 -19.335 -0.718 1.841 1.00 2.07 O ATOM 0 H GLU A 38 -15.721 -1.558 -0.386 1.00 0.24 H new ATOM 0 HA GLU A 38 -18.320 -2.647 0.453 1.00 0.27 H new ATOM 0 HB2 GLU A 38 -17.399 -0.929 -1.881 1.00 0.29 H new ATOM 0 HB3 GLU A 38 -19.030 -1.553 -1.735 1.00 0.29 H new ATOM 0 HG2 GLU A 38 -17.659 0.293 0.251 1.00 0.33 H new ATOM 0 HG3 GLU A 38 -18.851 0.777 -0.939 1.00 0.33 H new ATOM 586 N ASP A 39 -18.667 -4.369 -1.394 1.00 0.35 N ATOM 587 CA ASP A 39 -18.720 -5.573 -2.218 1.00 0.43 C ATOM 588 C ASP A 39 -19.333 -5.281 -3.585 1.00 0.47 C ATOM 589 O ASP A 39 -20.377 -4.637 -3.685 1.00 0.61 O ATOM 590 CB ASP A 39 -19.525 -6.664 -1.510 1.00 0.52 C ATOM 591 CG ASP A 39 -20.953 -6.240 -1.227 1.00 1.42 C ATOM 592 OD1 ASP A 39 -21.196 -5.648 -0.154 1.00 2.20 O ATOM 593 OD2 ASP A 39 -21.829 -6.499 -2.078 1.00 1.91 O ATOM 0 H ASP A 39 -19.550 -4.126 -0.945 1.00 0.35 H new ATOM 0 HA ASP A 39 -17.698 -5.920 -2.369 1.00 0.43 H new ATOM 0 HB2 ASP A 39 -19.532 -7.564 -2.126 1.00 0.52 H new ATOM 0 HB3 ASP A 39 -19.034 -6.923 -0.572 1.00 0.52 H new ATOM 598 N LEU A 40 -18.671 -5.760 -4.635 1.00 0.46 N ATOM 599 CA LEU A 40 -19.147 -5.559 -6.000 1.00 0.53 C ATOM 600 C LEU A 40 -19.891 -6.788 -6.508 1.00 0.57 C ATOM 601 O LEU A 40 -19.573 -7.918 -6.138 1.00 0.62 O ATOM 602 CB LEU A 40 -17.972 -5.247 -6.926 1.00 0.62 C ATOM 603 CG LEU A 40 -17.279 -3.912 -6.667 1.00 0.86 C ATOM 604 CD1 LEU A 40 -16.008 -3.802 -7.494 1.00 1.05 C ATOM 605 CD2 LEU A 40 -18.219 -2.757 -6.979 1.00 1.02 C ATOM 0 H LEU A 40 -17.803 -6.291 -4.566 1.00 0.46 H new ATOM 0 HA LEU A 40 -19.838 -4.716 -5.995 1.00 0.53 H new ATOM 0 HB2 LEU A 40 -17.235 -6.045 -6.834 1.00 0.62 H new ATOM 0 HB3 LEU A 40 -18.328 -5.260 -7.956 1.00 0.62 H new ATOM 0 HG LEU A 40 -17.008 -3.862 -5.612 1.00 0.86 H new ATOM 0 HD11 LEU A 40 -15.527 -2.844 -7.297 1.00 1.05 H new ATOM 0 HD12 LEU A 40 -15.328 -4.611 -7.226 1.00 1.05 H new ATOM 0 HD13 LEU A 40 -16.256 -3.872 -8.553 1.00 1.05 H new ATOM 0 HD21 LEU A 40 -17.710 -1.812 -6.789 1.00 1.02 H new ATOM 0 HD22 LEU A 40 -18.518 -2.804 -8.026 1.00 1.02 H new ATOM 0 HD23 LEU A 40 -19.103 -2.826 -6.346 1.00 1.02 H new ATOM 617 N LYS A 41 -20.882 -6.556 -7.363 1.00 0.84 N ATOM 618 CA LYS A 41 -21.675 -7.639 -7.933 1.00 1.06 C ATOM 619 C LYS A 41 -22.087 -7.315 -9.366 1.00 1.17 C ATOM 620 O LYS A 41 -21.853 -8.102 -10.284 1.00 1.58 O ATOM 621 CB LYS A 41 -22.921 -7.892 -7.078 1.00 1.22 C ATOM 622 CG LYS A 41 -22.618 -8.512 -5.724 1.00 1.38 C ATOM 623 CD LYS A 41 -22.118 -9.942 -5.862 1.00 1.63 C ATOM 624 CE LYS A 41 -21.839 -10.568 -4.507 1.00 1.68 C ATOM 625 NZ LYS A 41 -21.360 -11.972 -4.633 1.00 2.27 N ATOM 0 H LYS A 41 -21.155 -5.625 -7.677 1.00 0.84 H new ATOM 0 HA LYS A 41 -21.060 -8.539 -7.944 1.00 1.06 H new ATOM 0 HB2 LYS A 41 -23.444 -6.948 -6.926 1.00 1.22 H new ATOM 0 HB3 LYS A 41 -23.599 -8.548 -7.625 1.00 1.22 H new ATOM 0 HG2 LYS A 41 -21.868 -7.912 -5.208 1.00 1.38 H new ATOM 0 HG3 LYS A 41 -23.517 -8.498 -5.108 1.00 1.38 H new ATOM 0 HD2 LYS A 41 -22.860 -10.538 -6.393 1.00 1.63 H new ATOM 0 HD3 LYS A 41 -21.209 -9.954 -6.464 1.00 1.63 H new ATOM 0 HE2 LYS A 41 -21.091 -9.975 -3.980 1.00 1.68 H new ATOM 0 HE3 LYS A 41 -22.746 -10.547 -3.903 1.00 1.68 H new ATOM 0 HZ1 LYS A 41 -21.181 -12.364 -3.686 1.00 2.27 H new ATOM 0 HZ2 LYS A 41 -22.084 -12.544 -5.113 1.00 2.27 H new ATOM 0 HZ3 LYS A 41 -20.480 -11.990 -5.187 1.00 2.27 H new ATOM 639 N LYS A 42 -22.700 -6.149 -9.550 1.00 1.21 N ATOM 640 CA LYS A 42 -23.149 -5.720 -10.870 1.00 1.37 C ATOM 641 C LYS A 42 -22.079 -4.880 -11.563 1.00 1.45 C ATOM 642 O LYS A 42 -20.947 -4.784 -11.090 1.00 1.51 O ATOM 643 CB LYS A 42 -24.449 -4.917 -10.760 1.00 1.51 C ATOM 644 CG LYS A 42 -25.641 -5.735 -10.283 1.00 1.51 C ATOM 645 CD LYS A 42 -25.583 -5.996 -8.788 1.00 1.81 C ATOM 646 CE LYS A 42 -26.777 -6.812 -8.320 1.00 1.87 C ATOM 647 NZ LYS A 42 -26.693 -7.139 -6.869 1.00 2.49 N ATOM 0 H LYS A 42 -22.897 -5.485 -8.801 1.00 1.21 H new ATOM 0 HA LYS A 42 -23.332 -6.613 -11.468 1.00 1.37 H new ATOM 0 HB2 LYS A 42 -24.294 -4.085 -10.073 1.00 1.51 H new ATOM 0 HB3 LYS A 42 -24.682 -4.487 -11.734 1.00 1.51 H new ATOM 0 HG2 LYS A 42 -26.564 -5.208 -10.525 1.00 1.51 H new ATOM 0 HG3 LYS A 42 -25.667 -6.685 -10.817 1.00 1.51 H new ATOM 0 HD2 LYS A 42 -24.661 -6.525 -8.545 1.00 1.81 H new ATOM 0 HD3 LYS A 42 -25.557 -5.047 -8.252 1.00 1.81 H new ATOM 0 HE2 LYS A 42 -27.695 -6.257 -8.514 1.00 1.87 H new ATOM 0 HE3 LYS A 42 -26.835 -7.735 -8.897 1.00 1.87 H new ATOM 0 HZ1 LYS A 42 -27.526 -7.696 -6.590 1.00 2.49 H new ATOM 0 HZ2 LYS A 42 -25.831 -7.691 -6.687 1.00 2.49 H new ATOM 0 HZ3 LYS A 42 -26.664 -6.259 -6.316 1.00 2.49 H new ATOM 661 N ASP A 43 -22.450 -4.276 -12.688 1.00 1.86 N ATOM 662 CA ASP A 43 -21.529 -3.442 -13.451 1.00 2.00 C ATOM 663 C ASP A 43 -21.365 -2.076 -12.791 1.00 1.95 C ATOM 664 O ASP A 43 -21.909 -1.076 -13.260 1.00 2.34 O ATOM 665 CB ASP A 43 -22.033 -3.277 -14.887 1.00 2.46 C ATOM 666 CG ASP A 43 -21.095 -2.441 -15.739 1.00 2.78 C ATOM 667 OD1 ASP A 43 -20.083 -2.992 -16.222 1.00 2.94 O ATOM 668 OD2 ASP A 43 -21.373 -1.238 -15.922 1.00 3.40 O ATOM 0 H ASP A 43 -23.384 -4.349 -13.092 1.00 1.86 H new ATOM 0 HA ASP A 43 -20.556 -3.933 -13.471 1.00 2.00 H new ATOM 0 HB2 ASP A 43 -22.153 -4.260 -15.342 1.00 2.46 H new ATOM 0 HB3 ASP A 43 -23.018 -2.811 -14.872 1.00 2.46 H new ATOM 673 N GLU A 44 -20.611 -2.045 -11.699 1.00 1.52 N ATOM 674 CA GLU A 44 -20.373 -0.807 -10.966 1.00 1.51 C ATOM 675 C GLU A 44 -18.889 -0.634 -10.661 1.00 1.33 C ATOM 676 O GLU A 44 -18.367 -1.225 -9.717 1.00 1.10 O ATOM 677 CB GLU A 44 -21.179 -0.799 -9.666 1.00 1.42 C ATOM 678 CG GLU A 44 -22.680 -0.916 -9.883 1.00 1.69 C ATOM 679 CD GLU A 44 -23.454 -0.975 -8.582 1.00 2.24 C ATOM 680 OE1 GLU A 44 -23.747 0.099 -8.017 1.00 2.42 O ATOM 681 OE2 GLU A 44 -23.770 -2.095 -8.128 1.00 2.84 O ATOM 0 H GLU A 44 -20.153 -2.865 -11.301 1.00 1.52 H new ATOM 0 HA GLU A 44 -20.696 0.026 -11.590 1.00 1.51 H new ATOM 0 HB2 GLU A 44 -20.845 -1.623 -9.036 1.00 1.42 H new ATOM 0 HB3 GLU A 44 -20.969 0.122 -9.123 1.00 1.42 H new ATOM 0 HG2 GLU A 44 -23.026 -0.065 -10.469 1.00 1.69 H new ATOM 0 HG3 GLU A 44 -22.890 -1.812 -10.467 1.00 1.69 H new ATOM 688 N LYS A 45 -18.216 0.181 -11.469 1.00 1.57 N ATOM 689 CA LYS A 45 -16.791 0.434 -11.286 1.00 1.48 C ATOM 690 C LYS A 45 -16.526 1.084 -9.933 1.00 1.22 C ATOM 691 O LYS A 45 -17.434 1.636 -9.310 1.00 1.49 O ATOM 692 CB LYS A 45 -16.262 1.327 -12.411 1.00 1.83 C ATOM 693 CG LYS A 45 -16.562 0.801 -13.807 1.00 2.22 C ATOM 694 CD LYS A 45 -15.970 -0.583 -14.035 1.00 1.95 C ATOM 695 CE LYS A 45 -14.450 -0.565 -13.968 1.00 2.20 C ATOM 696 NZ LYS A 45 -13.866 -1.912 -14.221 1.00 3.04 N ATOM 0 H LYS A 45 -18.635 0.677 -12.256 1.00 1.57 H new ATOM 0 HA LYS A 45 -16.268 -0.522 -11.317 1.00 1.48 H new ATOM 0 HB2 LYS A 45 -16.696 2.322 -12.307 1.00 1.83 H new ATOM 0 HB3 LYS A 45 -15.183 1.436 -12.298 1.00 1.83 H new ATOM 0 HG2 LYS A 45 -17.641 0.763 -13.956 1.00 2.22 H new ATOM 0 HG3 LYS A 45 -16.162 1.493 -14.549 1.00 2.22 H new ATOM 0 HD2 LYS A 45 -16.359 -1.273 -13.286 1.00 1.95 H new ATOM 0 HD3 LYS A 45 -16.287 -0.958 -15.008 1.00 1.95 H new ATOM 0 HE2 LYS A 45 -14.063 0.142 -14.702 1.00 2.20 H new ATOM 0 HE3 LYS A 45 -14.134 -0.211 -12.987 1.00 2.20 H new ATOM 0 HZ1 LYS A 45 -12.829 -1.857 -14.166 1.00 3.04 H new ATOM 0 HZ2 LYS A 45 -14.215 -2.582 -13.506 1.00 3.04 H new ATOM 0 HZ3 LYS A 45 -14.146 -2.239 -15.168 1.00 3.04 H new ATOM 710 N LYS A 46 -15.277 1.016 -9.481 1.00 0.85 N ATOM 711 CA LYS A 46 -14.897 1.592 -8.197 1.00 0.63 C ATOM 712 C LYS A 46 -13.801 2.639 -8.355 1.00 0.59 C ATOM 713 O LYS A 46 -13.422 2.998 -9.471 1.00 0.73 O ATOM 714 CB LYS A 46 -14.435 0.492 -7.240 1.00 0.43 C ATOM 715 CG LYS A 46 -15.579 -0.238 -6.555 1.00 0.49 C ATOM 716 CD LYS A 46 -16.277 0.651 -5.539 1.00 0.75 C ATOM 717 CE LYS A 46 -17.469 -0.053 -4.914 1.00 0.88 C ATOM 718 NZ LYS A 46 -17.061 -1.269 -4.158 1.00 1.71 N ATOM 0 H LYS A 46 -14.512 0.568 -9.985 1.00 0.85 H new ATOM 0 HA LYS A 46 -15.776 2.086 -7.782 1.00 0.63 H new ATOM 0 HB2 LYS A 46 -13.833 -0.230 -7.793 1.00 0.43 H new ATOM 0 HB3 LYS A 46 -13.788 0.931 -6.480 1.00 0.43 H new ATOM 0 HG2 LYS A 46 -16.298 -0.572 -7.303 1.00 0.49 H new ATOM 0 HG3 LYS A 46 -15.197 -1.130 -6.058 1.00 0.49 H new ATOM 0 HD2 LYS A 46 -15.572 0.938 -4.759 1.00 0.75 H new ATOM 0 HD3 LYS A 46 -16.608 1.570 -6.023 1.00 0.75 H new ATOM 0 HE2 LYS A 46 -17.987 0.634 -4.245 1.00 0.88 H new ATOM 0 HE3 LYS A 46 -18.177 -0.331 -5.695 1.00 0.88 H new ATOM 0 HZ1 LYS A 46 -17.896 -1.692 -3.705 1.00 1.71 H new ATOM 0 HZ2 LYS A 46 -16.635 -1.957 -4.811 1.00 1.71 H new ATOM 0 HZ3 LYS A 46 -16.366 -1.008 -3.429 1.00 1.71 H new ATOM 732 N ASP A 47 -13.296 3.121 -7.224 1.00 0.48 N ATOM 733 CA ASP A 47 -12.249 4.135 -7.213 1.00 0.44 C ATOM 734 C ASP A 47 -10.894 3.537 -7.578 1.00 0.39 C ATOM 735 O ASP A 47 -10.536 2.458 -7.112 1.00 0.42 O ATOM 736 CB ASP A 47 -12.167 4.789 -5.834 1.00 0.45 C ATOM 737 CG ASP A 47 -13.457 5.486 -5.448 1.00 1.22 C ATOM 738 OD1 ASP A 47 -14.328 4.829 -4.842 1.00 2.20 O ATOM 739 OD2 ASP A 47 -13.596 6.689 -5.753 1.00 1.14 O ATOM 0 H ASP A 47 -13.598 2.822 -6.297 1.00 0.48 H new ATOM 0 HA ASP A 47 -12.504 4.887 -7.960 1.00 0.44 H new ATOM 0 HB2 ASP A 47 -11.930 4.030 -5.088 1.00 0.45 H new ATOM 0 HB3 ASP A 47 -11.350 5.511 -5.825 1.00 0.45 H new ATOM 744 N LYS A 48 -10.145 4.252 -8.413 1.00 0.37 N ATOM 745 CA LYS A 48 -8.823 3.802 -8.831 1.00 0.34 C ATOM 746 C LYS A 48 -7.738 4.492 -8.011 1.00 0.30 C ATOM 747 O LYS A 48 -7.869 5.665 -7.655 1.00 0.39 O ATOM 748 CB LYS A 48 -8.609 4.074 -10.322 1.00 0.41 C ATOM 749 CG LYS A 48 -9.127 2.966 -11.228 1.00 0.46 C ATOM 750 CD LYS A 48 -10.630 2.777 -11.090 1.00 0.64 C ATOM 751 CE LYS A 48 -11.128 1.635 -11.960 1.00 0.82 C ATOM 752 NZ LYS A 48 -12.589 1.399 -11.790 1.00 1.35 N ATOM 0 H LYS A 48 -10.432 5.145 -8.813 1.00 0.37 H new ATOM 0 HA LYS A 48 -8.759 2.727 -8.660 1.00 0.34 H new ATOM 0 HB2 LYS A 48 -9.104 5.008 -10.586 1.00 0.41 H new ATOM 0 HB3 LYS A 48 -7.544 4.214 -10.507 1.00 0.41 H new ATOM 0 HG2 LYS A 48 -8.884 3.201 -12.264 1.00 0.46 H new ATOM 0 HG3 LYS A 48 -8.620 2.032 -10.986 1.00 0.46 H new ATOM 0 HD2 LYS A 48 -10.879 2.577 -10.048 1.00 0.64 H new ATOM 0 HD3 LYS A 48 -11.141 3.698 -11.369 1.00 0.64 H new ATOM 0 HE2 LYS A 48 -10.916 1.857 -13.006 1.00 0.82 H new ATOM 0 HE3 LYS A 48 -10.582 0.725 -11.711 1.00 0.82 H new ATOM 0 HZ1 LYS A 48 -12.755 0.398 -11.563 1.00 1.35 H new ATOM 0 HZ2 LYS A 48 -12.949 1.993 -11.016 1.00 1.35 H new ATOM 0 HZ3 LYS A 48 -13.085 1.641 -12.672 1.00 1.35 H new ATOM 766 N VAL A 49 -6.670 3.761 -7.712 1.00 0.29 N ATOM 767 CA VAL A 49 -5.570 4.306 -6.923 1.00 0.27 C ATOM 768 C VAL A 49 -4.286 4.388 -7.741 1.00 0.23 C ATOM 769 O VAL A 49 -3.993 3.504 -8.547 1.00 0.28 O ATOM 770 CB VAL A 49 -5.308 3.452 -5.668 1.00 0.31 C ATOM 771 CG1 VAL A 49 -4.309 4.138 -4.749 1.00 0.61 C ATOM 772 CG2 VAL A 49 -6.608 3.168 -4.933 1.00 0.87 C ATOM 0 H VAL A 49 -6.542 2.792 -8.003 1.00 0.29 H new ATOM 0 HA VAL A 49 -5.867 5.310 -6.621 1.00 0.27 H new ATOM 0 HB VAL A 49 -4.880 2.501 -5.985 1.00 0.31 H new ATOM 0 HG11 VAL A 49 -4.139 3.518 -3.869 1.00 0.61 H new ATOM 0 HG12 VAL A 49 -3.367 4.283 -5.279 1.00 0.61 H new ATOM 0 HG13 VAL A 49 -4.704 5.106 -4.440 1.00 0.61 H new ATOM 0 HG21 VAL A 49 -6.402 2.564 -4.050 1.00 0.87 H new ATOM 0 HG22 VAL A 49 -7.068 4.109 -4.630 1.00 0.87 H new ATOM 0 HG23 VAL A 49 -7.288 2.628 -5.592 1.00 0.87 H new ATOM 782 N LEU A 50 -3.524 5.456 -7.525 1.00 0.21 N ATOM 783 CA LEU A 50 -2.264 5.658 -8.229 1.00 0.21 C ATOM 784 C LEU A 50 -1.136 4.917 -7.520 1.00 0.20 C ATOM 785 O LEU A 50 -0.654 5.358 -6.476 1.00 0.26 O ATOM 786 CB LEU A 50 -1.939 7.152 -8.311 1.00 0.24 C ATOM 787 CG LEU A 50 -0.651 7.499 -9.061 1.00 0.29 C ATOM 788 CD1 LEU A 50 -0.804 7.211 -10.546 1.00 0.31 C ATOM 789 CD2 LEU A 50 -0.279 8.956 -8.831 1.00 0.35 C ATOM 0 H LEU A 50 -3.759 6.197 -6.865 1.00 0.21 H new ATOM 0 HA LEU A 50 -2.363 5.261 -9.239 1.00 0.21 H new ATOM 0 HB2 LEU A 50 -2.771 7.662 -8.796 1.00 0.24 H new ATOM 0 HB3 LEU A 50 -1.868 7.548 -7.298 1.00 0.24 H new ATOM 0 HG LEU A 50 0.154 6.874 -8.674 1.00 0.29 H new ATOM 0 HD11 LEU A 50 0.122 7.464 -11.063 1.00 0.31 H new ATOM 0 HD12 LEU A 50 -1.023 6.153 -10.691 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.620 7.809 -10.950 1.00 0.31 H new ATOM 0 HD21 LEU A 50 0.639 9.187 -9.371 1.00 0.35 H new ATOM 0 HD22 LEU A 50 -1.083 9.598 -9.191 1.00 0.35 H new ATOM 0 HD23 LEU A 50 -0.126 9.129 -7.766 1.00 0.35 H new ATOM 801 N LEU A 51 -0.719 3.786 -8.087 1.00 0.20 N ATOM 802 CA LEU A 51 0.350 2.989 -7.492 1.00 0.22 C ATOM 803 C LEU A 51 1.669 3.203 -8.228 1.00 0.23 C ATOM 804 O LEU A 51 1.861 2.701 -9.336 1.00 0.37 O ATOM 805 CB LEU A 51 -0.012 1.497 -7.504 1.00 0.24 C ATOM 806 CG LEU A 51 -1.473 1.154 -7.169 1.00 0.58 C ATOM 807 CD1 LEU A 51 -1.594 -0.305 -6.760 1.00 0.98 C ATOM 808 CD2 LEU A 51 -2.017 2.054 -6.070 1.00 1.50 C ATOM 0 H LEU A 51 -1.102 3.404 -8.951 1.00 0.20 H new ATOM 0 HA LEU A 51 0.469 3.318 -6.459 1.00 0.22 H new ATOM 0 HB2 LEU A 51 0.217 1.096 -8.491 1.00 0.24 H new ATOM 0 HB3 LEU A 51 0.633 0.981 -6.793 1.00 0.24 H new ATOM 0 HG LEU A 51 -2.068 1.322 -8.067 1.00 0.58 H new ATOM 0 HD11 LEU A 51 -2.634 -0.532 -6.526 1.00 0.98 H new ATOM 0 HD12 LEU A 51 -1.259 -0.941 -7.579 1.00 0.98 H new ATOM 0 HD13 LEU A 51 -0.976 -0.489 -5.881 1.00 0.98 H new ATOM 0 HD21 LEU A 51 -3.052 1.785 -5.858 1.00 1.50 H new ATOM 0 HD22 LEU A 51 -1.418 1.930 -5.168 1.00 1.50 H new ATOM 0 HD23 LEU A 51 -1.972 3.093 -6.395 1.00 1.50 H new ATOM 820 N SER A 52 2.577 3.949 -7.604 1.00 0.17 N ATOM 821 CA SER A 52 3.881 4.229 -8.200 1.00 0.18 C ATOM 822 C SER A 52 4.944 3.278 -7.655 1.00 0.20 C ATOM 823 O SER A 52 4.974 2.987 -6.460 1.00 0.28 O ATOM 824 CB SER A 52 4.288 5.677 -7.926 1.00 0.18 C ATOM 825 OG SER A 52 5.546 5.974 -8.508 1.00 1.18 O ATOM 0 H SER A 52 2.434 4.370 -6.686 1.00 0.17 H new ATOM 0 HA SER A 52 3.801 4.078 -9.277 1.00 0.18 H new ATOM 0 HB2 SER A 52 3.531 6.352 -8.325 1.00 0.18 H new ATOM 0 HB3 SER A 52 4.332 5.848 -6.850 1.00 0.18 H new ATOM 0 HG SER A 52 6.228 6.021 -7.806 1.00 1.18 H new ATOM 831 N TYR A 53 5.815 2.797 -8.540 1.00 0.19 N ATOM 832 CA TYR A 53 6.878 1.878 -8.143 1.00 0.21 C ATOM 833 C TYR A 53 8.178 2.629 -7.865 1.00 0.20 C ATOM 834 O TYR A 53 8.421 3.695 -8.428 1.00 0.21 O ATOM 835 CB TYR A 53 7.109 0.826 -9.229 1.00 0.25 C ATOM 836 CG TYR A 53 5.889 -0.014 -9.529 1.00 0.36 C ATOM 837 CD1 TYR A 53 4.928 0.420 -10.433 1.00 0.52 C ATOM 838 CD2 TYR A 53 5.694 -1.240 -8.904 1.00 0.52 C ATOM 839 CE1 TYR A 53 3.810 -0.342 -10.709 1.00 0.65 C ATOM 840 CE2 TYR A 53 4.579 -2.008 -9.175 1.00 0.64 C ATOM 841 CZ TYR A 53 3.640 -1.556 -10.078 1.00 0.66 C ATOM 842 OH TYR A 53 2.527 -2.318 -10.350 1.00 0.82 O ATOM 0 H TYR A 53 5.805 3.028 -9.533 1.00 0.19 H new ATOM 0 HA TYR A 53 6.563 1.381 -7.226 1.00 0.21 H new ATOM 0 HB2 TYR A 53 7.430 1.325 -10.144 1.00 0.25 H new ATOM 0 HB3 TYR A 53 7.924 0.171 -8.921 1.00 0.25 H new ATOM 0 HD1 TYR A 53 5.057 1.371 -10.929 1.00 0.52 H new ATOM 0 HD2 TYR A 53 6.426 -1.598 -8.195 1.00 0.52 H new ATOM 0 HE1 TYR A 53 3.073 0.011 -11.415 1.00 0.65 H new ATOM 0 HE2 TYR A 53 4.443 -2.959 -8.682 1.00 0.64 H new ATOM 0 HH TYR A 53 2.560 -3.144 -9.824 1.00 0.82 H new ATOM 852 N TYR A 54 9.008 2.061 -6.994 1.00 0.21 N ATOM 853 CA TYR A 54 10.286 2.673 -6.642 1.00 0.22 C ATOM 854 C TYR A 54 11.371 1.612 -6.476 1.00 0.25 C ATOM 855 O TYR A 54 11.096 0.490 -6.053 1.00 0.31 O ATOM 856 CB TYR A 54 10.156 3.480 -5.348 1.00 0.22 C ATOM 857 CG TYR A 54 9.376 4.766 -5.498 1.00 0.23 C ATOM 858 CD1 TYR A 54 7.991 4.777 -5.390 1.00 0.22 C ATOM 859 CD2 TYR A 54 10.024 5.970 -5.741 1.00 0.31 C ATOM 860 CE1 TYR A 54 7.276 5.953 -5.520 1.00 0.25 C ATOM 861 CE2 TYR A 54 9.316 7.149 -5.871 1.00 0.35 C ATOM 862 CZ TYR A 54 7.942 7.134 -5.760 1.00 0.30 C ATOM 863 OH TYR A 54 7.232 8.306 -5.889 1.00 0.35 O ATOM 0 H TYR A 54 8.819 1.178 -6.519 1.00 0.21 H new ATOM 0 HA TYR A 54 10.570 3.342 -7.454 1.00 0.22 H new ATOM 0 HB2 TYR A 54 9.672 2.860 -4.593 1.00 0.22 H new ATOM 0 HB3 TYR A 54 11.154 3.714 -4.977 1.00 0.22 H new ATOM 0 HD1 TYR A 54 7.465 3.853 -5.202 1.00 0.22 H new ATOM 0 HD2 TYR A 54 11.100 5.985 -5.830 1.00 0.31 H new ATOM 0 HE1 TYR A 54 6.199 5.945 -5.434 1.00 0.25 H new ATOM 0 HE2 TYR A 54 9.836 8.077 -6.058 1.00 0.35 H new ATOM 0 HH TYR A 54 7.851 9.047 -6.054 1.00 0.35 H new ATOM 873 N GLU A 55 12.605 1.979 -6.811 1.00 0.26 N ATOM 874 CA GLU A 55 13.736 1.064 -6.691 1.00 0.30 C ATOM 875 C GLU A 55 14.679 1.515 -5.581 1.00 0.33 C ATOM 876 O GLU A 55 15.374 2.522 -5.716 1.00 0.53 O ATOM 877 CB GLU A 55 14.497 0.971 -8.017 1.00 0.44 C ATOM 878 CG GLU A 55 13.851 0.040 -9.029 1.00 1.14 C ATOM 879 CD GLU A 55 14.660 -0.090 -10.304 1.00 1.52 C ATOM 880 OE1 GLU A 55 15.589 -0.923 -10.339 1.00 2.05 O ATOM 881 OE2 GLU A 55 14.366 0.646 -11.270 1.00 1.73 O ATOM 0 H GLU A 55 12.847 2.903 -7.168 1.00 0.26 H new ATOM 0 HA GLU A 55 13.346 0.078 -6.439 1.00 0.30 H new ATOM 0 HB2 GLU A 55 14.575 1.968 -8.452 1.00 0.44 H new ATOM 0 HB3 GLU A 55 15.513 0.629 -7.819 1.00 0.44 H new ATOM 0 HG2 GLU A 55 13.725 -0.946 -8.581 1.00 1.14 H new ATOM 0 HG3 GLU A 55 12.855 0.409 -9.272 1.00 1.14 H new ATOM 888 N SER A 56 14.695 0.766 -4.483 1.00 0.45 N ATOM 889 CA SER A 56 15.555 1.090 -3.352 1.00 0.57 C ATOM 890 C SER A 56 16.829 0.254 -3.378 1.00 0.83 C ATOM 891 O SER A 56 16.836 -0.901 -2.951 1.00 1.21 O ATOM 892 CB SER A 56 14.809 0.861 -2.034 1.00 0.71 C ATOM 893 OG SER A 56 15.630 1.168 -0.922 1.00 1.19 O ATOM 0 H SER A 56 14.123 -0.068 -4.353 1.00 0.45 H new ATOM 0 HA SER A 56 15.831 2.142 -3.429 1.00 0.57 H new ATOM 0 HB2 SER A 56 13.912 1.479 -2.009 1.00 0.71 H new ATOM 0 HB3 SER A 56 14.483 -0.177 -1.973 1.00 0.71 H new ATOM 0 HG SER A 56 15.129 1.015 -0.094 1.00 1.19 H new ATOM 899 N GLN A 57 17.908 0.847 -3.879 1.00 0.92 N ATOM 900 CA GLN A 57 19.191 0.160 -3.960 1.00 1.22 C ATOM 901 C GLN A 57 20.197 0.776 -2.992 1.00 1.17 C ATOM 902 O GLN A 57 20.420 1.986 -3.000 1.00 1.33 O ATOM 903 CB GLN A 57 19.735 0.209 -5.392 1.00 1.70 C ATOM 904 CG GLN A 57 19.859 1.616 -5.954 1.00 1.81 C ATOM 905 CD GLN A 57 20.379 1.633 -7.381 1.00 2.29 C ATOM 906 OE1 GLN A 57 21.054 2.575 -7.794 1.00 2.89 O ATOM 907 NE2 GLN A 57 20.061 0.593 -8.142 1.00 2.56 N ATOM 0 H GLN A 57 17.919 1.803 -4.235 1.00 0.92 H new ATOM 0 HA GLN A 57 19.037 -0.882 -3.679 1.00 1.22 H new ATOM 0 HB2 GLN A 57 20.714 -0.269 -5.415 1.00 1.70 H new ATOM 0 HB3 GLN A 57 19.080 -0.374 -6.039 1.00 1.70 H new ATOM 0 HG2 GLN A 57 18.885 2.103 -5.921 1.00 1.81 H new ATOM 0 HG3 GLN A 57 20.528 2.198 -5.321 1.00 1.81 H new ATOM 0 HE21 GLN A 57 19.499 -0.167 -7.758 1.00 2.56 H new ATOM 0 HE22 GLN A 57 20.379 0.554 -9.110 1.00 2.56 H new ATOM 916 N HIS A 58 20.796 -0.063 -2.154 1.00 1.16 N ATOM 917 CA HIS A 58 21.778 0.401 -1.182 1.00 1.25 C ATOM 918 C HIS A 58 23.100 0.748 -1.870 1.00 1.32 C ATOM 919 O HIS A 58 23.683 -0.089 -2.558 1.00 1.40 O ATOM 920 CB HIS A 58 22.011 -0.669 -0.112 1.00 1.42 C ATOM 921 CG HIS A 58 20.798 -0.965 0.712 1.00 1.68 C ATOM 922 ND1 HIS A 58 20.044 -2.110 0.562 1.00 2.18 N ATOM 923 CD2 HIS A 58 20.207 -0.257 1.707 1.00 2.23 C ATOM 924 CE1 HIS A 58 19.045 -2.095 1.424 1.00 2.52 C ATOM 925 NE2 HIS A 58 19.121 -0.983 2.131 1.00 2.46 N ATOM 0 H HIS A 58 20.619 -1.067 -2.129 1.00 1.16 H new ATOM 0 HA HIS A 58 21.388 1.301 -0.706 1.00 1.25 H new ATOM 0 HB2 HIS A 58 22.345 -1.587 -0.595 1.00 1.42 H new ATOM 0 HB3 HIS A 58 22.817 -0.344 0.546 1.00 1.42 H new ATOM 0 HD2 HIS A 58 20.530 0.698 2.093 1.00 2.23 H new ATOM 0 HE1 HIS A 58 18.293 -2.862 1.533 1.00 2.52 H new ATOM 0 HE2 HIS A 58 18.477 -0.707 2.873 1.00 2.46 H new ATOM 934 N PRO A 59 23.592 1.993 -1.694 1.00 1.53 N ATOM 935 CA PRO A 59 24.850 2.440 -2.310 1.00 1.67 C ATOM 936 C PRO A 59 26.038 1.578 -1.895 1.00 1.84 C ATOM 937 O PRO A 59 27.107 1.650 -2.500 1.00 2.52 O ATOM 938 CB PRO A 59 25.022 3.872 -1.793 1.00 2.10 C ATOM 939 CG PRO A 59 23.657 4.300 -1.378 1.00 2.33 C ATOM 940 CD PRO A 59 22.973 3.059 -0.886 1.00 1.88 C ATOM 0 HA PRO A 59 24.812 2.371 -3.397 1.00 1.67 H new ATOM 0 HB2 PRO A 59 25.718 3.908 -0.955 1.00 2.10 H new ATOM 0 HB3 PRO A 59 25.422 4.526 -2.568 1.00 2.10 H new ATOM 0 HG2 PRO A 59 23.705 5.057 -0.595 1.00 2.33 H new ATOM 0 HG3 PRO A 59 23.114 4.741 -2.214 1.00 2.33 H new ATOM 0 HD2 PRO A 59 23.138 2.904 0.180 1.00 1.88 H new ATOM 0 HD3 PRO A 59 21.895 3.106 -1.038 1.00 1.88 H new ATOM 948 N SER A 60 25.843 0.771 -0.858 1.00 1.87 N ATOM 949 CA SER A 60 26.895 -0.107 -0.364 1.00 2.25 C ATOM 950 C SER A 60 26.809 -1.480 -1.025 1.00 2.28 C ATOM 951 O SER A 60 27.087 -2.502 -0.398 1.00 2.89 O ATOM 952 CB SER A 60 26.797 -0.249 1.155 1.00 2.98 C ATOM 953 OG SER A 60 26.937 1.008 1.795 1.00 3.59 O ATOM 0 H SER A 60 24.965 0.707 -0.343 1.00 1.87 H new ATOM 0 HA SER A 60 27.857 0.338 -0.617 1.00 2.25 H new ATOM 0 HB2 SER A 60 25.837 -0.691 1.421 1.00 2.98 H new ATOM 0 HB3 SER A 60 27.571 -0.930 1.510 1.00 2.98 H new ATOM 0 HG SER A 60 26.869 0.890 2.766 1.00 3.59 H new ATOM 959 N ASN A 61 26.420 -1.492 -2.297 1.00 2.36 N ATOM 960 CA ASN A 61 26.292 -2.737 -3.049 1.00 2.83 C ATOM 961 C ASN A 61 27.593 -3.066 -3.774 1.00 3.18 C ATOM 962 O ASN A 61 27.854 -2.552 -4.863 1.00 3.77 O ATOM 963 CB ASN A 61 25.143 -2.632 -4.054 1.00 3.70 C ATOM 964 CG ASN A 61 24.900 -3.930 -4.800 1.00 4.39 C ATOM 965 OD1 ASN A 61 24.498 -3.924 -5.963 1.00 4.96 O ATOM 966 ND2 ASN A 61 25.137 -5.053 -4.131 1.00 4.80 N ATOM 0 H ASN A 61 26.188 -0.653 -2.829 1.00 2.36 H new ATOM 0 HA ASN A 61 26.076 -3.541 -2.346 1.00 2.83 H new ATOM 0 HB2 ASN A 61 24.232 -2.342 -3.530 1.00 3.70 H new ATOM 0 HB3 ASN A 61 25.363 -1.841 -4.771 1.00 3.70 H new ATOM 0 HD21 ASN A 61 24.986 -5.956 -4.581 1.00 4.80 H new ATOM 0 HD22 ASN A 61 25.470 -5.012 -3.168 1.00 4.80 H new ATOM 973 N GLU A 62 28.405 -3.924 -3.164 1.00 3.41 N ATOM 974 CA GLU A 62 29.679 -4.320 -3.755 1.00 4.31 C ATOM 975 C GLU A 62 29.581 -5.707 -4.385 1.00 4.66 C ATOM 976 O GLU A 62 29.976 -5.905 -5.534 1.00 5.26 O ATOM 977 CB GLU A 62 30.783 -4.307 -2.695 1.00 5.11 C ATOM 978 CG GLU A 62 30.957 -2.959 -2.014 1.00 6.02 C ATOM 979 CD GLU A 62 31.308 -1.852 -2.991 1.00 6.49 C ATOM 980 OE1 GLU A 62 32.513 -1.648 -3.245 1.00 6.66 O ATOM 981 OE2 GLU A 62 30.379 -1.193 -3.500 1.00 6.92 O ATOM 0 H GLU A 62 28.204 -4.358 -2.263 1.00 3.41 H new ATOM 0 HA GLU A 62 29.926 -3.602 -4.537 1.00 4.31 H new ATOM 0 HB2 GLU A 62 30.559 -5.060 -1.940 1.00 5.11 H new ATOM 0 HB3 GLU A 62 31.726 -4.594 -3.161 1.00 5.11 H new ATOM 0 HG2 GLU A 62 30.037 -2.699 -1.491 1.00 6.02 H new ATOM 0 HG3 GLU A 62 31.741 -3.035 -1.260 1.00 6.02 H new ATOM 988 N SER A 63 29.051 -6.660 -3.625 1.00 4.71 N ATOM 989 CA SER A 63 28.901 -8.028 -4.108 1.00 5.40 C ATOM 990 C SER A 63 27.508 -8.251 -4.690 1.00 5.72 C ATOM 991 O SER A 63 26.570 -8.591 -3.969 1.00 6.12 O ATOM 992 CB SER A 63 29.158 -9.023 -2.975 1.00 6.13 C ATOM 993 OG SER A 63 29.015 -10.358 -3.427 1.00 6.64 O ATOM 0 H SER A 63 28.718 -6.510 -2.672 1.00 4.71 H new ATOM 0 HA SER A 63 29.635 -8.190 -4.897 1.00 5.40 H new ATOM 0 HB2 SER A 63 30.162 -8.876 -2.578 1.00 6.13 H new ATOM 0 HB3 SER A 63 28.462 -8.836 -2.157 1.00 6.13 H new ATOM 0 HG SER A 63 29.186 -10.975 -2.685 1.00 6.64 H new ATOM 999 N GLY A 64 27.382 -8.056 -5.999 1.00 5.83 N ATOM 1000 CA GLY A 64 26.101 -8.240 -6.659 1.00 6.37 C ATOM 1001 C GLY A 64 26.052 -9.511 -7.486 1.00 6.20 C ATOM 1002 O GLY A 64 25.858 -10.600 -6.947 1.00 6.52 O ATOM 0 H GLY A 64 28.144 -7.774 -6.615 1.00 5.83 H new ATOM 0 HA2 GLY A 64 25.310 -8.267 -5.909 1.00 6.37 H new ATOM 0 HA3 GLY A 64 25.901 -7.383 -7.303 1.00 6.37 H new ATOM 1006 N ASP A 65 26.229 -9.368 -8.797 1.00 5.88 N ATOM 1007 CA ASP A 65 26.210 -10.509 -9.708 1.00 5.83 C ATOM 1008 C ASP A 65 24.884 -11.259 -9.622 1.00 5.38 C ATOM 1009 O ASP A 65 24.746 -12.211 -8.853 1.00 5.77 O ATOM 1010 CB ASP A 65 27.370 -11.459 -9.396 1.00 6.69 C ATOM 1011 CG ASP A 65 28.716 -10.762 -9.441 1.00 7.43 C ATOM 1012 OD1 ASP A 65 29.109 -10.165 -8.418 1.00 8.04 O ATOM 1013 OD2 ASP A 65 29.377 -10.815 -10.499 1.00 7.57 O ATOM 0 H ASP A 65 26.388 -8.470 -9.253 1.00 5.88 H new ATOM 0 HA ASP A 65 26.323 -10.129 -10.723 1.00 5.83 H new ATOM 0 HB2 ASP A 65 27.223 -11.896 -8.408 1.00 6.69 H new ATOM 0 HB3 ASP A 65 27.365 -12.281 -10.112 1.00 6.69 H new ATOM 1018 N GLY A 66 23.911 -10.824 -10.418 1.00 4.75 N ATOM 1019 CA GLY A 66 22.610 -11.464 -10.418 1.00 4.50 C ATOM 1020 C GLY A 66 21.606 -10.738 -11.293 1.00 4.15 C ATOM 1021 O GLY A 66 21.966 -10.188 -12.334 1.00 4.62 O ATOM 0 H GLY A 66 24.002 -10.039 -11.063 1.00 4.75 H new ATOM 0 HA2 GLY A 66 22.714 -12.492 -10.766 1.00 4.50 H new ATOM 0 HA3 GLY A 66 22.231 -11.510 -9.397 1.00 4.50 H new ATOM 1025 N VAL A 67 20.346 -10.736 -10.869 1.00 3.74 N ATOM 1026 CA VAL A 67 19.287 -10.073 -11.621 1.00 3.83 C ATOM 1027 C VAL A 67 18.627 -8.975 -10.791 1.00 3.19 C ATOM 1028 O VAL A 67 17.422 -8.741 -10.901 1.00 3.45 O ATOM 1029 CB VAL A 67 18.215 -11.074 -12.091 1.00 4.57 C ATOM 1030 CG1 VAL A 67 18.791 -12.030 -13.122 1.00 5.42 C ATOM 1031 CG2 VAL A 67 17.639 -11.840 -10.908 1.00 4.44 C ATOM 0 H VAL A 67 20.034 -11.186 -10.009 1.00 3.74 H new ATOM 0 HA VAL A 67 19.755 -9.625 -12.498 1.00 3.83 H new ATOM 0 HB VAL A 67 17.406 -10.514 -12.560 1.00 4.57 H new ATOM 0 HG11 VAL A 67 18.018 -12.729 -13.442 1.00 5.42 H new ATOM 0 HG12 VAL A 67 19.148 -11.465 -13.983 1.00 5.42 H new ATOM 0 HG13 VAL A 67 19.621 -12.583 -12.682 1.00 5.42 H new ATOM 0 HG21 VAL A 67 16.884 -12.542 -11.262 1.00 4.44 H new ATOM 0 HG22 VAL A 67 18.437 -12.388 -10.406 1.00 4.44 H new ATOM 0 HG23 VAL A 67 17.184 -11.140 -10.208 1.00 4.44 H new ATOM 1041 N ASP A 68 19.427 -8.310 -9.962 1.00 2.69 N ATOM 1042 CA ASP A 68 18.935 -7.231 -9.110 1.00 2.47 C ATOM 1043 C ASP A 68 17.847 -7.729 -8.162 1.00 1.74 C ATOM 1044 O ASP A 68 16.661 -7.698 -8.489 1.00 2.03 O ATOM 1045 CB ASP A 68 18.399 -6.080 -9.962 1.00 3.50 C ATOM 1046 CG ASP A 68 19.439 -5.539 -10.925 1.00 4.42 C ATOM 1047 OD1 ASP A 68 19.568 -6.097 -12.033 1.00 4.69 O ATOM 1048 OD2 ASP A 68 20.123 -4.557 -10.567 1.00 5.19 O ATOM 0 H ASP A 68 20.424 -8.501 -9.862 1.00 2.69 H new ATOM 0 HA ASP A 68 19.772 -6.871 -8.511 1.00 2.47 H new ATOM 0 HB2 ASP A 68 17.530 -6.422 -10.525 1.00 3.50 H new ATOM 0 HB3 ASP A 68 18.060 -5.276 -9.309 1.00 3.50 H new ATOM 1053 N GLY A 69 18.260 -8.187 -6.984 1.00 1.09 N ATOM 1054 CA GLY A 69 17.310 -8.682 -6.004 1.00 0.76 C ATOM 1055 C GLY A 69 16.970 -7.645 -4.953 1.00 0.68 C ATOM 1056 O GLY A 69 16.773 -7.975 -3.784 1.00 0.66 O ATOM 0 H GLY A 69 19.236 -8.224 -6.691 1.00 1.09 H new ATOM 0 HA2 GLY A 69 16.397 -8.993 -6.512 1.00 0.76 H new ATOM 0 HA3 GLY A 69 17.722 -9.567 -5.518 1.00 0.76 H new ATOM 1060 N LYS A 70 16.900 -6.385 -5.373 1.00 0.67 N ATOM 1061 CA LYS A 70 16.583 -5.288 -4.466 1.00 0.60 C ATOM 1062 C LYS A 70 15.076 -5.176 -4.255 1.00 0.51 C ATOM 1063 O LYS A 70 14.295 -5.381 -5.184 1.00 0.50 O ATOM 1064 CB LYS A 70 17.133 -3.973 -5.022 1.00 0.66 C ATOM 1065 CG LYS A 70 18.644 -3.963 -5.197 1.00 0.76 C ATOM 1066 CD LYS A 70 19.360 -3.619 -3.898 1.00 1.25 C ATOM 1067 CE LYS A 70 19.689 -4.863 -3.086 1.00 1.58 C ATOM 1068 NZ LYS A 70 20.757 -5.680 -3.728 1.00 2.43 N ATOM 0 H LYS A 70 17.059 -6.099 -6.339 1.00 0.67 H new ATOM 0 HA LYS A 70 17.050 -5.493 -3.503 1.00 0.60 H new ATOM 0 HB2 LYS A 70 16.664 -3.773 -5.985 1.00 0.66 H new ATOM 0 HB3 LYS A 70 16.849 -3.160 -4.354 1.00 0.66 H new ATOM 0 HG2 LYS A 70 18.976 -4.940 -5.548 1.00 0.76 H new ATOM 0 HG3 LYS A 70 18.916 -3.239 -5.965 1.00 0.76 H new ATOM 0 HD2 LYS A 70 20.279 -3.078 -4.122 1.00 1.25 H new ATOM 0 HD3 LYS A 70 18.735 -2.952 -3.304 1.00 1.25 H new ATOM 0 HE2 LYS A 70 20.008 -4.570 -2.086 1.00 1.58 H new ATOM 0 HE3 LYS A 70 18.790 -5.468 -2.969 1.00 1.58 H new ATOM 0 HZ1 LYS A 70 21.188 -6.307 -3.019 1.00 2.43 H new ATOM 0 HZ2 LYS A 70 20.344 -6.253 -4.492 1.00 2.43 H new ATOM 0 HZ3 LYS A 70 21.485 -5.051 -4.122 1.00 2.43 H new ATOM 1082 N MET A 71 14.676 -4.851 -3.030 1.00 0.45 N ATOM 1083 CA MET A 71 13.260 -4.715 -2.700 1.00 0.36 C ATOM 1084 C MET A 71 12.658 -3.489 -3.379 1.00 0.33 C ATOM 1085 O MET A 71 13.215 -2.393 -3.314 1.00 0.36 O ATOM 1086 CB MET A 71 13.070 -4.627 -1.184 1.00 0.35 C ATOM 1087 CG MET A 71 13.724 -3.408 -0.552 1.00 0.39 C ATOM 1088 SD MET A 71 13.486 -3.343 1.235 1.00 0.40 S ATOM 1089 CE MET A 71 14.274 -1.783 1.628 1.00 0.47 C ATOM 0 H MET A 71 15.310 -4.677 -2.250 1.00 0.45 H new ATOM 0 HA MET A 71 12.741 -5.600 -3.068 1.00 0.36 H new ATOM 0 HB2 MET A 71 12.003 -4.611 -0.961 1.00 0.35 H new ATOM 0 HB3 MET A 71 13.479 -5.526 -0.723 1.00 0.35 H new ATOM 0 HG2 MET A 71 14.791 -3.417 -0.773 1.00 0.39 H new ATOM 0 HG3 MET A 71 13.313 -2.505 -1.003 1.00 0.39 H new ATOM 0 HE1 MET A 71 14.208 -1.602 2.701 1.00 0.47 H new ATOM 0 HE2 MET A 71 15.322 -1.819 1.330 1.00 0.47 H new ATOM 0 HE3 MET A 71 13.772 -0.977 1.093 1.00 0.47 H new ATOM 1099 N LEU A 72 11.517 -3.683 -4.032 1.00 0.30 N ATOM 1100 CA LEU A 72 10.835 -2.595 -4.725 1.00 0.29 C ATOM 1101 C LEU A 72 9.789 -1.941 -3.828 1.00 0.28 C ATOM 1102 O LEU A 72 8.954 -2.625 -3.235 1.00 0.33 O ATOM 1103 CB LEU A 72 10.164 -3.117 -5.998 1.00 0.29 C ATOM 1104 CG LEU A 72 11.112 -3.700 -7.047 1.00 0.32 C ATOM 1105 CD1 LEU A 72 10.326 -4.357 -8.170 1.00 0.34 C ATOM 1106 CD2 LEU A 72 12.025 -2.617 -7.601 1.00 0.34 C ATOM 0 H LEU A 72 11.044 -4.585 -4.096 1.00 0.30 H new ATOM 0 HA LEU A 72 11.582 -1.846 -4.988 1.00 0.29 H new ATOM 0 HB2 LEU A 72 9.442 -3.884 -5.719 1.00 0.29 H new ATOM 0 HB3 LEU A 72 9.603 -2.301 -6.453 1.00 0.29 H new ATOM 0 HG LEU A 72 11.729 -4.460 -6.567 1.00 0.32 H new ATOM 0 HD11 LEU A 72 11.017 -4.766 -8.907 1.00 0.34 H new ATOM 0 HD12 LEU A 72 9.712 -5.161 -7.763 1.00 0.34 H new ATOM 0 HD13 LEU A 72 9.684 -3.616 -8.647 1.00 0.34 H new ATOM 0 HD21 LEU A 72 12.693 -3.050 -8.346 1.00 0.34 H new ATOM 0 HD22 LEU A 72 11.423 -1.835 -8.064 1.00 0.34 H new ATOM 0 HD23 LEU A 72 12.615 -2.189 -6.791 1.00 0.34 H new ATOM 1118 N MET A 73 9.840 -0.616 -3.732 1.00 0.26 N ATOM 1119 CA MET A 73 8.886 0.128 -2.916 1.00 0.26 C ATOM 1120 C MET A 73 7.685 0.546 -3.757 1.00 0.21 C ATOM 1121 O MET A 73 7.735 0.499 -4.987 1.00 0.20 O ATOM 1122 CB MET A 73 9.550 1.360 -2.299 1.00 0.30 C ATOM 1123 CG MET A 73 10.722 1.033 -1.387 1.00 0.36 C ATOM 1124 SD MET A 73 11.404 2.494 -0.578 1.00 1.17 S ATOM 1125 CE MET A 73 11.945 3.450 -1.993 1.00 0.80 C ATOM 0 H MET A 73 10.531 -0.036 -4.208 1.00 0.26 H new ATOM 0 HA MET A 73 8.544 -0.521 -2.110 1.00 0.26 H new ATOM 0 HB2 MET A 73 9.896 2.014 -3.099 1.00 0.30 H new ATOM 0 HB3 MET A 73 8.805 1.917 -1.732 1.00 0.30 H new ATOM 0 HG2 MET A 73 10.399 0.320 -0.628 1.00 0.36 H new ATOM 0 HG3 MET A 73 11.505 0.546 -1.969 1.00 0.36 H new ATOM 0 HE1 MET A 73 12.847 4.004 -1.734 1.00 0.80 H new ATOM 0 HE2 MET A 73 12.157 2.779 -2.826 1.00 0.80 H new ATOM 0 HE3 MET A 73 11.160 4.149 -2.281 1.00 0.80 H new ATOM 1135 N VAL A 74 6.610 0.958 -3.095 1.00 0.20 N ATOM 1136 CA VAL A 74 5.400 1.374 -3.794 1.00 0.16 C ATOM 1137 C VAL A 74 4.609 2.397 -2.986 1.00 0.17 C ATOM 1138 O VAL A 74 4.522 2.308 -1.761 1.00 0.24 O ATOM 1139 CB VAL A 74 4.486 0.169 -4.107 1.00 0.18 C ATOM 1140 CG1 VAL A 74 4.057 -0.532 -2.829 1.00 0.26 C ATOM 1141 CG2 VAL A 74 3.273 0.608 -4.912 1.00 0.14 C ATOM 0 H VAL A 74 6.551 1.013 -2.078 1.00 0.20 H new ATOM 0 HA VAL A 74 5.725 1.831 -4.729 1.00 0.16 H new ATOM 0 HB VAL A 74 5.056 -0.540 -4.707 1.00 0.18 H new ATOM 0 HG11 VAL A 74 3.414 -1.377 -3.076 1.00 0.26 H new ATOM 0 HG12 VAL A 74 4.938 -0.890 -2.297 1.00 0.26 H new ATOM 0 HG13 VAL A 74 3.510 0.167 -2.196 1.00 0.26 H new ATOM 0 HG21 VAL A 74 2.643 -0.256 -5.121 1.00 0.14 H new ATOM 0 HG22 VAL A 74 2.704 1.342 -4.342 1.00 0.14 H new ATOM 0 HG23 VAL A 74 3.601 1.054 -5.851 1.00 0.14 H new ATOM 1151 N THR A 75 4.041 3.370 -3.690 1.00 0.12 N ATOM 1152 CA THR A 75 3.234 4.405 -3.062 1.00 0.12 C ATOM 1153 C THR A 75 1.817 4.369 -3.620 1.00 0.11 C ATOM 1154 O THR A 75 1.623 4.295 -4.834 1.00 0.11 O ATOM 1155 CB THR A 75 3.828 5.809 -3.282 1.00 0.16 C ATOM 1156 OG1 THR A 75 3.925 6.086 -4.685 1.00 0.18 O ATOM 1157 CG2 THR A 75 5.203 5.923 -2.643 1.00 0.18 C ATOM 0 H THR A 75 4.127 3.462 -4.702 1.00 0.12 H new ATOM 0 HA THR A 75 3.222 4.204 -1.991 1.00 0.12 H new ATOM 0 HB THR A 75 3.165 6.536 -2.812 1.00 0.16 H new ATOM 0 HG1 THR A 75 4.302 6.981 -4.816 1.00 0.18 H new ATOM 0 HG21 THR A 75 5.601 6.923 -2.812 1.00 0.18 H new ATOM 0 HG22 THR A 75 5.122 5.741 -1.571 1.00 0.18 H new ATOM 0 HG23 THR A 75 5.873 5.186 -3.087 1.00 0.18 H new ATOM 1165 N LEU A 76 0.831 4.421 -2.734 1.00 0.12 N ATOM 1166 CA LEU A 76 -0.566 4.376 -3.148 1.00 0.14 C ATOM 1167 C LEU A 76 -1.256 5.708 -2.885 1.00 0.14 C ATOM 1168 O LEU A 76 -1.303 6.181 -1.750 1.00 0.18 O ATOM 1169 CB LEU A 76 -1.291 3.242 -2.415 1.00 0.18 C ATOM 1170 CG LEU A 76 -0.433 2.000 -2.131 1.00 0.16 C ATOM 1171 CD1 LEU A 76 -1.243 0.937 -1.408 1.00 0.21 C ATOM 1172 CD2 LEU A 76 0.135 1.429 -3.419 1.00 0.16 C ATOM 0 H LEU A 76 0.972 4.494 -1.726 1.00 0.12 H new ATOM 0 HA LEU A 76 -0.603 4.186 -4.221 1.00 0.14 H new ATOM 0 HB2 LEU A 76 -1.672 3.626 -1.469 1.00 0.18 H new ATOM 0 HB3 LEU A 76 -2.155 2.941 -3.007 1.00 0.18 H new ATOM 0 HG LEU A 76 0.393 2.307 -1.490 1.00 0.16 H new ATOM 0 HD11 LEU A 76 -0.614 0.067 -1.218 1.00 0.21 H new ATOM 0 HD12 LEU A 76 -1.605 1.337 -0.461 1.00 0.21 H new ATOM 0 HD13 LEU A 76 -2.091 0.643 -2.026 1.00 0.21 H new ATOM 0 HD21 LEU A 76 0.739 0.550 -3.192 1.00 0.16 H new ATOM 0 HD22 LEU A 76 -0.682 1.146 -4.083 1.00 0.16 H new ATOM 0 HD23 LEU A 76 0.756 2.180 -3.907 1.00 0.16 H new ATOM 1184 N SER A 77 -1.786 6.314 -3.946 1.00 0.20 N ATOM 1185 CA SER A 77 -2.473 7.596 -3.832 1.00 0.23 C ATOM 1186 C SER A 77 -3.821 7.565 -4.551 1.00 0.23 C ATOM 1187 O SER A 77 -3.891 7.805 -5.757 1.00 0.19 O ATOM 1188 CB SER A 77 -1.602 8.715 -4.410 1.00 0.26 C ATOM 1189 OG SER A 77 -2.247 9.972 -4.303 1.00 0.29 O ATOM 0 H SER A 77 -1.752 5.937 -4.893 1.00 0.20 H new ATOM 0 HA SER A 77 -2.653 7.788 -2.774 1.00 0.23 H new ATOM 0 HB2 SER A 77 -0.648 8.746 -3.883 1.00 0.26 H new ATOM 0 HB3 SER A 77 -1.381 8.504 -5.456 1.00 0.26 H new ATOM 0 HG SER A 77 -2.927 10.051 -5.004 1.00 0.29 H new ATOM 1195 N PRO A 78 -4.915 7.263 -3.823 1.00 0.30 N ATOM 1196 CA PRO A 78 -6.259 7.210 -4.408 1.00 0.33 C ATOM 1197 C PRO A 78 -6.773 8.598 -4.774 1.00 0.34 C ATOM 1198 O PRO A 78 -7.803 8.737 -5.433 1.00 0.41 O ATOM 1199 CB PRO A 78 -7.109 6.604 -3.290 1.00 0.39 C ATOM 1200 CG PRO A 78 -6.393 6.964 -2.036 1.00 0.41 C ATOM 1201 CD PRO A 78 -4.930 6.945 -2.381 1.00 0.37 C ATOM 0 HA PRO A 78 -6.283 6.637 -5.335 1.00 0.33 H new ATOM 0 HB2 PRO A 78 -8.121 7.008 -3.298 1.00 0.39 H new ATOM 0 HB3 PRO A 78 -7.196 5.523 -3.400 1.00 0.39 H new ATOM 0 HG2 PRO A 78 -6.698 7.948 -1.680 1.00 0.41 H new ATOM 0 HG3 PRO A 78 -6.617 6.254 -1.240 1.00 0.41 H new ATOM 0 HD2 PRO A 78 -4.371 7.680 -1.802 1.00 0.37 H new ATOM 0 HD3 PRO A 78 -4.482 5.972 -2.179 1.00 0.37 H new ATOM 1209 N THR A 79 -6.044 9.621 -4.339 1.00 0.34 N ATOM 1210 CA THR A 79 -6.414 11.002 -4.616 1.00 0.37 C ATOM 1211 C THR A 79 -5.271 11.742 -5.308 1.00 0.36 C ATOM 1212 O THR A 79 -4.423 11.125 -5.953 1.00 0.32 O ATOM 1213 CB THR A 79 -6.789 11.751 -3.324 1.00 0.44 C ATOM 1214 OG1 THR A 79 -5.647 11.845 -2.467 1.00 0.52 O ATOM 1215 CG2 THR A 79 -7.919 11.040 -2.595 1.00 0.51 C ATOM 0 H THR A 79 -5.190 9.517 -3.791 1.00 0.34 H new ATOM 0 HA THR A 79 -7.282 10.976 -5.275 1.00 0.37 H new ATOM 0 HB THR A 79 -7.126 12.752 -3.593 1.00 0.44 H new ATOM 0 HG1 THR A 79 -5.244 12.734 -2.555 1.00 0.52 H new ATOM 0 HG21 THR A 79 -8.167 11.587 -1.686 1.00 0.51 H new ATOM 0 HG22 THR A 79 -8.796 10.993 -3.241 1.00 0.51 H new ATOM 0 HG23 THR A 79 -7.605 10.029 -2.336 1.00 0.51 H new ATOM 1223 N LYS A 80 -5.255 13.064 -5.170 1.00 0.41 N ATOM 1224 CA LYS A 80 -4.224 13.885 -5.790 1.00 0.43 C ATOM 1225 C LYS A 80 -2.955 13.936 -4.941 1.00 0.43 C ATOM 1226 O LYS A 80 -1.967 13.267 -5.244 1.00 0.47 O ATOM 1227 CB LYS A 80 -4.750 15.303 -6.022 1.00 0.46 C ATOM 1228 CG LYS A 80 -6.155 15.351 -6.604 1.00 0.44 C ATOM 1229 CD LYS A 80 -6.257 14.558 -7.897 1.00 0.43 C ATOM 1230 CE LYS A 80 -7.638 14.687 -8.520 1.00 1.19 C ATOM 1231 NZ LYS A 80 -7.943 16.092 -8.912 1.00 2.08 N ATOM 0 H LYS A 80 -5.946 13.589 -4.633 1.00 0.41 H new ATOM 0 HA LYS A 80 -3.969 13.428 -6.746 1.00 0.43 H new ATOM 0 HB2 LYS A 80 -4.741 15.843 -5.075 1.00 0.46 H new ATOM 0 HB3 LYS A 80 -4.071 15.827 -6.694 1.00 0.46 H new ATOM 0 HG2 LYS A 80 -6.863 14.954 -5.877 1.00 0.44 H new ATOM 0 HG3 LYS A 80 -6.436 16.388 -6.790 1.00 0.44 H new ATOM 0 HD2 LYS A 80 -5.504 14.910 -8.602 1.00 0.43 H new ATOM 0 HD3 LYS A 80 -6.042 13.508 -7.699 1.00 0.43 H new ATOM 0 HE2 LYS A 80 -7.702 14.044 -9.398 1.00 1.19 H new ATOM 0 HE3 LYS A 80 -8.389 14.336 -7.812 1.00 1.19 H new ATOM 0 HZ1 LYS A 80 -8.764 16.104 -9.551 1.00 2.08 H new ATOM 0 HZ2 LYS A 80 -8.158 16.651 -8.062 1.00 2.08 H new ATOM 0 HZ3 LYS A 80 -7.120 16.503 -9.398 1.00 2.08 H new ATOM 1245 N ASP A 81 -2.989 14.736 -3.877 1.00 0.41 N ATOM 1246 CA ASP A 81 -1.835 14.896 -2.998 1.00 0.43 C ATOM 1247 C ASP A 81 -1.840 13.889 -1.849 1.00 0.43 C ATOM 1248 O ASP A 81 -0.816 13.281 -1.553 1.00 0.61 O ATOM 1249 CB ASP A 81 -1.797 16.317 -2.436 1.00 0.42 C ATOM 1250 CG ASP A 81 -1.705 17.367 -3.526 1.00 0.44 C ATOM 1251 OD1 ASP A 81 -0.572 17.725 -3.912 1.00 0.48 O ATOM 1252 OD2 ASP A 81 -2.766 17.831 -3.994 1.00 0.44 O ATOM 0 H ASP A 81 -3.805 15.284 -3.603 1.00 0.41 H new ATOM 0 HA ASP A 81 -0.944 14.710 -3.597 1.00 0.43 H new ATOM 0 HB2 ASP A 81 -2.692 16.493 -1.840 1.00 0.42 H new ATOM 0 HB3 ASP A 81 -0.943 16.417 -1.766 1.00 0.42 H new ATOM 1257 N PHE A 82 -2.990 13.720 -1.201 1.00 0.31 N ATOM 1258 CA PHE A 82 -3.105 12.799 -0.069 1.00 0.30 C ATOM 1259 C PHE A 82 -2.488 11.436 -0.383 1.00 0.27 C ATOM 1260 O PHE A 82 -2.935 10.732 -1.288 1.00 0.32 O ATOM 1261 CB PHE A 82 -4.571 12.624 0.336 1.00 0.31 C ATOM 1262 CG PHE A 82 -5.264 13.915 0.668 1.00 0.34 C ATOM 1263 CD1 PHE A 82 -5.149 14.474 1.931 1.00 0.34 C ATOM 1264 CD2 PHE A 82 -6.032 14.568 -0.282 1.00 0.43 C ATOM 1265 CE1 PHE A 82 -5.788 15.659 2.240 1.00 0.39 C ATOM 1266 CE2 PHE A 82 -6.673 15.754 0.021 1.00 0.47 C ATOM 1267 CZ PHE A 82 -6.551 16.300 1.284 1.00 0.44 C ATOM 0 H PHE A 82 -3.854 14.207 -1.438 1.00 0.31 H new ATOM 0 HA PHE A 82 -2.552 13.237 0.762 1.00 0.30 H new ATOM 0 HB2 PHE A 82 -5.107 12.133 -0.476 1.00 0.31 H new ATOM 0 HB3 PHE A 82 -4.624 11.961 1.200 1.00 0.31 H new ATOM 0 HD1 PHE A 82 -4.553 13.977 2.682 1.00 0.34 H new ATOM 0 HD2 PHE A 82 -6.131 14.145 -1.271 1.00 0.43 H new ATOM 0 HE1 PHE A 82 -5.691 16.084 3.228 1.00 0.39 H new ATOM 0 HE2 PHE A 82 -7.269 16.253 -0.729 1.00 0.47 H new ATOM 0 HZ PHE A 82 -7.051 17.227 1.523 1.00 0.44 H new ATOM 1277 N TRP A 83 -1.455 11.075 0.380 1.00 0.22 N ATOM 1278 CA TRP A 83 -0.770 9.796 0.204 1.00 0.20 C ATOM 1279 C TRP A 83 -1.073 8.858 1.367 1.00 0.19 C ATOM 1280 O TRP A 83 -1.573 9.286 2.407 1.00 0.22 O ATOM 1281 CB TRP A 83 0.745 10.005 0.105 1.00 0.21 C ATOM 1282 CG TRP A 83 1.194 10.572 -1.206 1.00 0.22 C ATOM 1283 CD1 TRP A 83 1.193 9.939 -2.416 1.00 0.25 C ATOM 1284 CD2 TRP A 83 1.721 11.881 -1.439 1.00 0.27 C ATOM 1285 NE1 TRP A 83 1.679 10.778 -3.387 1.00 0.31 N ATOM 1286 CE2 TRP A 83 2.011 11.977 -2.813 1.00 0.32 C ATOM 1287 CE3 TRP A 83 1.971 12.986 -0.620 1.00 0.31 C ATOM 1288 CZ2 TRP A 83 2.539 13.133 -3.384 1.00 0.39 C ATOM 1289 CZ3 TRP A 83 2.496 14.132 -1.189 1.00 0.38 C ATOM 1290 CH2 TRP A 83 2.774 14.197 -2.559 1.00 0.41 C ATOM 0 H TRP A 83 -1.074 11.654 1.128 1.00 0.22 H new ATOM 0 HA TRP A 83 -1.133 9.348 -0.721 1.00 0.20 H new ATOM 0 HB2 TRP A 83 1.063 10.672 0.906 1.00 0.21 H new ATOM 0 HB3 TRP A 83 1.245 9.050 0.267 1.00 0.21 H new ATOM 0 HD1 TRP A 83 0.859 8.926 -2.584 1.00 0.25 H new ATOM 0 HE1 TRP A 83 1.777 10.547 -4.376 1.00 0.31 H new ATOM 0 HE3 TRP A 83 1.758 12.945 0.438 1.00 0.31 H new ATOM 0 HZ2 TRP A 83 2.755 13.186 -4.441 1.00 0.39 H new ATOM 0 HZ3 TRP A 83 2.695 14.991 -0.566 1.00 0.38 H new ATOM 0 HH2 TRP A 83 3.183 15.107 -2.973 1.00 0.41 H new ATOM 1301 N LEU A 84 -0.764 7.577 1.183 1.00 0.16 N ATOM 1302 CA LEU A 84 -0.994 6.579 2.222 1.00 0.17 C ATOM 1303 C LEU A 84 0.167 6.555 3.211 1.00 0.17 C ATOM 1304 O LEU A 84 1.332 6.554 2.814 1.00 0.24 O ATOM 1305 CB LEU A 84 -1.177 5.191 1.600 1.00 0.19 C ATOM 1306 CG LEU A 84 -2.629 4.728 1.451 1.00 0.14 C ATOM 1307 CD1 LEU A 84 -3.388 5.631 0.491 1.00 0.22 C ATOM 1308 CD2 LEU A 84 -2.680 3.284 0.976 1.00 0.16 C ATOM 0 H LEU A 84 -0.354 7.207 0.325 1.00 0.16 H new ATOM 0 HA LEU A 84 -1.904 6.850 2.757 1.00 0.17 H new ATOM 0 HB2 LEU A 84 -0.709 5.187 0.616 1.00 0.19 H new ATOM 0 HB3 LEU A 84 -0.642 4.464 2.210 1.00 0.19 H new ATOM 0 HG LEU A 84 -3.109 4.790 2.428 1.00 0.14 H new ATOM 0 HD11 LEU A 84 -4.417 5.283 0.401 1.00 0.22 H new ATOM 0 HD12 LEU A 84 -3.382 6.653 0.871 1.00 0.22 H new ATOM 0 HD13 LEU A 84 -2.909 5.606 -0.488 1.00 0.22 H new ATOM 0 HD21 LEU A 84 -3.719 2.971 0.875 1.00 0.16 H new ATOM 0 HD22 LEU A 84 -2.181 3.201 0.011 1.00 0.16 H new ATOM 0 HD23 LEU A 84 -2.177 2.644 1.701 1.00 0.16 H new ATOM 1320 N HIS A 85 -0.160 6.538 4.498 1.00 0.23 N ATOM 1321 CA HIS A 85 0.857 6.516 5.545 1.00 0.24 C ATOM 1322 C HIS A 85 0.489 5.520 6.639 1.00 0.27 C ATOM 1323 O HIS A 85 -0.681 5.374 6.992 1.00 0.36 O ATOM 1324 CB HIS A 85 1.033 7.911 6.144 1.00 0.24 C ATOM 1325 CG HIS A 85 1.558 8.918 5.168 1.00 0.23 C ATOM 1326 ND1 HIS A 85 0.746 9.776 4.456 1.00 0.29 N ATOM 1327 CD2 HIS A 85 2.828 9.203 4.788 1.00 0.33 C ATOM 1328 CE1 HIS A 85 1.492 10.542 3.680 1.00 0.29 C ATOM 1329 NE2 HIS A 85 2.758 10.214 3.864 1.00 0.30 N ATOM 0 H HIS A 85 -1.120 6.539 4.842 1.00 0.23 H new ATOM 0 HA HIS A 85 1.799 6.202 5.096 1.00 0.24 H new ATOM 0 HB2 HIS A 85 0.074 8.256 6.529 1.00 0.24 H new ATOM 0 HB3 HIS A 85 1.714 7.850 6.993 1.00 0.24 H new ATOM 0 HD2 HIS A 85 3.727 8.723 5.146 1.00 0.33 H new ATOM 0 HE1 HIS A 85 1.128 11.306 3.009 1.00 0.29 H new ATOM 0 HE2 HIS A 85 3.555 10.643 3.395 1.00 0.30 H new ATOM 1338 N ALA A 86 1.499 4.838 7.172 1.00 0.27 N ATOM 1339 CA ALA A 86 1.287 3.852 8.224 1.00 0.31 C ATOM 1340 C ALA A 86 1.338 4.500 9.604 1.00 0.29 C ATOM 1341 O ALA A 86 2.360 5.061 10.001 1.00 0.47 O ATOM 1342 CB ALA A 86 2.321 2.742 8.122 1.00 0.47 C ATOM 0 H ALA A 86 2.473 4.951 6.891 1.00 0.27 H new ATOM 0 HA ALA A 86 0.294 3.423 8.090 1.00 0.31 H new ATOM 0 HB1 ALA A 86 2.151 2.012 8.914 1.00 0.47 H new ATOM 0 HB2 ALA A 86 2.234 2.252 7.152 1.00 0.47 H new ATOM 0 HB3 ALA A 86 3.320 3.165 8.227 1.00 0.47 H new ATOM 1348 N ASN A 87 0.229 4.413 10.330 1.00 0.33 N ATOM 1349 CA ASN A 87 0.141 4.988 11.667 1.00 0.43 C ATOM 1350 C ASN A 87 0.382 3.922 12.731 1.00 0.46 C ATOM 1351 O ASN A 87 -0.478 3.077 12.983 1.00 0.53 O ATOM 1352 CB ASN A 87 -1.231 5.633 11.875 1.00 0.56 C ATOM 1353 CG ASN A 87 -1.329 6.378 13.191 1.00 1.09 C ATOM 1354 OD1 ASN A 87 -0.335 6.897 13.699 1.00 1.83 O ATOM 1355 ND2 ASN A 87 -2.532 6.434 13.751 1.00 1.83 N ATOM 0 H ASN A 87 -0.623 3.949 10.014 1.00 0.33 H new ATOM 0 HA ASN A 87 0.912 5.752 11.762 1.00 0.43 H new ATOM 0 HB2 ASN A 87 -1.433 6.322 11.055 1.00 0.56 H new ATOM 0 HB3 ASN A 87 -2.000 4.862 11.840 1.00 0.56 H new ATOM 0 HD21 ASN A 87 -2.660 6.922 14.638 1.00 1.83 H new ATOM 0 HD22 ASN A 87 -3.328 5.989 13.294 1.00 1.83 H new ATOM 1362 N ASN A 88 1.559 3.966 13.351 1.00 0.49 N ATOM 1363 CA ASN A 88 1.914 2.999 14.385 1.00 0.56 C ATOM 1364 C ASN A 88 1.190 3.311 15.692 1.00 0.60 C ATOM 1365 O ASN A 88 1.245 2.533 16.643 1.00 0.73 O ATOM 1366 CB ASN A 88 3.427 2.994 14.610 1.00 0.65 C ATOM 1367 CG ASN A 88 3.943 4.330 15.114 1.00 1.56 C ATOM 1368 OD1 ASN A 88 4.316 5.200 14.328 1.00 2.56 O ATOM 1369 ND2 ASN A 88 3.968 4.494 16.431 1.00 1.79 N ATOM 0 H ASN A 88 2.281 4.659 13.156 1.00 0.49 H new ATOM 0 HA ASN A 88 1.603 2.010 14.047 1.00 0.56 H new ATOM 0 HB2 ASN A 88 3.682 2.215 15.329 1.00 0.65 H new ATOM 0 HB3 ASN A 88 3.929 2.743 13.676 1.00 0.65 H new ATOM 0 HD21 ASN A 88 4.307 5.370 16.830 1.00 1.79 H new ATOM 0 HD22 ASN A 88 3.649 3.744 17.044 1.00 1.79 H new ATOM 1376 N LYS A 89 0.511 4.453 15.728 1.00 0.56 N ATOM 1377 CA LYS A 89 -0.226 4.870 16.916 1.00 0.63 C ATOM 1378 C LYS A 89 -1.402 3.935 17.183 1.00 0.61 C ATOM 1379 O LYS A 89 -1.534 3.388 18.277 1.00 0.77 O ATOM 1380 CB LYS A 89 -0.728 6.306 16.750 1.00 0.72 C ATOM 1381 CG LYS A 89 0.387 7.330 16.600 1.00 1.41 C ATOM 1382 CD LYS A 89 1.228 7.434 17.863 1.00 1.89 C ATOM 1383 CE LYS A 89 2.334 8.464 17.712 1.00 2.63 C ATOM 1384 NZ LYS A 89 1.796 9.815 17.397 1.00 3.20 N ATOM 0 H LYS A 89 0.456 5.107 14.947 1.00 0.56 H new ATOM 0 HA LYS A 89 0.451 4.825 17.769 1.00 0.63 H new ATOM 0 HB2 LYS A 89 -1.376 6.356 15.875 1.00 0.72 H new ATOM 0 HB3 LYS A 89 -1.338 6.570 17.614 1.00 0.72 H new ATOM 0 HG2 LYS A 89 1.024 7.054 15.760 1.00 1.41 H new ATOM 0 HG3 LYS A 89 -0.042 8.304 16.367 1.00 1.41 H new ATOM 0 HD2 LYS A 89 0.590 7.704 18.705 1.00 1.89 H new ATOM 0 HD3 LYS A 89 1.664 6.462 18.092 1.00 1.89 H new ATOM 0 HE2 LYS A 89 2.915 8.510 18.633 1.00 2.63 H new ATOM 0 HE3 LYS A 89 3.016 8.151 16.921 1.00 2.63 H new ATOM 0 HZ1 LYS A 89 2.537 10.528 17.551 1.00 3.20 H new ATOM 0 HZ2 LYS A 89 1.489 9.843 16.404 1.00 3.20 H new ATOM 0 HZ3 LYS A 89 0.986 10.019 18.016 1.00 3.20 H new ATOM 1398 N GLU A 90 -2.251 3.756 16.176 1.00 0.52 N ATOM 1399 CA GLU A 90 -3.417 2.888 16.305 1.00 0.55 C ATOM 1400 C GLU A 90 -3.297 1.665 15.400 1.00 0.41 C ATOM 1401 O GLU A 90 -4.259 0.918 15.219 1.00 0.42 O ATOM 1402 CB GLU A 90 -4.693 3.661 15.968 1.00 0.72 C ATOM 1403 CG GLU A 90 -4.931 4.863 16.866 1.00 0.91 C ATOM 1404 CD GLU A 90 -6.209 5.603 16.523 1.00 1.03 C ATOM 1405 OE1 GLU A 90 -6.159 6.507 15.661 1.00 1.61 O ATOM 1406 OE2 GLU A 90 -7.260 5.282 17.116 1.00 1.04 O ATOM 0 H GLU A 90 -2.154 4.200 15.263 1.00 0.52 H new ATOM 0 HA GLU A 90 -3.467 2.545 17.339 1.00 0.55 H new ATOM 0 HB2 GLU A 90 -4.642 3.996 14.932 1.00 0.72 H new ATOM 0 HB3 GLU A 90 -5.547 2.987 16.043 1.00 0.72 H new ATOM 0 HG2 GLU A 90 -4.974 4.533 17.904 1.00 0.91 H new ATOM 0 HG3 GLU A 90 -4.086 5.547 16.783 1.00 0.91 H new ATOM 1413 N HIS A 91 -2.107 1.470 14.836 1.00 0.33 N ATOM 1414 CA HIS A 91 -1.851 0.337 13.950 1.00 0.29 C ATOM 1415 C HIS A 91 -2.826 0.334 12.774 1.00 0.29 C ATOM 1416 O HIS A 91 -3.418 -0.697 12.450 1.00 0.34 O ATOM 1417 CB HIS A 91 -1.957 -0.980 14.724 1.00 0.38 C ATOM 1418 CG HIS A 91 -1.004 -1.077 15.875 1.00 0.49 C ATOM 1419 ND1 HIS A 91 0.140 -1.848 15.845 1.00 1.11 N ATOM 1420 CD2 HIS A 91 -1.031 -0.499 17.101 1.00 1.24 C ATOM 1421 CE1 HIS A 91 0.775 -1.740 16.999 1.00 0.91 C ATOM 1422 NE2 HIS A 91 0.085 -0.927 17.776 1.00 0.95 N ATOM 0 H HIS A 91 -1.304 2.083 14.977 1.00 0.33 H new ATOM 0 HA HIS A 91 -0.839 0.436 13.558 1.00 0.29 H new ATOM 0 HB2 HIS A 91 -2.975 -1.092 15.096 1.00 0.38 H new ATOM 0 HB3 HIS A 91 -1.774 -1.809 14.041 1.00 0.38 H new ATOM 0 HD2 HIS A 91 -1.789 0.173 17.476 1.00 1.24 H new ATOM 0 HE1 HIS A 91 1.700 -2.233 17.261 1.00 0.91 H new ATOM 0 HE2 HIS A 91 0.340 -0.659 18.727 1.00 0.95 H new ATOM 1431 N SER A 92 -2.984 1.490 12.136 1.00 0.34 N ATOM 1432 CA SER A 92 -3.889 1.620 10.998 1.00 0.44 C ATOM 1433 C SER A 92 -3.292 2.528 9.926 1.00 0.35 C ATOM 1434 O SER A 92 -2.436 3.364 10.215 1.00 0.30 O ATOM 1435 CB SER A 92 -5.238 2.175 11.458 1.00 0.61 C ATOM 1436 OG SER A 92 -5.090 3.456 12.045 1.00 1.33 O ATOM 0 H SER A 92 -2.497 2.350 12.388 1.00 0.34 H new ATOM 0 HA SER A 92 -4.036 0.630 10.567 1.00 0.44 H new ATOM 0 HB2 SER A 92 -5.918 2.237 10.608 1.00 0.61 H new ATOM 0 HB3 SER A 92 -5.689 1.492 12.178 1.00 0.61 H new ATOM 0 HG SER A 92 -5.967 3.789 12.329 1.00 1.33 H new ATOM 1442 N VAL A 93 -3.751 2.358 8.689 1.00 0.38 N ATOM 1443 CA VAL A 93 -3.264 3.164 7.575 1.00 0.33 C ATOM 1444 C VAL A 93 -4.166 4.371 7.337 1.00 0.29 C ATOM 1445 O VAL A 93 -5.369 4.226 7.125 1.00 0.31 O ATOM 1446 CB VAL A 93 -3.175 2.336 6.277 1.00 0.40 C ATOM 1447 CG1 VAL A 93 -2.570 3.161 5.149 1.00 0.84 C ATOM 1448 CG2 VAL A 93 -2.368 1.066 6.509 1.00 1.20 C ATOM 0 H VAL A 93 -4.459 1.670 8.434 1.00 0.38 H new ATOM 0 HA VAL A 93 -2.265 3.507 7.844 1.00 0.33 H new ATOM 0 HB VAL A 93 -4.185 2.052 5.983 1.00 0.40 H new ATOM 0 HG11 VAL A 93 -2.517 2.556 4.244 1.00 0.84 H new ATOM 0 HG12 VAL A 93 -3.192 4.037 4.965 1.00 0.84 H new ATOM 0 HG13 VAL A 93 -1.567 3.481 5.430 1.00 0.84 H new ATOM 0 HG21 VAL A 93 -2.315 0.494 5.583 1.00 1.20 H new ATOM 0 HG22 VAL A 93 -1.360 1.329 6.831 1.00 1.20 H new ATOM 0 HG23 VAL A 93 -2.850 0.465 7.280 1.00 1.20 H new ATOM 1458 N GLU A 94 -3.573 5.561 7.372 1.00 0.30 N ATOM 1459 CA GLU A 94 -4.320 6.798 7.163 1.00 0.31 C ATOM 1460 C GLU A 94 -3.677 7.643 6.068 1.00 0.27 C ATOM 1461 O GLU A 94 -2.476 7.540 5.817 1.00 0.29 O ATOM 1462 CB GLU A 94 -4.391 7.601 8.464 1.00 0.39 C ATOM 1463 CG GLU A 94 -5.288 6.971 9.516 1.00 0.67 C ATOM 1464 CD GLU A 94 -6.744 6.933 9.092 1.00 1.47 C ATOM 1465 OE1 GLU A 94 -7.145 5.948 8.437 1.00 2.41 O ATOM 1466 OE2 GLU A 94 -7.481 7.888 9.413 1.00 1.54 O ATOM 0 H GLU A 94 -2.576 5.695 7.543 1.00 0.30 H new ATOM 0 HA GLU A 94 -5.330 6.534 6.849 1.00 0.31 H new ATOM 0 HB2 GLU A 94 -3.386 7.707 8.871 1.00 0.39 H new ATOM 0 HB3 GLU A 94 -4.753 8.605 8.243 1.00 0.39 H new ATOM 0 HG2 GLU A 94 -4.946 5.956 9.720 1.00 0.67 H new ATOM 0 HG3 GLU A 94 -5.199 7.531 10.447 1.00 0.67 H new ATOM 1473 N LEU A 95 -4.482 8.477 5.418 1.00 0.31 N ATOM 1474 CA LEU A 95 -3.989 9.336 4.349 1.00 0.32 C ATOM 1475 C LEU A 95 -3.587 10.706 4.886 1.00 0.29 C ATOM 1476 O LEU A 95 -4.342 11.343 5.621 1.00 0.37 O ATOM 1477 CB LEU A 95 -5.047 9.496 3.253 1.00 0.44 C ATOM 1478 CG LEU A 95 -5.393 8.216 2.490 1.00 0.50 C ATOM 1479 CD1 LEU A 95 -6.318 7.333 3.311 1.00 1.11 C ATOM 1480 CD2 LEU A 95 -6.027 8.551 1.149 1.00 0.62 C ATOM 0 H LEU A 95 -5.478 8.576 5.613 1.00 0.31 H new ATOM 0 HA LEU A 95 -3.106 8.860 3.922 1.00 0.32 H new ATOM 0 HB2 LEU A 95 -5.958 9.888 3.704 1.00 0.44 H new ATOM 0 HB3 LEU A 95 -4.698 10.242 2.539 1.00 0.44 H new ATOM 0 HG LEU A 95 -4.470 7.666 2.308 1.00 0.50 H new ATOM 0 HD11 LEU A 95 -6.551 6.428 2.749 1.00 1.11 H new ATOM 0 HD12 LEU A 95 -5.828 7.063 4.246 1.00 1.11 H new ATOM 0 HD13 LEU A 95 -7.240 7.873 3.527 1.00 1.11 H new ATOM 0 HD21 LEU A 95 -6.267 7.629 0.619 1.00 0.62 H new ATOM 0 HD22 LEU A 95 -6.940 9.124 1.311 1.00 0.62 H new ATOM 0 HD23 LEU A 95 -5.329 9.140 0.554 1.00 0.62 H new ATOM 1492 N HIS A 96 -2.394 11.155 4.508 1.00 0.25 N ATOM 1493 CA HIS A 96 -1.886 12.450 4.946 1.00 0.30 C ATOM 1494 C HIS A 96 -1.291 13.231 3.776 1.00 0.25 C ATOM 1495 O HIS A 96 -0.783 12.644 2.820 1.00 0.22 O ATOM 1496 CB HIS A 96 -0.831 12.267 6.039 1.00 0.39 C ATOM 1497 CG HIS A 96 -1.378 11.689 7.310 1.00 0.73 C ATOM 1498 ND1 HIS A 96 -1.709 12.461 8.404 1.00 1.24 N ATOM 1499 CD2 HIS A 96 -1.646 10.409 7.659 1.00 1.11 C ATOM 1500 CE1 HIS A 96 -2.159 11.680 9.371 1.00 1.64 C ATOM 1501 NE2 HIS A 96 -2.131 10.431 8.944 1.00 1.57 N ATOM 0 H HIS A 96 -1.760 10.639 3.898 1.00 0.25 H new ATOM 0 HA HIS A 96 -2.724 13.019 5.350 1.00 0.30 H new ATOM 0 HB2 HIS A 96 -0.041 11.616 5.664 1.00 0.39 H new ATOM 0 HB3 HIS A 96 -0.373 13.232 6.256 1.00 0.39 H new ATOM 0 HD2 HIS A 96 -1.505 9.534 7.042 1.00 1.11 H new ATOM 0 HE1 HIS A 96 -2.493 12.008 10.344 1.00 1.64 H new ATOM 0 HE2 HIS A 96 -2.422 9.614 9.481 1.00 1.57 H new ATOM 1510 N LYS A 97 -1.362 14.557 3.862 1.00 0.32 N ATOM 1511 CA LYS A 97 -0.831 15.427 2.815 1.00 0.32 C ATOM 1512 C LYS A 97 0.374 16.214 3.324 1.00 0.34 C ATOM 1513 O LYS A 97 0.275 16.959 4.298 1.00 0.50 O ATOM 1514 CB LYS A 97 -1.918 16.391 2.328 1.00 0.39 C ATOM 1515 CG LYS A 97 -1.453 17.332 1.229 1.00 0.42 C ATOM 1516 CD LYS A 97 -2.588 18.213 0.732 1.00 0.53 C ATOM 1517 CE LYS A 97 -2.109 19.197 -0.323 1.00 1.29 C ATOM 1518 NZ LYS A 97 -3.230 20.001 -0.886 1.00 2.10 N ATOM 0 H LYS A 97 -1.783 15.054 4.647 1.00 0.32 H new ATOM 0 HA LYS A 97 -0.509 14.802 1.982 1.00 0.32 H new ATOM 0 HB2 LYS A 97 -2.767 15.813 1.964 1.00 0.39 H new ATOM 0 HB3 LYS A 97 -2.273 16.981 3.173 1.00 0.39 H new ATOM 0 HG2 LYS A 97 -0.643 17.958 1.603 1.00 0.42 H new ATOM 0 HG3 LYS A 97 -1.051 16.752 0.398 1.00 0.42 H new ATOM 0 HD2 LYS A 97 -3.379 17.589 0.316 1.00 0.53 H new ATOM 0 HD3 LYS A 97 -3.020 18.759 1.571 1.00 0.53 H new ATOM 0 HE2 LYS A 97 -1.368 19.865 0.115 1.00 1.29 H new ATOM 0 HE3 LYS A 97 -1.613 18.653 -1.127 1.00 1.29 H new ATOM 0 HZ1 LYS A 97 -2.860 20.659 -1.601 1.00 2.10 H new ATOM 0 HZ2 LYS A 97 -3.926 19.366 -1.327 1.00 2.10 H new ATOM 0 HZ3 LYS A 97 -3.688 20.540 -0.123 1.00 2.10 H new ATOM 1532 N CYS A 98 1.512 16.043 2.655 1.00 0.37 N ATOM 1533 CA CYS A 98 2.739 16.733 3.042 1.00 0.43 C ATOM 1534 C CYS A 98 3.563 17.119 1.816 1.00 0.40 C ATOM 1535 O CYS A 98 3.159 16.871 0.680 1.00 0.37 O ATOM 1536 CB CYS A 98 3.573 15.856 3.979 1.00 0.49 C ATOM 1537 SG CYS A 98 2.766 15.483 5.554 1.00 1.10 S ATOM 0 H CYS A 98 1.609 15.433 1.843 1.00 0.37 H new ATOM 0 HA CYS A 98 2.458 17.646 3.567 1.00 0.43 H new ATOM 0 HB2 CYS A 98 3.806 14.920 3.472 1.00 0.49 H new ATOM 0 HB3 CYS A 98 4.521 16.355 4.178 1.00 0.49 H new ATOM 0 HG CYS A 98 1.618 16.090 5.608 1.00 1.10 H new ATOM 1543 N GLU A 99 4.721 17.729 2.057 1.00 0.46 N ATOM 1544 CA GLU A 99 5.605 18.156 0.975 1.00 0.47 C ATOM 1545 C GLU A 99 6.060 16.970 0.128 1.00 0.42 C ATOM 1546 O GLU A 99 5.750 15.818 0.433 1.00 0.38 O ATOM 1547 CB GLU A 99 6.822 18.889 1.546 1.00 0.53 C ATOM 1548 CG GLU A 99 6.461 20.100 2.390 1.00 1.09 C ATOM 1549 CD GLU A 99 5.722 21.163 1.599 1.00 1.85 C ATOM 1550 OE1 GLU A 99 4.478 21.090 1.527 1.00 2.55 O ATOM 1551 OE2 GLU A 99 6.389 22.067 1.053 1.00 2.07 O ATOM 0 H GLU A 99 5.069 17.939 2.992 1.00 0.46 H new ATOM 0 HA GLU A 99 5.044 18.835 0.333 1.00 0.47 H new ATOM 0 HB2 GLU A 99 7.403 18.194 2.152 1.00 0.53 H new ATOM 0 HB3 GLU A 99 7.463 19.207 0.724 1.00 0.53 H new ATOM 0 HG2 GLU A 99 5.843 19.782 3.230 1.00 1.09 H new ATOM 0 HG3 GLU A 99 7.371 20.531 2.809 1.00 1.09 H new ATOM 1558 N LYS A 100 6.795 17.263 -0.942 1.00 0.45 N ATOM 1559 CA LYS A 100 7.296 16.228 -1.843 1.00 0.46 C ATOM 1560 C LYS A 100 8.060 15.134 -1.087 1.00 0.45 C ATOM 1561 O LYS A 100 7.775 13.951 -1.271 1.00 0.45 O ATOM 1562 CB LYS A 100 8.186 16.841 -2.931 1.00 0.52 C ATOM 1563 CG LYS A 100 8.926 15.813 -3.779 1.00 0.56 C ATOM 1564 CD LYS A 100 7.981 14.785 -4.391 1.00 0.60 C ATOM 1565 CE LYS A 100 7.018 15.423 -5.380 1.00 0.96 C ATOM 1566 NZ LYS A 100 6.070 14.427 -5.953 1.00 1.77 N ATOM 0 H LYS A 100 7.058 18.212 -1.207 1.00 0.45 H new ATOM 0 HA LYS A 100 6.430 15.763 -2.314 1.00 0.46 H new ATOM 0 HB2 LYS A 100 7.570 17.460 -3.584 1.00 0.52 H new ATOM 0 HB3 LYS A 100 8.915 17.501 -2.461 1.00 0.52 H new ATOM 0 HG2 LYS A 100 9.469 16.324 -4.574 1.00 0.56 H new ATOM 0 HG3 LYS A 100 9.667 15.302 -3.164 1.00 0.56 H new ATOM 0 HD2 LYS A 100 8.561 14.012 -4.895 1.00 0.60 H new ATOM 0 HD3 LYS A 100 7.416 14.293 -3.599 1.00 0.60 H new ATOM 0 HE2 LYS A 100 6.457 16.214 -4.882 1.00 0.96 H new ATOM 0 HE3 LYS A 100 7.583 15.892 -6.186 1.00 0.96 H new ATOM 0 HZ1 LYS A 100 5.431 14.901 -6.622 1.00 1.77 H new ATOM 0 HZ2 LYS A 100 6.604 13.686 -6.450 1.00 1.77 H new ATOM 0 HZ3 LYS A 100 5.513 13.997 -5.187 1.00 1.77 H new ATOM 1580 N PRO A 101 9.044 15.499 -0.233 1.00 0.46 N ATOM 1581 CA PRO A 101 9.827 14.515 0.525 1.00 0.48 C ATOM 1582 C PRO A 101 8.941 13.529 1.278 1.00 0.42 C ATOM 1583 O PRO A 101 8.504 13.798 2.398 1.00 0.45 O ATOM 1584 CB PRO A 101 10.649 15.365 1.507 1.00 0.55 C ATOM 1585 CG PRO A 101 10.064 16.736 1.443 1.00 0.64 C ATOM 1586 CD PRO A 101 9.477 16.874 0.070 1.00 0.48 C ATOM 0 HA PRO A 101 10.444 13.901 -0.131 1.00 0.48 H new ATOM 0 HB2 PRO A 101 10.591 14.961 2.518 1.00 0.55 H new ATOM 0 HB3 PRO A 101 11.703 15.376 1.228 1.00 0.55 H new ATOM 0 HG2 PRO A 101 9.300 16.870 2.209 1.00 0.64 H new ATOM 0 HG3 PRO A 101 10.827 17.494 1.618 1.00 0.64 H new ATOM 0 HD2 PRO A 101 8.642 17.575 0.054 1.00 0.48 H new ATOM 0 HD3 PRO A 101 10.211 17.236 -0.650 1.00 0.48 H new ATOM 1594 N LEU A 102 8.677 12.385 0.654 1.00 0.40 N ATOM 1595 CA LEU A 102 7.844 11.353 1.260 1.00 0.36 C ATOM 1596 C LEU A 102 8.621 10.586 2.331 1.00 0.37 C ATOM 1597 O LEU A 102 9.759 10.177 2.101 1.00 0.45 O ATOM 1598 CB LEU A 102 7.346 10.381 0.189 1.00 0.38 C ATOM 1599 CG LEU A 102 6.674 11.027 -1.024 1.00 0.41 C ATOM 1600 CD1 LEU A 102 6.303 9.969 -2.053 1.00 0.50 C ATOM 1601 CD2 LEU A 102 5.442 11.813 -0.601 1.00 0.45 C ATOM 0 H LEU A 102 9.029 12.149 -0.274 1.00 0.40 H new ATOM 0 HA LEU A 102 6.990 11.839 1.731 1.00 0.36 H new ATOM 0 HB2 LEU A 102 8.191 9.787 -0.159 1.00 0.38 H new ATOM 0 HB3 LEU A 102 6.639 9.691 0.650 1.00 0.38 H new ATOM 0 HG LEU A 102 7.382 11.720 -1.479 1.00 0.41 H new ATOM 0 HD11 LEU A 102 5.826 10.446 -2.909 1.00 0.50 H new ATOM 0 HD12 LEU A 102 7.203 9.450 -2.382 1.00 0.50 H new ATOM 0 HD13 LEU A 102 5.614 9.253 -1.606 1.00 0.50 H new ATOM 0 HD21 LEU A 102 4.979 12.264 -1.479 1.00 0.45 H new ATOM 0 HD22 LEU A 102 4.730 11.142 -0.120 1.00 0.45 H new ATOM 0 HD23 LEU A 102 5.733 12.596 0.099 1.00 0.45 H new ATOM 1613 N PRO A 103 8.020 10.380 3.519 1.00 0.37 N ATOM 1614 CA PRO A 103 8.671 9.655 4.612 1.00 0.40 C ATOM 1615 C PRO A 103 8.653 8.145 4.399 1.00 0.35 C ATOM 1616 O PRO A 103 8.062 7.652 3.437 1.00 0.30 O ATOM 1617 CB PRO A 103 7.829 10.033 5.828 1.00 0.47 C ATOM 1618 CG PRO A 103 6.467 10.276 5.276 1.00 0.46 C ATOM 1619 CD PRO A 103 6.666 10.837 3.892 1.00 0.42 C ATOM 0 HA PRO A 103 9.726 9.914 4.706 1.00 0.40 H new ATOM 0 HB2 PRO A 103 7.820 9.234 6.569 1.00 0.47 H new ATOM 0 HB3 PRO A 103 8.222 10.922 6.322 1.00 0.47 H new ATOM 0 HG2 PRO A 103 5.891 9.351 5.242 1.00 0.46 H new ATOM 0 HG3 PRO A 103 5.912 10.974 5.903 1.00 0.46 H new ATOM 0 HD2 PRO A 103 5.913 10.465 3.197 1.00 0.42 H new ATOM 0 HD3 PRO A 103 6.595 11.925 3.887 1.00 0.42 H new ATOM 1627 N ASP A 104 9.306 7.415 5.297 1.00 0.40 N ATOM 1628 CA ASP A 104 9.367 5.960 5.205 1.00 0.41 C ATOM 1629 C ASP A 104 7.973 5.348 5.325 1.00 0.41 C ATOM 1630 O ASP A 104 7.735 4.230 4.868 1.00 0.54 O ATOM 1631 CB ASP A 104 10.279 5.398 6.298 1.00 0.52 C ATOM 1632 CG ASP A 104 11.652 6.038 6.290 1.00 1.05 C ATOM 1633 OD1 ASP A 104 11.820 7.092 6.940 1.00 1.45 O ATOM 1634 OD2 ASP A 104 12.560 5.487 5.634 1.00 1.57 O ATOM 0 H ASP A 104 9.801 7.807 6.098 1.00 0.40 H new ATOM 0 HA ASP A 104 9.776 5.699 4.229 1.00 0.41 H new ATOM 0 HB2 ASP A 104 9.814 5.554 7.271 1.00 0.52 H new ATOM 0 HB3 ASP A 104 10.382 4.321 6.163 1.00 0.52 H new ATOM 1639 N GLN A 105 7.060 6.091 5.942 1.00 0.36 N ATOM 1640 CA GLN A 105 5.690 5.626 6.127 1.00 0.39 C ATOM 1641 C GLN A 105 4.904 5.705 4.823 1.00 0.34 C ATOM 1642 O GLN A 105 3.814 5.144 4.709 1.00 0.42 O ATOM 1643 CB GLN A 105 4.988 6.453 7.209 1.00 0.48 C ATOM 1644 CG GLN A 105 5.593 6.297 8.596 1.00 0.67 C ATOM 1645 CD GLN A 105 6.985 6.891 8.701 1.00 0.83 C ATOM 1646 OE1 GLN A 105 7.984 6.204 8.484 1.00 1.41 O ATOM 1647 NE2 GLN A 105 7.056 8.174 9.035 1.00 1.65 N ATOM 0 H GLN A 105 7.244 7.019 6.323 1.00 0.36 H new ATOM 0 HA GLN A 105 5.729 4.584 6.443 1.00 0.39 H new ATOM 0 HB2 GLN A 105 5.020 7.505 6.926 1.00 0.48 H new ATOM 0 HB3 GLN A 105 3.937 6.165 7.247 1.00 0.48 H new ATOM 0 HG2 GLN A 105 4.942 6.777 9.327 1.00 0.67 H new ATOM 0 HG3 GLN A 105 5.635 5.238 8.852 1.00 0.67 H new ATOM 0 HE21 GLN A 105 6.202 8.705 9.206 1.00 1.65 H new ATOM 0 HE22 GLN A 105 7.965 8.629 9.121 1.00 1.65 H new ATOM 1656 N ALA A 106 5.463 6.405 3.841 1.00 0.31 N ATOM 1657 CA ALA A 106 4.813 6.562 2.546 1.00 0.30 C ATOM 1658 C ALA A 106 5.244 5.471 1.572 1.00 0.31 C ATOM 1659 O ALA A 106 4.487 5.089 0.680 1.00 0.62 O ATOM 1660 CB ALA A 106 5.119 7.936 1.970 1.00 0.31 C ATOM 0 H ALA A 106 6.366 6.873 3.918 1.00 0.31 H new ATOM 0 HA ALA A 106 3.737 6.469 2.695 1.00 0.30 H new ATOM 0 HB1 ALA A 106 4.628 8.042 1.002 1.00 0.31 H new ATOM 0 HB2 ALA A 106 4.752 8.705 2.649 1.00 0.31 H new ATOM 0 HB3 ALA A 106 6.196 8.046 1.845 1.00 0.31 H new ATOM 1666 N PHE A 107 6.465 4.975 1.744 1.00 0.21 N ATOM 1667 CA PHE A 107 6.996 3.930 0.875 1.00 0.19 C ATOM 1668 C PHE A 107 6.767 2.546 1.475 1.00 0.18 C ATOM 1669 O PHE A 107 7.234 2.251 2.574 1.00 0.24 O ATOM 1670 CB PHE A 107 8.493 4.144 0.638 1.00 0.23 C ATOM 1671 CG PHE A 107 8.817 5.428 -0.072 1.00 0.19 C ATOM 1672 CD1 PHE A 107 8.549 5.575 -1.423 1.00 0.22 C ATOM 1673 CD2 PHE A 107 9.392 6.486 0.612 1.00 0.26 C ATOM 1674 CE1 PHE A 107 8.849 6.753 -2.079 1.00 0.22 C ATOM 1675 CE2 PHE A 107 9.695 7.667 -0.038 1.00 0.27 C ATOM 1676 CZ PHE A 107 9.423 7.801 -1.386 1.00 0.21 C ATOM 0 H PHE A 107 7.106 5.280 2.477 1.00 0.21 H new ATOM 0 HA PHE A 107 6.467 3.988 -0.076 1.00 0.19 H new ATOM 0 HB2 PHE A 107 9.009 4.130 1.598 1.00 0.23 H new ATOM 0 HB3 PHE A 107 8.882 3.309 0.055 1.00 0.23 H new ATOM 0 HD1 PHE A 107 8.100 4.759 -1.970 1.00 0.22 H new ATOM 0 HD2 PHE A 107 9.606 6.387 1.666 1.00 0.26 H new ATOM 0 HE1 PHE A 107 8.635 6.855 -3.133 1.00 0.22 H new ATOM 0 HE2 PHE A 107 10.144 8.484 0.507 1.00 0.27 H new ATOM 0 HZ PHE A 107 9.659 8.723 -1.897 1.00 0.21 H new ATOM 1686 N PHE A 108 6.043 1.702 0.745 1.00 0.16 N ATOM 1687 CA PHE A 108 5.761 0.346 1.203 1.00 0.17 C ATOM 1688 C PHE A 108 6.443 -0.676 0.299 1.00 0.18 C ATOM 1689 O PHE A 108 6.416 -0.551 -0.923 1.00 0.27 O ATOM 1690 CB PHE A 108 4.252 0.093 1.229 1.00 0.17 C ATOM 1691 CG PHE A 108 3.508 0.983 2.185 1.00 0.20 C ATOM 1692 CD1 PHE A 108 3.507 0.713 3.544 1.00 0.26 C ATOM 1693 CD2 PHE A 108 2.815 2.091 1.723 1.00 0.27 C ATOM 1694 CE1 PHE A 108 2.825 1.533 4.426 1.00 0.30 C ATOM 1695 CE2 PHE A 108 2.131 2.912 2.600 1.00 0.32 C ATOM 1696 CZ PHE A 108 2.129 2.627 3.951 1.00 0.32 C ATOM 0 H PHE A 108 5.642 1.933 -0.164 1.00 0.16 H new ATOM 0 HA PHE A 108 6.154 0.239 2.214 1.00 0.17 H new ATOM 0 HB2 PHE A 108 3.851 0.236 0.226 1.00 0.17 H new ATOM 0 HB3 PHE A 108 4.071 -0.947 1.499 1.00 0.17 H new ATOM 0 HD1 PHE A 108 4.044 -0.146 3.919 1.00 0.26 H new ATOM 0 HD2 PHE A 108 2.809 2.315 0.667 1.00 0.27 H new ATOM 0 HE1 PHE A 108 2.837 1.318 5.484 1.00 0.30 H new ATOM 0 HE2 PHE A 108 1.599 3.775 2.229 1.00 0.32 H new ATOM 0 HZ PHE A 108 1.583 3.259 4.636 1.00 0.32 H new ATOM 1706 N VAL A 109 7.059 -1.686 0.904 1.00 0.17 N ATOM 1707 CA VAL A 109 7.745 -2.722 0.143 1.00 0.18 C ATOM 1708 C VAL A 109 6.756 -3.767 -0.367 1.00 0.20 C ATOM 1709 O VAL A 109 6.171 -4.516 0.415 1.00 0.22 O ATOM 1710 CB VAL A 109 8.832 -3.415 0.985 1.00 0.21 C ATOM 1711 CG1 VAL A 109 9.599 -4.424 0.148 1.00 0.23 C ATOM 1712 CG2 VAL A 109 9.782 -2.391 1.579 1.00 0.21 C ATOM 0 H VAL A 109 7.097 -1.809 1.916 1.00 0.17 H new ATOM 0 HA VAL A 109 8.222 -2.233 -0.706 1.00 0.18 H new ATOM 0 HB VAL A 109 8.342 -3.946 1.801 1.00 0.21 H new ATOM 0 HG11 VAL A 109 10.362 -4.902 0.763 1.00 0.23 H new ATOM 0 HG12 VAL A 109 8.912 -5.181 -0.230 1.00 0.23 H new ATOM 0 HG13 VAL A 109 10.075 -3.915 -0.690 1.00 0.23 H new ATOM 0 HG21 VAL A 109 10.543 -2.901 2.170 1.00 0.21 H new ATOM 0 HG22 VAL A 109 10.261 -1.831 0.776 1.00 0.21 H new ATOM 0 HG23 VAL A 109 9.225 -1.705 2.218 1.00 0.21 H new ATOM 1722 N LEU A 110 6.578 -3.812 -1.684 1.00 0.24 N ATOM 1723 CA LEU A 110 5.657 -4.759 -2.303 1.00 0.27 C ATOM 1724 C LEU A 110 6.244 -6.169 -2.308 1.00 0.25 C ATOM 1725 O LEU A 110 7.352 -6.388 -2.795 1.00 0.30 O ATOM 1726 CB LEU A 110 5.336 -4.319 -3.737 1.00 0.35 C ATOM 1727 CG LEU A 110 3.975 -4.767 -4.279 1.00 0.48 C ATOM 1728 CD1 LEU A 110 3.668 -4.053 -5.587 1.00 0.89 C ATOM 1729 CD2 LEU A 110 3.939 -6.275 -4.480 1.00 1.01 C ATOM 0 H LEU A 110 7.061 -3.202 -2.344 1.00 0.24 H new ATOM 0 HA LEU A 110 4.738 -4.774 -1.717 1.00 0.27 H new ATOM 0 HB2 LEU A 110 5.385 -3.231 -3.783 1.00 0.35 H new ATOM 0 HB3 LEU A 110 6.114 -4.702 -4.398 1.00 0.35 H new ATOM 0 HG LEU A 110 3.213 -4.503 -3.546 1.00 0.48 H new ATOM 0 HD11 LEU A 110 2.698 -4.380 -5.961 1.00 0.89 H new ATOM 0 HD12 LEU A 110 3.647 -2.976 -5.418 1.00 0.89 H new ATOM 0 HD13 LEU A 110 4.439 -4.290 -6.320 1.00 0.89 H new ATOM 0 HD21 LEU A 110 2.962 -6.567 -4.865 1.00 1.01 H new ATOM 0 HD22 LEU A 110 4.712 -6.566 -5.192 1.00 1.01 H new ATOM 0 HD23 LEU A 110 4.117 -6.773 -3.527 1.00 1.01 H new ATOM 1741 N HIS A 111 5.492 -7.119 -1.757 1.00 0.24 N ATOM 1742 CA HIS A 111 5.928 -8.511 -1.701 1.00 0.26 C ATOM 1743 C HIS A 111 4.902 -9.427 -2.358 1.00 0.25 C ATOM 1744 O HIS A 111 3.695 -9.230 -2.209 1.00 0.26 O ATOM 1745 CB HIS A 111 6.157 -8.945 -0.253 1.00 0.27 C ATOM 1746 CG HIS A 111 7.330 -8.282 0.399 1.00 0.32 C ATOM 1747 ND1 HIS A 111 8.626 -8.734 0.256 1.00 0.55 N ATOM 1748 CD2 HIS A 111 7.399 -7.199 1.208 1.00 0.26 C ATOM 1749 CE1 HIS A 111 9.440 -7.959 0.950 1.00 0.55 C ATOM 1750 NE2 HIS A 111 8.721 -7.019 1.535 1.00 0.36 N ATOM 0 H HIS A 111 4.576 -6.949 -1.342 1.00 0.24 H new ATOM 0 HA HIS A 111 6.868 -8.590 -2.247 1.00 0.26 H new ATOM 0 HB2 HIS A 111 5.260 -8.728 0.327 1.00 0.27 H new ATOM 0 HB3 HIS A 111 6.301 -10.025 -0.226 1.00 0.27 H new ATOM 0 HD2 HIS A 111 6.569 -6.590 1.535 1.00 0.26 H new ATOM 0 HE1 HIS A 111 10.511 -8.075 1.026 1.00 0.55 H new ATOM 0 HE2 HIS A 111 9.088 -6.279 2.133 1.00 0.36 H new ATOM 1759 N ASN A 112 5.390 -10.430 -3.082 1.00 0.29 N ATOM 1760 CA ASN A 112 4.514 -11.380 -3.759 1.00 0.30 C ATOM 1761 C ASN A 112 4.066 -12.480 -2.802 1.00 0.29 C ATOM 1762 O ASN A 112 4.892 -13.209 -2.250 1.00 0.44 O ATOM 1763 CB ASN A 112 5.227 -11.997 -4.963 1.00 0.46 C ATOM 1764 CG ASN A 112 4.309 -12.877 -5.790 1.00 1.42 C ATOM 1765 OD1 ASN A 112 3.671 -12.413 -6.734 1.00 2.14 O ATOM 1766 ND2 ASN A 112 4.238 -14.155 -5.437 1.00 2.13 N ATOM 0 H ASN A 112 6.386 -10.606 -3.215 1.00 0.29 H new ATOM 0 HA ASN A 112 3.633 -10.840 -4.106 1.00 0.30 H new ATOM 0 HB2 ASN A 112 5.627 -11.202 -5.592 1.00 0.46 H new ATOM 0 HB3 ASN A 112 6.076 -12.587 -4.616 1.00 0.46 H new ATOM 0 HD21 ASN A 112 3.636 -14.795 -5.956 1.00 2.13 H new ATOM 0 HD22 ASN A 112 4.785 -14.497 -4.647 1.00 2.13 H new ATOM 1773 N MET A 113 2.756 -12.592 -2.610 1.00 0.28 N ATOM 1774 CA MET A 113 2.197 -13.601 -1.715 1.00 0.36 C ATOM 1775 C MET A 113 1.551 -14.733 -2.506 1.00 0.40 C ATOM 1776 O MET A 113 2.002 -15.877 -2.452 1.00 0.46 O ATOM 1777 CB MET A 113 1.171 -12.963 -0.778 1.00 0.43 C ATOM 1778 CG MET A 113 1.772 -11.955 0.188 1.00 0.47 C ATOM 1779 SD MET A 113 2.952 -12.702 1.330 1.00 0.89 S ATOM 1780 CE MET A 113 1.895 -13.848 2.213 1.00 0.58 C ATOM 0 H MET A 113 2.061 -11.997 -3.061 1.00 0.28 H new ATOM 0 HA MET A 113 3.010 -14.019 -1.122 1.00 0.36 H new ATOM 0 HB2 MET A 113 0.404 -12.469 -1.375 1.00 0.43 H new ATOM 0 HB3 MET A 113 0.674 -13.748 -0.208 1.00 0.43 H new ATOM 0 HG2 MET A 113 2.269 -11.167 -0.378 1.00 0.47 H new ATOM 0 HG3 MET A 113 0.972 -11.482 0.757 1.00 0.47 H new ATOM 0 HE1 MET A 113 2.363 -14.119 3.160 1.00 0.58 H new ATOM 0 HE2 MET A 113 0.930 -13.379 2.406 1.00 0.58 H new ATOM 0 HE3 MET A 113 1.748 -14.745 1.611 1.00 0.58 H new ATOM 1790 N HIS A 114 0.488 -14.407 -3.239 1.00 0.45 N ATOM 1791 CA HIS A 114 -0.221 -15.400 -4.038 1.00 0.51 C ATOM 1792 C HIS A 114 0.098 -15.226 -5.521 1.00 0.47 C ATOM 1793 O HIS A 114 0.974 -14.444 -5.889 1.00 0.46 O ATOM 1794 CB HIS A 114 -1.729 -15.287 -3.805 1.00 0.54 C ATOM 1795 CG HIS A 114 -2.464 -16.578 -3.989 1.00 0.67 C ATOM 1796 ND1 HIS A 114 -3.238 -16.854 -5.095 1.00 0.94 N ATOM 1797 CD2 HIS A 114 -2.540 -17.674 -3.195 1.00 1.39 C ATOM 1798 CE1 HIS A 114 -3.761 -18.063 -4.975 1.00 1.40 C ATOM 1799 NE2 HIS A 114 -3.351 -18.580 -3.832 1.00 1.75 N ATOM 0 H HIS A 114 0.101 -13.465 -3.295 1.00 0.45 H new ATOM 0 HA HIS A 114 0.111 -16.391 -3.729 1.00 0.51 H new ATOM 0 HB2 HIS A 114 -1.905 -14.920 -2.794 1.00 0.54 H new ATOM 0 HB3 HIS A 114 -2.139 -14.545 -4.490 1.00 0.54 H new ATOM 0 HD2 HIS A 114 -2.054 -17.809 -2.240 1.00 1.39 H new ATOM 0 HE1 HIS A 114 -4.412 -18.544 -5.690 1.00 1.40 H new ATOM 0 HE2 HIS A 114 -3.597 -19.505 -3.479 1.00 1.75 H new ATOM 1808 N SER A 115 -0.619 -15.961 -6.368 1.00 0.49 N ATOM 1809 CA SER A 115 -0.414 -15.893 -7.811 1.00 0.54 C ATOM 1810 C SER A 115 -0.564 -14.465 -8.327 1.00 0.50 C ATOM 1811 O SER A 115 0.337 -13.932 -8.974 1.00 0.56 O ATOM 1812 CB SER A 115 -1.404 -16.812 -8.527 1.00 0.59 C ATOM 1813 OG SER A 115 -1.232 -18.161 -8.127 1.00 1.50 O ATOM 0 H SER A 115 -1.349 -16.612 -6.078 1.00 0.49 H new ATOM 0 HA SER A 115 0.603 -16.224 -8.020 1.00 0.54 H new ATOM 0 HB2 SER A 115 -2.423 -16.493 -8.310 1.00 0.59 H new ATOM 0 HB3 SER A 115 -1.267 -16.729 -9.605 1.00 0.59 H new ATOM 0 HG SER A 115 -1.878 -18.727 -8.598 1.00 1.50 H new ATOM 1819 N ASN A 116 -1.708 -13.850 -8.039 1.00 0.45 N ATOM 1820 CA ASN A 116 -1.975 -12.485 -8.485 1.00 0.50 C ATOM 1821 C ASN A 116 -2.037 -11.519 -7.304 1.00 0.44 C ATOM 1822 O ASN A 116 -1.815 -10.319 -7.462 1.00 0.66 O ATOM 1823 CB ASN A 116 -3.288 -12.429 -9.269 1.00 0.61 C ATOM 1824 CG ASN A 116 -3.252 -13.286 -10.521 1.00 1.08 C ATOM 1825 OD1 ASN A 116 -2.565 -14.305 -10.572 1.00 1.93 O ATOM 1826 ND2 ASN A 116 -3.999 -12.875 -11.539 1.00 1.68 N ATOM 0 H ASN A 116 -2.463 -14.274 -7.500 1.00 0.45 H new ATOM 0 HA ASN A 116 -1.154 -12.181 -9.134 1.00 0.50 H new ATOM 0 HB2 ASN A 116 -4.105 -12.761 -8.628 1.00 0.61 H new ATOM 0 HB3 ASN A 116 -3.499 -11.396 -9.545 1.00 0.61 H new ATOM 0 HD21 ASN A 116 -4.018 -13.411 -12.407 1.00 1.68 H new ATOM 0 HD22 ASN A 116 -4.554 -12.023 -11.453 1.00 1.68 H new ATOM 1833 N CYS A 117 -2.338 -12.048 -6.121 1.00 0.32 N ATOM 1834 CA CYS A 117 -2.433 -11.228 -4.919 1.00 0.32 C ATOM 1835 C CYS A 117 -1.085 -10.606 -4.571 1.00 0.28 C ATOM 1836 O CYS A 117 -0.032 -11.170 -4.873 1.00 0.34 O ATOM 1837 CB CYS A 117 -2.939 -12.063 -3.744 1.00 0.43 C ATOM 1838 SG CYS A 117 -4.472 -12.958 -4.080 1.00 0.97 S ATOM 0 H CYS A 117 -2.520 -13.040 -5.970 1.00 0.32 H new ATOM 0 HA CYS A 117 -3.142 -10.424 -5.117 1.00 0.32 H new ATOM 0 HB2 CYS A 117 -2.167 -12.779 -3.462 1.00 0.43 H new ATOM 0 HB3 CYS A 117 -3.094 -11.408 -2.887 1.00 0.43 H new ATOM 0 HG CYS A 117 -4.818 -13.636 -3.027 1.00 0.97 H new ATOM 1844 N VAL A 118 -1.124 -9.439 -3.933 1.00 0.25 N ATOM 1845 CA VAL A 118 0.093 -8.737 -3.541 1.00 0.27 C ATOM 1846 C VAL A 118 -0.040 -8.144 -2.142 1.00 0.24 C ATOM 1847 O VAL A 118 -1.142 -7.815 -1.700 1.00 0.28 O ATOM 1848 CB VAL A 118 0.436 -7.611 -4.534 1.00 0.37 C ATOM 1849 CG1 VAL A 118 0.810 -8.189 -5.890 1.00 0.46 C ATOM 1850 CG2 VAL A 118 -0.728 -6.640 -4.663 1.00 0.41 C ATOM 0 H VAL A 118 -1.987 -8.960 -3.677 1.00 0.25 H new ATOM 0 HA VAL A 118 0.898 -9.472 -3.545 1.00 0.27 H new ATOM 0 HB VAL A 118 1.296 -7.063 -4.150 1.00 0.37 H new ATOM 0 HG11 VAL A 118 1.049 -7.378 -6.578 1.00 0.46 H new ATOM 0 HG12 VAL A 118 1.677 -8.840 -5.781 1.00 0.46 H new ATOM 0 HG13 VAL A 118 -0.028 -8.764 -6.284 1.00 0.46 H new ATOM 0 HG21 VAL A 118 -0.467 -5.851 -5.369 1.00 0.41 H new ATOM 0 HG22 VAL A 118 -1.608 -7.173 -5.023 1.00 0.41 H new ATOM 0 HG23 VAL A 118 -0.944 -6.199 -3.690 1.00 0.41 H new ATOM 1860 N SER A 119 1.088 -8.008 -1.450 1.00 0.24 N ATOM 1861 CA SER A 119 1.095 -7.455 -0.099 1.00 0.23 C ATOM 1862 C SER A 119 1.954 -6.197 -0.025 1.00 0.21 C ATOM 1863 O SER A 119 2.903 -6.033 -0.793 1.00 0.30 O ATOM 1864 CB SER A 119 1.611 -8.495 0.896 1.00 0.29 C ATOM 1865 OG SER A 119 1.589 -7.989 2.220 1.00 1.09 O ATOM 0 H SER A 119 2.008 -8.273 -1.802 1.00 0.24 H new ATOM 0 HA SER A 119 0.071 -7.187 0.160 1.00 0.23 H new ATOM 0 HB2 SER A 119 0.998 -9.395 0.837 1.00 0.29 H new ATOM 0 HB3 SER A 119 2.628 -8.784 0.630 1.00 0.29 H new ATOM 0 HG SER A 119 2.403 -8.267 2.690 1.00 1.09 H new ATOM 1871 N PHE A 120 1.613 -5.307 0.904 1.00 0.20 N ATOM 1872 CA PHE A 120 2.355 -4.063 1.086 1.00 0.18 C ATOM 1873 C PHE A 120 2.967 -3.996 2.482 1.00 0.18 C ATOM 1874 O PHE A 120 2.290 -3.650 3.450 1.00 0.27 O ATOM 1875 CB PHE A 120 1.439 -2.860 0.864 1.00 0.21 C ATOM 1876 CG PHE A 120 0.767 -2.859 -0.479 1.00 0.24 C ATOM 1877 CD1 PHE A 120 1.493 -2.605 -1.631 1.00 0.40 C ATOM 1878 CD2 PHE A 120 -0.590 -3.115 -0.589 1.00 0.28 C ATOM 1879 CE1 PHE A 120 0.879 -2.606 -2.868 1.00 0.45 C ATOM 1880 CE2 PHE A 120 -1.211 -3.117 -1.823 1.00 0.32 C ATOM 1881 CZ PHE A 120 -0.475 -2.862 -2.964 1.00 0.35 C ATOM 0 H PHE A 120 0.827 -5.425 1.543 1.00 0.20 H new ATOM 0 HA PHE A 120 3.160 -4.039 0.351 1.00 0.18 H new ATOM 0 HB2 PHE A 120 0.677 -2.845 1.643 1.00 0.21 H new ATOM 0 HB3 PHE A 120 2.022 -1.945 0.971 1.00 0.21 H new ATOM 0 HD1 PHE A 120 2.552 -2.404 -1.561 1.00 0.40 H new ATOM 0 HD2 PHE A 120 -1.169 -3.315 0.300 1.00 0.28 H new ATOM 0 HE1 PHE A 120 1.456 -2.407 -3.759 1.00 0.45 H new ATOM 0 HE2 PHE A 120 -2.270 -3.318 -1.896 1.00 0.32 H new ATOM 0 HZ PHE A 120 -0.958 -2.863 -3.930 1.00 0.35 H new ATOM 1891 N GLU A 121 4.250 -4.332 2.580 1.00 0.19 N ATOM 1892 CA GLU A 121 4.952 -4.308 3.859 1.00 0.19 C ATOM 1893 C GLU A 121 5.409 -2.894 4.200 1.00 0.19 C ATOM 1894 O GLU A 121 5.691 -2.091 3.312 1.00 0.19 O ATOM 1895 CB GLU A 121 6.159 -5.247 3.816 1.00 0.23 C ATOM 1896 CG GLU A 121 6.869 -5.389 5.154 1.00 0.29 C ATOM 1897 CD GLU A 121 8.096 -6.276 5.073 1.00 0.33 C ATOM 1898 OE1 GLU A 121 7.946 -7.509 5.196 1.00 0.45 O ATOM 1899 OE2 GLU A 121 9.206 -5.734 4.887 1.00 0.35 O ATOM 0 H GLU A 121 4.824 -4.624 1.789 1.00 0.19 H new ATOM 0 HA GLU A 121 4.262 -4.646 4.632 1.00 0.19 H new ATOM 0 HB2 GLU A 121 5.831 -6.231 3.482 1.00 0.23 H new ATOM 0 HB3 GLU A 121 6.869 -4.879 3.075 1.00 0.23 H new ATOM 0 HG2 GLU A 121 7.162 -4.402 5.512 1.00 0.29 H new ATOM 0 HG3 GLU A 121 6.175 -5.801 5.887 1.00 0.29 H new ATOM 1906 N CYS A 122 5.477 -2.598 5.496 1.00 0.22 N ATOM 1907 CA CYS A 122 5.906 -1.282 5.958 1.00 0.24 C ATOM 1908 C CYS A 122 7.428 -1.179 5.946 1.00 0.27 C ATOM 1909 O CYS A 122 8.121 -2.003 6.542 1.00 0.26 O ATOM 1910 CB CYS A 122 5.372 -1.015 7.365 1.00 0.27 C ATOM 1911 SG CYS A 122 3.569 -1.026 7.484 1.00 0.31 S ATOM 0 H CYS A 122 5.241 -3.251 6.243 1.00 0.22 H new ATOM 0 HA CYS A 122 5.502 -0.531 5.279 1.00 0.24 H new ATOM 0 HB2 CYS A 122 5.775 -1.767 8.044 1.00 0.27 H new ATOM 0 HB3 CYS A 122 5.742 -0.048 7.705 1.00 0.27 H new ATOM 0 HG CYS A 122 3.201 -0.396 8.560 1.00 0.31 H new ATOM 1917 N LYS A 123 7.937 -0.160 5.262 1.00 0.34 N ATOM 1918 CA LYS A 123 9.377 0.056 5.159 1.00 0.41 C ATOM 1919 C LYS A 123 9.983 0.407 6.515 1.00 0.43 C ATOM 1920 O LYS A 123 11.141 0.089 6.788 1.00 0.48 O ATOM 1921 CB LYS A 123 9.674 1.171 4.156 1.00 0.48 C ATOM 1922 CG LYS A 123 11.157 1.396 3.916 1.00 0.65 C ATOM 1923 CD LYS A 123 11.399 2.557 2.965 1.00 0.67 C ATOM 1924 CE LYS A 123 12.881 2.745 2.687 1.00 0.69 C ATOM 1925 NZ LYS A 123 13.475 1.558 2.011 1.00 1.39 N ATOM 0 H LYS A 123 7.372 0.532 4.769 1.00 0.34 H new ATOM 0 HA LYS A 123 9.829 -0.873 4.812 1.00 0.41 H new ATOM 0 HB2 LYS A 123 9.193 0.932 3.207 1.00 0.48 H new ATOM 0 HB3 LYS A 123 9.228 2.099 4.514 1.00 0.48 H new ATOM 0 HG2 LYS A 123 11.654 1.593 4.866 1.00 0.65 H new ATOM 0 HG3 LYS A 123 11.602 0.489 3.505 1.00 0.65 H new ATOM 0 HD2 LYS A 123 10.871 2.378 2.028 1.00 0.67 H new ATOM 0 HD3 LYS A 123 10.988 3.472 3.393 1.00 0.67 H new ATOM 0 HE2 LYS A 123 13.024 3.627 2.063 1.00 0.69 H new ATOM 0 HE3 LYS A 123 13.406 2.929 3.625 1.00 0.69 H new ATOM 0 HZ1 LYS A 123 14.430 1.793 1.673 1.00 1.39 H new ATOM 0 HZ2 LYS A 123 13.531 0.767 2.684 1.00 1.39 H new ATOM 0 HZ3 LYS A 123 12.879 1.284 1.204 1.00 1.39 H new ATOM 1939 N THR A 124 9.197 1.066 7.360 1.00 0.43 N ATOM 1940 CA THR A 124 9.663 1.464 8.683 1.00 0.49 C ATOM 1941 C THR A 124 9.346 0.399 9.728 1.00 0.44 C ATOM 1942 O THR A 124 10.055 0.268 10.726 1.00 0.50 O ATOM 1943 CB THR A 124 9.040 2.804 9.119 1.00 0.59 C ATOM 1944 OG1 THR A 124 9.359 3.071 10.489 1.00 1.19 O ATOM 1945 CG2 THR A 124 7.529 2.784 8.938 1.00 0.88 C ATOM 0 H THR A 124 8.235 1.335 7.152 1.00 0.43 H new ATOM 0 HA THR A 124 10.744 1.582 8.613 1.00 0.49 H new ATOM 0 HB THR A 124 9.454 3.593 8.491 1.00 0.59 H new ATOM 0 HG1 THR A 124 8.960 3.925 10.757 1.00 1.19 H new ATOM 0 HG21 THR A 124 7.112 3.741 9.253 1.00 0.88 H new ATOM 0 HG22 THR A 124 7.291 2.612 7.888 1.00 0.88 H new ATOM 0 HG23 THR A 124 7.101 1.985 9.543 1.00 0.88 H new ATOM 1953 N ASP A 125 8.280 -0.358 9.493 1.00 0.39 N ATOM 1954 CA ASP A 125 7.872 -1.413 10.415 1.00 0.42 C ATOM 1955 C ASP A 125 8.004 -2.790 9.764 1.00 0.35 C ATOM 1956 O ASP A 125 7.056 -3.285 9.155 1.00 0.36 O ATOM 1957 CB ASP A 125 6.431 -1.191 10.879 1.00 0.52 C ATOM 1958 CG ASP A 125 6.285 0.037 11.755 1.00 0.64 C ATOM 1959 OD1 ASP A 125 6.477 -0.084 12.982 1.00 0.78 O ATOM 1960 OD2 ASP A 125 5.978 1.119 11.212 1.00 0.65 O ATOM 0 H ASP A 125 7.682 -0.261 8.672 1.00 0.39 H new ATOM 0 HA ASP A 125 8.533 -1.376 11.281 1.00 0.42 H new ATOM 0 HB2 ASP A 125 5.784 -1.091 10.008 1.00 0.52 H new ATOM 0 HB3 ASP A 125 6.091 -2.068 11.429 1.00 0.52 H new ATOM 1965 N PRO A 126 9.184 -3.428 9.884 1.00 0.43 N ATOM 1966 CA PRO A 126 9.424 -4.752 9.300 1.00 0.46 C ATOM 1967 C PRO A 126 8.561 -5.830 9.947 1.00 0.45 C ATOM 1968 O PRO A 126 8.600 -6.024 11.163 1.00 0.56 O ATOM 1969 CB PRO A 126 10.906 -5.011 9.587 1.00 0.62 C ATOM 1970 CG PRO A 126 11.223 -4.144 10.755 1.00 0.89 C ATOM 1971 CD PRO A 126 10.372 -2.917 10.595 1.00 0.60 C ATOM 0 HA PRO A 126 9.174 -4.780 8.239 1.00 0.46 H new ATOM 0 HB2 PRO A 126 11.088 -6.062 9.813 1.00 0.62 H new ATOM 0 HB3 PRO A 126 11.526 -4.758 8.727 1.00 0.62 H new ATOM 0 HG2 PRO A 126 11.002 -4.654 11.692 1.00 0.89 H new ATOM 0 HG3 PRO A 126 12.282 -3.886 10.775 1.00 0.89 H new ATOM 0 HD2 PRO A 126 10.109 -2.480 11.558 1.00 0.60 H new ATOM 0 HD3 PRO A 126 10.883 -2.143 10.023 1.00 0.60 H new ATOM 1979 N GLY A 127 7.780 -6.527 9.129 1.00 0.40 N ATOM 1980 CA GLY A 127 6.916 -7.575 9.640 1.00 0.43 C ATOM 1981 C GLY A 127 5.450 -7.200 9.576 1.00 0.44 C ATOM 1982 O GLY A 127 4.576 -8.054 9.732 1.00 0.65 O ATOM 0 H GLY A 127 7.730 -6.385 8.120 1.00 0.40 H new ATOM 0 HA2 GLY A 127 7.080 -8.488 9.067 1.00 0.43 H new ATOM 0 HA3 GLY A 127 7.187 -7.794 10.673 1.00 0.43 H new ATOM 1986 N VAL A 128 5.178 -5.920 9.347 1.00 0.28 N ATOM 1987 CA VAL A 128 3.808 -5.430 9.264 1.00 0.32 C ATOM 1988 C VAL A 128 3.380 -5.247 7.811 1.00 0.21 C ATOM 1989 O VAL A 128 4.152 -4.763 6.982 1.00 0.16 O ATOM 1990 CB VAL A 128 3.646 -4.094 10.014 1.00 0.42 C ATOM 1991 CG1 VAL A 128 2.196 -3.638 9.994 1.00 0.93 C ATOM 1992 CG2 VAL A 128 4.154 -4.220 11.442 1.00 1.27 C ATOM 0 H VAL A 128 5.890 -5.202 9.215 1.00 0.28 H new ATOM 0 HA VAL A 128 3.170 -6.179 9.734 1.00 0.32 H new ATOM 0 HB VAL A 128 4.244 -3.339 9.504 1.00 0.42 H new ATOM 0 HG11 VAL A 128 2.104 -2.693 10.529 1.00 0.93 H new ATOM 0 HG12 VAL A 128 1.871 -3.504 8.962 1.00 0.93 H new ATOM 0 HG13 VAL A 128 1.571 -4.390 10.476 1.00 0.93 H new ATOM 0 HG21 VAL A 128 4.032 -3.267 11.957 1.00 1.27 H new ATOM 0 HG22 VAL A 128 3.586 -4.990 11.964 1.00 1.27 H new ATOM 0 HG23 VAL A 128 5.209 -4.493 11.430 1.00 1.27 H new ATOM 2002 N PHE A 129 2.146 -5.636 7.511 1.00 0.23 N ATOM 2003 CA PHE A 129 1.614 -5.520 6.158 1.00 0.19 C ATOM 2004 C PHE A 129 0.225 -4.887 6.174 1.00 0.16 C ATOM 2005 O PHE A 129 -0.543 -5.075 7.118 1.00 0.18 O ATOM 2006 CB PHE A 129 1.537 -6.899 5.495 1.00 0.29 C ATOM 2007 CG PHE A 129 2.817 -7.685 5.570 1.00 0.26 C ATOM 2008 CD1 PHE A 129 3.117 -8.437 6.694 1.00 0.49 C ATOM 2009 CD2 PHE A 129 3.717 -7.675 4.516 1.00 0.30 C ATOM 2010 CE1 PHE A 129 4.290 -9.162 6.767 1.00 0.58 C ATOM 2011 CE2 PHE A 129 4.892 -8.401 4.583 1.00 0.38 C ATOM 2012 CZ PHE A 129 5.178 -9.145 5.712 1.00 0.46 C ATOM 0 H PHE A 129 1.495 -6.035 8.187 1.00 0.23 H new ATOM 0 HA PHE A 129 2.287 -4.881 5.586 1.00 0.19 H new ATOM 0 HB2 PHE A 129 0.741 -7.474 5.968 1.00 0.29 H new ATOM 0 HB3 PHE A 129 1.261 -6.773 4.448 1.00 0.29 H new ATOM 0 HD1 PHE A 129 2.425 -8.457 7.523 1.00 0.49 H new ATOM 0 HD2 PHE A 129 3.498 -7.094 3.632 1.00 0.30 H new ATOM 0 HE1 PHE A 129 4.512 -9.742 7.650 1.00 0.58 H new ATOM 0 HE2 PHE A 129 5.585 -8.387 3.755 1.00 0.38 H new ATOM 0 HZ PHE A 129 6.095 -9.712 5.768 1.00 0.46 H new ATOM 2022 N ILE A 130 -0.087 -4.130 5.124 1.00 0.16 N ATOM 2023 CA ILE A 130 -1.387 -3.480 5.014 1.00 0.16 C ATOM 2024 C ILE A 130 -2.474 -4.520 4.775 1.00 0.18 C ATOM 2025 O ILE A 130 -2.280 -5.463 4.007 1.00 0.26 O ATOM 2026 CB ILE A 130 -1.416 -2.451 3.866 1.00 0.19 C ATOM 2027 CG1 ILE A 130 -0.261 -1.454 4.008 1.00 0.21 C ATOM 2028 CG2 ILE A 130 -2.755 -1.723 3.844 1.00 0.25 C ATOM 2029 CD1 ILE A 130 -0.168 -0.459 2.867 1.00 0.25 C ATOM 0 H ILE A 130 0.542 -3.953 4.341 1.00 0.16 H new ATOM 0 HA ILE A 130 -1.568 -2.956 5.952 1.00 0.16 H new ATOM 0 HB ILE A 130 -1.294 -2.980 2.921 1.00 0.19 H new ATOM 0 HG12 ILE A 130 -0.377 -0.909 4.945 1.00 0.21 H new ATOM 0 HG13 ILE A 130 0.677 -2.006 4.074 1.00 0.21 H new ATOM 0 HG21 ILE A 130 -2.762 -0.999 3.029 1.00 0.25 H new ATOM 0 HG22 ILE A 130 -3.559 -2.444 3.696 1.00 0.25 H new ATOM 0 HG23 ILE A 130 -2.903 -1.204 4.791 1.00 0.25 H new ATOM 0 HD11 ILE A 130 0.673 0.213 3.038 1.00 0.25 H new ATOM 0 HD12 ILE A 130 -0.020 -0.994 1.929 1.00 0.25 H new ATOM 0 HD13 ILE A 130 -1.090 0.120 2.813 1.00 0.25 H new ATOM 2041 N GLY A 131 -3.616 -4.350 5.432 1.00 0.19 N ATOM 2042 CA GLY A 131 -4.703 -5.295 5.265 1.00 0.20 C ATOM 2043 C GLY A 131 -5.987 -4.837 5.919 1.00 0.16 C ATOM 2044 O GLY A 131 -5.964 -4.077 6.886 1.00 0.19 O ATOM 0 H GLY A 131 -3.807 -3.580 6.073 1.00 0.19 H new ATOM 0 HA2 GLY A 131 -4.880 -5.454 4.201 1.00 0.20 H new ATOM 0 HA3 GLY A 131 -4.410 -6.257 5.686 1.00 0.20 H new ATOM 2048 N VAL A 132 -7.110 -5.310 5.394 1.00 0.18 N ATOM 2049 CA VAL A 132 -8.419 -4.951 5.922 1.00 0.16 C ATOM 2050 C VAL A 132 -8.666 -5.597 7.283 1.00 0.17 C ATOM 2051 O VAL A 132 -8.768 -6.817 7.394 1.00 0.22 O ATOM 2052 CB VAL A 132 -9.536 -5.370 4.948 1.00 0.17 C ATOM 2053 CG1 VAL A 132 -10.907 -5.088 5.543 1.00 0.18 C ATOM 2054 CG2 VAL A 132 -9.367 -4.657 3.618 1.00 0.22 C ATOM 0 H VAL A 132 -7.140 -5.947 4.598 1.00 0.18 H new ATOM 0 HA VAL A 132 -8.432 -3.868 6.041 1.00 0.16 H new ATOM 0 HB VAL A 132 -9.461 -6.444 4.777 1.00 0.17 H new ATOM 0 HG11 VAL A 132 -11.680 -5.392 4.837 1.00 0.18 H new ATOM 0 HG12 VAL A 132 -11.023 -5.648 6.471 1.00 0.18 H new ATOM 0 HG13 VAL A 132 -11.002 -4.022 5.748 1.00 0.18 H new ATOM 0 HG21 VAL A 132 -10.163 -4.962 2.938 1.00 0.22 H new ATOM 0 HG22 VAL A 132 -9.416 -3.579 3.774 1.00 0.22 H new ATOM 0 HG23 VAL A 132 -8.401 -4.918 3.186 1.00 0.22 H new ATOM 2064 N LYS A 133 -8.760 -4.760 8.313 1.00 0.17 N ATOM 2065 CA LYS A 133 -8.998 -5.234 9.669 1.00 0.21 C ATOM 2066 C LYS A 133 -10.434 -5.738 9.815 1.00 0.22 C ATOM 2067 O LYS A 133 -10.716 -6.909 9.559 1.00 0.24 O ATOM 2068 CB LYS A 133 -8.727 -4.111 10.674 1.00 0.29 C ATOM 2069 CG LYS A 133 -8.473 -4.601 12.086 1.00 0.35 C ATOM 2070 CD LYS A 133 -7.005 -4.921 12.302 1.00 1.17 C ATOM 2071 CE LYS A 133 -6.771 -5.564 13.653 1.00 1.20 C ATOM 2072 NZ LYS A 133 -5.326 -5.811 13.911 1.00 2.26 N ATOM 0 H LYS A 133 -8.674 -3.747 8.231 1.00 0.17 H new ATOM 0 HA LYS A 133 -8.318 -6.062 9.873 1.00 0.21 H new ATOM 0 HB2 LYS A 133 -7.864 -3.536 10.338 1.00 0.29 H new ATOM 0 HB3 LYS A 133 -9.579 -3.431 10.683 1.00 0.29 H new ATOM 0 HG2 LYS A 133 -8.791 -3.841 12.800 1.00 0.35 H new ATOM 0 HG3 LYS A 133 -9.074 -5.490 12.278 1.00 0.35 H new ATOM 0 HD2 LYS A 133 -6.657 -5.590 11.514 1.00 1.17 H new ATOM 0 HD3 LYS A 133 -6.417 -4.006 12.226 1.00 1.17 H new ATOM 0 HE2 LYS A 133 -7.174 -4.921 14.435 1.00 1.20 H new ATOM 0 HE3 LYS A 133 -7.315 -6.507 13.704 1.00 1.20 H new ATOM 0 HZ1 LYS A 133 -5.211 -6.252 14.846 1.00 2.26 H new ATOM 0 HZ2 LYS A 133 -4.946 -6.446 13.180 1.00 2.26 H new ATOM 0 HZ3 LYS A 133 -4.810 -4.908 13.888 1.00 2.26 H new ATOM 2086 N ASP A 134 -11.336 -4.852 10.229 1.00 0.26 N ATOM 2087 CA ASP A 134 -12.741 -5.208 10.393 1.00 0.31 C ATOM 2088 C ASP A 134 -13.497 -4.983 9.089 1.00 0.28 C ATOM 2089 O ASP A 134 -14.268 -5.835 8.645 1.00 0.30 O ATOM 2090 CB ASP A 134 -13.377 -4.387 11.516 1.00 0.39 C ATOM 2091 CG ASP A 134 -12.698 -4.610 12.853 1.00 1.40 C ATOM 2092 OD1 ASP A 134 -13.097 -5.550 13.571 1.00 1.76 O ATOM 2093 OD2 ASP A 134 -11.767 -3.845 13.181 1.00 2.23 O ATOM 0 H ASP A 134 -11.118 -3.882 10.457 1.00 0.26 H new ATOM 0 HA ASP A 134 -12.799 -6.263 10.659 1.00 0.31 H new ATOM 0 HB2 ASP A 134 -13.329 -3.329 11.260 1.00 0.39 H new ATOM 0 HB3 ASP A 134 -14.432 -4.648 11.600 1.00 0.39 H new ATOM 2098 N ASN A 135 -13.267 -3.822 8.482 1.00 0.27 N ATOM 2099 CA ASN A 135 -13.913 -3.461 7.224 1.00 0.27 C ATOM 2100 C ASN A 135 -13.194 -2.279 6.585 1.00 0.23 C ATOM 2101 O ASN A 135 -13.688 -1.675 5.633 1.00 0.26 O ATOM 2102 CB ASN A 135 -15.385 -3.118 7.456 1.00 0.35 C ATOM 2103 CG ASN A 135 -16.174 -3.046 6.163 1.00 1.25 C ATOM 2104 OD1 ASN A 135 -15.852 -3.725 5.188 1.00 2.08 O ATOM 2105 ND2 ASN A 135 -17.213 -2.221 6.151 1.00 1.98 N ATOM 0 H ASN A 135 -12.633 -3.110 8.845 1.00 0.27 H new ATOM 0 HA ASN A 135 -13.858 -4.315 6.549 1.00 0.27 H new ATOM 0 HB2 ASN A 135 -15.831 -3.868 8.109 1.00 0.35 H new ATOM 0 HB3 ASN A 135 -15.455 -2.162 7.974 1.00 0.35 H new ATOM 0 HD21 ASN A 135 -17.782 -2.130 5.310 1.00 1.98 H new ATOM 0 HD22 ASN A 135 -17.442 -1.678 6.983 1.00 1.98 H new ATOM 2112 N HIS A 136 -12.023 -1.953 7.125 1.00 0.19 N ATOM 2113 CA HIS A 136 -11.222 -0.843 6.621 1.00 0.21 C ATOM 2114 C HIS A 136 -9.748 -1.232 6.578 1.00 0.19 C ATOM 2115 O HIS A 136 -9.356 -2.256 7.133 1.00 0.17 O ATOM 2116 CB HIS A 136 -11.410 0.393 7.504 1.00 0.28 C ATOM 2117 CG HIS A 136 -10.813 0.252 8.871 1.00 0.35 C ATOM 2118 ND1 HIS A 136 -9.558 0.726 9.196 1.00 1.34 N ATOM 2119 CD2 HIS A 136 -11.304 -0.310 10.001 1.00 0.89 C ATOM 2120 CE1 HIS A 136 -9.303 0.458 10.464 1.00 1.15 C ATOM 2121 NE2 HIS A 136 -10.346 -0.168 10.975 1.00 0.49 N ATOM 0 H HIS A 136 -11.607 -2.445 7.916 1.00 0.19 H new ATOM 0 HA HIS A 136 -11.555 -0.607 5.610 1.00 0.21 H new ATOM 0 HB2 HIS A 136 -10.962 1.254 7.008 1.00 0.28 H new ATOM 0 HB3 HIS A 136 -12.476 0.600 7.602 1.00 0.28 H new ATOM 0 HD1 HIS A 136 -8.926 1.208 8.557 1.00 1.34 H new ATOM 0 HD2 HIS A 136 -12.269 -0.782 10.115 1.00 0.89 H new ATOM 0 HE1 HIS A 136 -8.395 0.709 10.993 1.00 1.15 H new ATOM 2130 N LEU A 137 -8.936 -0.409 5.924 1.00 0.21 N ATOM 2131 CA LEU A 137 -7.508 -0.682 5.814 1.00 0.22 C ATOM 2132 C LEU A 137 -6.781 -0.348 7.113 1.00 0.25 C ATOM 2133 O LEU A 137 -6.896 0.760 7.637 1.00 0.38 O ATOM 2134 CB LEU A 137 -6.895 0.106 4.654 1.00 0.27 C ATOM 2135 CG LEU A 137 -7.291 -0.380 3.257 1.00 0.27 C ATOM 2136 CD1 LEU A 137 -6.677 0.512 2.190 1.00 0.32 C ATOM 2137 CD2 LEU A 137 -6.865 -1.827 3.055 1.00 0.27 C ATOM 0 H LEU A 137 -9.240 0.449 5.464 1.00 0.21 H new ATOM 0 HA LEU A 137 -7.390 -1.748 5.618 1.00 0.22 H new ATOM 0 HB2 LEU A 137 -7.184 1.152 4.753 1.00 0.27 H new ATOM 0 HB3 LEU A 137 -5.809 0.066 4.741 1.00 0.27 H new ATOM 0 HG LEU A 137 -8.376 -0.326 3.167 1.00 0.27 H new ATOM 0 HD11 LEU A 137 -6.969 0.152 1.203 1.00 0.32 H new ATOM 0 HD12 LEU A 137 -7.031 1.534 2.323 1.00 0.32 H new ATOM 0 HD13 LEU A 137 -5.591 0.490 2.278 1.00 0.32 H new ATOM 0 HD21 LEU A 137 -7.155 -2.156 2.057 1.00 0.27 H new ATOM 0 HD22 LEU A 137 -5.783 -1.906 3.164 1.00 0.27 H new ATOM 0 HD23 LEU A 137 -7.352 -2.457 3.800 1.00 0.27 H new ATOM 2149 N ALA A 138 -6.031 -1.321 7.620 1.00 0.20 N ATOM 2150 CA ALA A 138 -5.274 -1.154 8.853 1.00 0.21 C ATOM 2151 C ALA A 138 -3.962 -1.927 8.789 1.00 0.22 C ATOM 2152 O ALA A 138 -3.738 -2.713 7.866 1.00 0.30 O ATOM 2153 CB ALA A 138 -6.098 -1.614 10.048 1.00 0.20 C ATOM 0 H ALA A 138 -5.932 -2.241 7.191 1.00 0.20 H new ATOM 0 HA ALA A 138 -5.045 -0.095 8.972 1.00 0.21 H new ATOM 0 HB1 ALA A 138 -5.518 -1.483 10.962 1.00 0.20 H new ATOM 0 HB2 ALA A 138 -7.011 -1.022 10.110 1.00 0.20 H new ATOM 0 HB3 ALA A 138 -6.355 -2.667 9.929 1.00 0.20 H new ATOM 2159 N LEU A 139 -3.098 -1.701 9.771 1.00 0.19 N ATOM 2160 CA LEU A 139 -1.808 -2.378 9.827 1.00 0.21 C ATOM 2161 C LEU A 139 -1.941 -3.743 10.494 1.00 0.22 C ATOM 2162 O LEU A 139 -2.121 -3.837 11.709 1.00 0.28 O ATOM 2163 CB LEU A 139 -0.791 -1.519 10.583 1.00 0.23 C ATOM 2164 CG LEU A 139 -0.448 -0.187 9.914 1.00 0.30 C ATOM 2165 CD1 LEU A 139 0.454 0.645 10.812 1.00 0.62 C ATOM 2166 CD2 LEU A 139 0.211 -0.422 8.562 1.00 0.82 C ATOM 0 H LEU A 139 -3.267 -1.053 10.540 1.00 0.19 H new ATOM 0 HA LEU A 139 -1.456 -2.527 8.806 1.00 0.21 H new ATOM 0 HB2 LEU A 139 -1.178 -1.318 11.582 1.00 0.23 H new ATOM 0 HB3 LEU A 139 0.127 -2.094 10.707 1.00 0.23 H new ATOM 0 HG LEU A 139 -1.374 0.365 9.753 1.00 0.30 H new ATOM 0 HD11 LEU A 139 0.687 1.589 10.319 1.00 0.62 H new ATOM 0 HD12 LEU A 139 -0.055 0.844 11.755 1.00 0.62 H new ATOM 0 HD13 LEU A 139 1.377 0.099 11.006 1.00 0.62 H new ATOM 0 HD21 LEU A 139 0.448 0.537 8.101 1.00 0.82 H new ATOM 0 HD22 LEU A 139 1.128 -0.995 8.699 1.00 0.82 H new ATOM 0 HD23 LEU A 139 -0.470 -0.976 7.917 1.00 0.82 H new ATOM 2178 N ILE A 140 -1.850 -4.799 9.690 1.00 0.18 N ATOM 2179 CA ILE A 140 -1.967 -6.161 10.199 1.00 0.19 C ATOM 2180 C ILE A 140 -0.612 -6.863 10.199 1.00 0.25 C ATOM 2181 O ILE A 140 0.060 -6.938 9.172 1.00 0.31 O ATOM 2182 CB ILE A 140 -2.966 -6.987 9.362 1.00 0.19 C ATOM 2183 CG1 ILE A 140 -4.300 -6.245 9.237 1.00 0.33 C ATOM 2184 CG2 ILE A 140 -3.177 -8.359 9.984 1.00 0.21 C ATOM 2185 CD1 ILE A 140 -5.307 -6.949 8.352 1.00 0.44 C ATOM 0 H ILE A 140 -1.696 -4.737 8.684 1.00 0.18 H new ATOM 0 HA ILE A 140 -2.335 -6.090 11.222 1.00 0.19 H new ATOM 0 HB ILE A 140 -2.550 -7.122 8.364 1.00 0.19 H new ATOM 0 HG12 ILE A 140 -4.729 -6.117 10.231 1.00 0.33 H new ATOM 0 HG13 ILE A 140 -4.115 -5.247 8.839 1.00 0.33 H new ATOM 0 HG21 ILE A 140 -3.884 -8.927 9.380 1.00 0.21 H new ATOM 0 HG22 ILE A 140 -2.226 -8.890 10.025 1.00 0.21 H new ATOM 0 HG23 ILE A 140 -3.572 -8.244 10.993 1.00 0.21 H new ATOM 0 HD11 ILE A 140 -6.226 -6.365 8.311 1.00 0.44 H new ATOM 0 HD12 ILE A 140 -4.898 -7.053 7.347 1.00 0.44 H new ATOM 0 HD13 ILE A 140 -5.522 -7.937 8.760 1.00 0.44 H new ATOM 2197 N LYS A 141 -0.220 -7.378 11.363 1.00 0.35 N ATOM 2198 CA LYS A 141 1.056 -8.074 11.503 1.00 0.44 C ATOM 2199 C LYS A 141 0.914 -9.550 11.146 1.00 0.32 C ATOM 2200 O LYS A 141 0.006 -10.232 11.623 1.00 0.50 O ATOM 2201 CB LYS A 141 1.581 -7.933 12.935 1.00 0.70 C ATOM 2202 CG LYS A 141 2.912 -8.625 13.169 1.00 0.79 C ATOM 2203 CD LYS A 141 3.328 -8.556 14.630 1.00 0.98 C ATOM 2204 CE LYS A 141 4.657 -9.256 14.863 1.00 1.45 C ATOM 2205 NZ LYS A 141 5.044 -9.251 16.301 1.00 2.04 N ATOM 0 H LYS A 141 -0.768 -7.326 12.222 1.00 0.35 H new ATOM 0 HA LYS A 141 1.767 -7.619 10.814 1.00 0.44 H new ATOM 0 HB2 LYS A 141 1.686 -6.874 13.171 1.00 0.70 H new ATOM 0 HB3 LYS A 141 0.843 -8.342 13.625 1.00 0.70 H new ATOM 0 HG2 LYS A 141 2.840 -9.668 12.859 1.00 0.79 H new ATOM 0 HG3 LYS A 141 3.679 -8.160 12.549 1.00 0.79 H new ATOM 0 HD2 LYS A 141 3.405 -7.514 14.939 1.00 0.98 H new ATOM 0 HD3 LYS A 141 2.559 -9.016 15.251 1.00 0.98 H new ATOM 0 HE2 LYS A 141 4.592 -10.285 14.508 1.00 1.45 H new ATOM 0 HE3 LYS A 141 5.433 -8.765 14.277 1.00 1.45 H new ATOM 0 HZ1 LYS A 141 5.956 -9.738 16.417 1.00 2.04 H new ATOM 0 HZ2 LYS A 141 5.131 -8.269 16.634 1.00 2.04 H new ATOM 0 HZ3 LYS A 141 4.316 -9.742 16.858 1.00 2.04 H new ATOM 2219 N VAL A 142 1.818 -10.036 10.300 1.00 0.35 N ATOM 2220 CA VAL A 142 1.800 -11.432 9.876 1.00 0.41 C ATOM 2221 C VAL A 142 3.215 -11.993 9.780 1.00 0.49 C ATOM 2222 O VAL A 142 4.056 -11.461 9.053 1.00 0.70 O ATOM 2223 CB VAL A 142 1.100 -11.601 8.512 1.00 0.56 C ATOM 2224 CG1 VAL A 142 1.118 -13.057 8.073 1.00 0.92 C ATOM 2225 CG2 VAL A 142 -0.328 -11.077 8.575 1.00 0.81 C ATOM 0 H VAL A 142 2.573 -9.483 9.894 1.00 0.35 H new ATOM 0 HA VAL A 142 1.241 -11.984 10.632 1.00 0.41 H new ATOM 0 HB VAL A 142 1.648 -11.017 7.773 1.00 0.56 H new ATOM 0 HG11 VAL A 142 0.619 -13.152 7.109 1.00 0.92 H new ATOM 0 HG12 VAL A 142 2.150 -13.397 7.983 1.00 0.92 H new ATOM 0 HG13 VAL A 142 0.598 -13.666 8.812 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -0.806 -11.205 7.604 1.00 0.81 H new ATOM 0 HG22 VAL A 142 -0.886 -11.631 9.329 1.00 0.81 H new ATOM 0 HG23 VAL A 142 -0.316 -10.019 8.837 1.00 0.81 H new ATOM 2235 N ASP A 143 3.473 -13.071 10.514 1.00 0.49 N ATOM 2236 CA ASP A 143 4.786 -13.708 10.504 1.00 0.57 C ATOM 2237 C ASP A 143 4.934 -14.621 9.293 1.00 0.84 C ATOM 2238 O ASP A 143 3.971 -15.255 8.858 1.00 1.02 O ATOM 2239 CB ASP A 143 4.999 -14.506 11.791 1.00 0.73 C ATOM 2240 CG ASP A 143 5.159 -13.615 13.007 1.00 1.51 C ATOM 2241 OD1 ASP A 143 4.130 -13.188 13.570 1.00 2.39 O ATOM 2242 OD2 ASP A 143 6.315 -13.343 13.396 1.00 1.78 O ATOM 0 H ASP A 143 2.790 -13.522 11.123 1.00 0.49 H new ATOM 0 HA ASP A 143 5.543 -12.926 10.443 1.00 0.57 H new ATOM 0 HB2 ASP A 143 4.152 -15.175 11.944 1.00 0.73 H new ATOM 0 HB3 ASP A 143 5.885 -15.132 11.684 1.00 0.73 H new ATOM 2247 N SER A 144 6.146 -14.683 8.752 1.00 1.03 N ATOM 2248 CA SER A 144 6.425 -15.512 7.584 1.00 1.43 C ATOM 2249 C SER A 144 6.463 -16.993 7.954 1.00 1.30 C ATOM 2250 O SER A 144 7.004 -17.370 8.993 1.00 1.83 O ATOM 2251 CB SER A 144 7.751 -15.098 6.946 1.00 2.21 C ATOM 2252 OG SER A 144 7.723 -13.741 6.540 1.00 3.06 O ATOM 0 H SER A 144 6.953 -14.168 9.104 1.00 1.03 H new ATOM 0 HA SER A 144 5.619 -15.362 6.865 1.00 1.43 H new ATOM 0 HB2 SER A 144 8.563 -15.251 7.657 1.00 2.21 H new ATOM 0 HB3 SER A 144 7.957 -15.734 6.085 1.00 2.21 H new ATOM 0 HG SER A 144 8.584 -13.502 6.137 1.00 3.06 H new ATOM 2258 N SER A 145 5.880 -17.824 7.089 1.00 1.31 N ATOM 2259 CA SER A 145 5.841 -19.272 7.301 1.00 1.34 C ATOM 2260 C SER A 145 5.015 -19.636 8.533 1.00 1.30 C ATOM 2261 O SER A 145 4.910 -20.810 8.890 1.00 1.61 O ATOM 2262 CB SER A 145 7.259 -19.834 7.435 1.00 1.94 C ATOM 2263 OG SER A 145 7.235 -21.241 7.594 1.00 2.25 O ATOM 0 H SER A 145 5.425 -17.516 6.229 1.00 1.31 H new ATOM 0 HA SER A 145 5.362 -19.718 6.430 1.00 1.34 H new ATOM 0 HB2 SER A 145 7.842 -19.574 6.551 1.00 1.94 H new ATOM 0 HB3 SER A 145 7.756 -19.376 8.290 1.00 1.94 H new ATOM 0 HG SER A 145 6.454 -21.497 8.128 1.00 2.25 H new ATOM 2269 N GLU A 146 4.430 -18.632 9.179 1.00 1.26 N ATOM 2270 CA GLU A 146 3.619 -18.863 10.370 1.00 1.51 C ATOM 2271 C GLU A 146 2.150 -18.544 10.107 1.00 1.43 C ATOM 2272 O GLU A 146 1.260 -19.274 10.543 1.00 1.95 O ATOM 2273 CB GLU A 146 4.135 -18.019 11.536 1.00 1.75 C ATOM 2274 CG GLU A 146 3.396 -18.271 12.841 1.00 1.72 C ATOM 2275 CD GLU A 146 3.534 -19.702 13.323 1.00 2.48 C ATOM 2276 OE1 GLU A 146 4.526 -19.999 14.023 1.00 3.04 O ATOM 2277 OE2 GLU A 146 2.651 -20.524 13.001 1.00 3.07 O ATOM 0 H GLU A 146 4.502 -17.654 8.899 1.00 1.26 H new ATOM 0 HA GLU A 146 3.699 -19.919 10.629 1.00 1.51 H new ATOM 0 HB2 GLU A 146 5.195 -18.225 11.682 1.00 1.75 H new ATOM 0 HB3 GLU A 146 4.049 -16.964 11.277 1.00 1.75 H new ATOM 0 HG2 GLU A 146 3.778 -17.595 13.607 1.00 1.72 H new ATOM 0 HG3 GLU A 146 2.340 -18.037 12.707 1.00 1.72 H new ATOM 2284 N ASN A 147 1.903 -17.449 9.392 1.00 1.13 N ATOM 2285 CA ASN A 147 0.539 -17.038 9.078 1.00 1.51 C ATOM 2286 C ASN A 147 0.416 -16.598 7.621 1.00 1.30 C ATOM 2287 O ASN A 147 -0.270 -15.624 7.311 1.00 1.68 O ATOM 2288 CB ASN A 147 0.099 -15.904 10.007 1.00 2.13 C ATOM 2289 CG ASN A 147 0.054 -16.333 11.461 1.00 2.99 C ATOM 2290 OD1 ASN A 147 -0.969 -16.817 11.945 1.00 3.45 O ATOM 2291 ND2 ASN A 147 1.165 -16.155 12.166 1.00 3.59 N ATOM 0 H ASN A 147 2.627 -16.833 9.021 1.00 1.13 H new ATOM 0 HA ASN A 147 -0.113 -17.898 9.230 1.00 1.51 H new ATOM 0 HB2 ASN A 147 0.785 -15.063 9.900 1.00 2.13 H new ATOM 0 HB3 ASN A 147 -0.887 -15.552 9.704 1.00 2.13 H new ATOM 0 HD21 ASN A 147 1.193 -16.423 13.150 1.00 3.59 H new ATOM 0 HD22 ASN A 147 1.990 -15.750 11.724 1.00 3.59 H new ATOM 2298 N LEU A 148 1.083 -17.326 6.729 1.00 0.97 N ATOM 2299 CA LEU A 148 1.047 -17.014 5.304 1.00 1.05 C ATOM 2300 C LEU A 148 -0.380 -17.059 4.770 1.00 0.99 C ATOM 2301 O LEU A 148 -0.691 -16.450 3.746 1.00 1.29 O ATOM 2302 CB LEU A 148 1.923 -17.998 4.522 1.00 1.08 C ATOM 2303 CG LEU A 148 3.421 -17.922 4.823 1.00 1.18 C ATOM 2304 CD1 LEU A 148 4.167 -19.025 4.087 1.00 1.72 C ATOM 2305 CD2 LEU A 148 3.974 -16.557 4.441 1.00 1.74 C ATOM 0 H LEU A 148 1.655 -18.136 6.968 1.00 0.97 H new ATOM 0 HA LEU A 148 1.434 -16.004 5.172 1.00 1.05 H new ATOM 0 HB2 LEU A 148 1.578 -19.011 4.731 1.00 1.08 H new ATOM 0 HB3 LEU A 148 1.774 -17.824 3.456 1.00 1.08 H new ATOM 0 HG LEU A 148 3.565 -18.063 5.894 1.00 1.18 H new ATOM 0 HD11 LEU A 148 5.231 -18.957 4.312 1.00 1.72 H new ATOM 0 HD12 LEU A 148 3.790 -19.996 4.408 1.00 1.72 H new ATOM 0 HD13 LEU A 148 4.015 -18.913 3.013 1.00 1.72 H new ATOM 0 HD21 LEU A 148 5.041 -16.522 4.662 1.00 1.74 H new ATOM 0 HD22 LEU A 148 3.819 -16.387 3.376 1.00 1.74 H new ATOM 0 HD23 LEU A 148 3.459 -15.783 5.011 1.00 1.74 H new ATOM 2317 N CYS A 149 -1.248 -17.782 5.471 1.00 0.81 N ATOM 2318 CA CYS A 149 -2.642 -17.908 5.066 1.00 0.79 C ATOM 2319 C CYS A 149 -3.486 -16.786 5.662 1.00 0.79 C ATOM 2320 O CYS A 149 -4.090 -16.946 6.724 1.00 1.26 O ATOM 2321 CB CYS A 149 -3.196 -19.266 5.498 1.00 0.77 C ATOM 2322 SG CYS A 149 -4.920 -19.543 5.025 1.00 1.73 S ATOM 0 H CYS A 149 -1.009 -18.290 6.323 1.00 0.81 H new ATOM 0 HA CYS A 149 -2.689 -17.833 3.980 1.00 0.79 H new ATOM 0 HB2 CYS A 149 -2.580 -20.053 5.063 1.00 0.77 H new ATOM 0 HB3 CYS A 149 -3.109 -19.355 6.581 1.00 0.77 H new ATOM 0 HG CYS A 149 -5.298 -20.718 5.432 1.00 1.73 H new ATOM 2328 N THR A 150 -3.522 -15.651 4.973 1.00 0.52 N ATOM 2329 CA THR A 150 -4.292 -14.501 5.429 1.00 0.47 C ATOM 2330 C THR A 150 -4.784 -13.670 4.248 1.00 0.37 C ATOM 2331 O THR A 150 -4.017 -12.928 3.638 1.00 0.35 O ATOM 2332 CB THR A 150 -3.459 -13.605 6.367 1.00 0.52 C ATOM 2333 OG1 THR A 150 -2.998 -14.365 7.490 1.00 0.83 O ATOM 2334 CG2 THR A 150 -4.281 -12.421 6.855 1.00 1.06 C ATOM 0 H THR A 150 -3.025 -15.503 4.094 1.00 0.52 H new ATOM 0 HA THR A 150 -5.150 -14.888 5.979 1.00 0.47 H new ATOM 0 HB THR A 150 -2.603 -13.228 5.807 1.00 0.52 H new ATOM 0 HG1 THR A 150 -2.097 -14.705 7.307 1.00 0.83 H new ATOM 0 HG21 THR A 150 -3.672 -11.803 7.515 1.00 1.06 H new ATOM 0 HG22 THR A 150 -4.607 -11.828 6.001 1.00 1.06 H new ATOM 0 HG23 THR A 150 -5.153 -12.783 7.399 1.00 1.06 H new ATOM 2342 N GLU A 151 -6.069 -13.799 3.936 1.00 0.38 N ATOM 2343 CA GLU A 151 -6.670 -13.065 2.826 1.00 0.34 C ATOM 2344 C GLU A 151 -6.612 -11.558 3.062 1.00 0.28 C ATOM 2345 O GLU A 151 -6.681 -10.770 2.118 1.00 0.28 O ATOM 2346 CB GLU A 151 -8.120 -13.507 2.628 1.00 0.46 C ATOM 2347 CG GLU A 151 -8.968 -13.387 3.883 1.00 1.22 C ATOM 2348 CD GLU A 151 -10.394 -13.858 3.671 1.00 1.34 C ATOM 2349 OE1 GLU A 151 -10.605 -15.084 3.569 1.00 1.46 O ATOM 2350 OE2 GLU A 151 -11.299 -13.000 3.606 1.00 1.95 O ATOM 0 H GLU A 151 -6.717 -14.407 4.437 1.00 0.38 H new ATOM 0 HA GLU A 151 -6.098 -13.289 1.926 1.00 0.34 H new ATOM 0 HB2 GLU A 151 -8.569 -12.907 1.837 1.00 0.46 H new ATOM 0 HB3 GLU A 151 -8.132 -14.543 2.289 1.00 0.46 H new ATOM 0 HG2 GLU A 151 -8.512 -13.971 4.682 1.00 1.22 H new ATOM 0 HG3 GLU A 151 -8.978 -12.348 4.212 1.00 1.22 H new ATOM 2357 N ASN A 152 -6.483 -11.163 4.324 1.00 0.27 N ATOM 2358 CA ASN A 152 -6.425 -9.751 4.682 1.00 0.28 C ATOM 2359 C ASN A 152 -5.208 -9.068 4.059 1.00 0.29 C ATOM 2360 O ASN A 152 -5.318 -7.969 3.514 1.00 0.32 O ATOM 2361 CB ASN A 152 -6.392 -9.592 6.204 1.00 0.37 C ATOM 2362 CG ASN A 152 -7.610 -10.200 6.871 1.00 0.53 C ATOM 2363 OD1 ASN A 152 -8.624 -9.527 7.068 1.00 1.30 O ATOM 2364 ND2 ASN A 152 -7.520 -11.477 7.222 1.00 1.29 N ATOM 0 H ASN A 152 -6.417 -11.802 5.117 1.00 0.27 H new ATOM 0 HA ASN A 152 -7.321 -9.270 4.289 1.00 0.28 H new ATOM 0 HB2 ASN A 152 -5.491 -10.064 6.597 1.00 0.37 H new ATOM 0 HB3 ASN A 152 -6.333 -8.533 6.456 1.00 0.37 H new ATOM 0 HD21 ASN A 152 -8.309 -11.939 7.674 1.00 1.29 H new ATOM 0 HD22 ASN A 152 -6.661 -11.997 7.040 1.00 1.29 H new ATOM 2371 N ILE A 153 -4.053 -9.723 4.139 1.00 0.31 N ATOM 2372 CA ILE A 153 -2.822 -9.164 3.584 1.00 0.37 C ATOM 2373 C ILE A 153 -2.692 -9.467 2.094 1.00 0.38 C ATOM 2374 O ILE A 153 -1.605 -9.373 1.524 1.00 0.71 O ATOM 2375 CB ILE A 153 -1.575 -9.697 4.318 1.00 0.42 C ATOM 2376 CG1 ILE A 153 -1.548 -11.228 4.293 1.00 0.40 C ATOM 2377 CG2 ILE A 153 -1.546 -9.179 5.749 1.00 0.48 C ATOM 2378 CD1 ILE A 153 -0.281 -11.823 4.868 1.00 0.48 C ATOM 0 H ILE A 153 -3.943 -10.636 4.580 1.00 0.31 H new ATOM 0 HA ILE A 153 -2.882 -8.085 3.724 1.00 0.37 H new ATOM 0 HB ILE A 153 -0.686 -9.335 3.802 1.00 0.42 H new ATOM 0 HG12 ILE A 153 -2.403 -11.607 4.852 1.00 0.40 H new ATOM 0 HG13 ILE A 153 -1.664 -11.568 3.264 1.00 0.40 H new ATOM 0 HG21 ILE A 153 -0.661 -9.562 6.257 1.00 0.48 H new ATOM 0 HG22 ILE A 153 -1.517 -8.089 5.741 1.00 0.48 H new ATOM 0 HG23 ILE A 153 -2.440 -9.514 6.275 1.00 0.48 H new ATOM 0 HD11 ILE A 153 -0.334 -12.911 4.817 1.00 0.48 H new ATOM 0 HD12 ILE A 153 0.578 -11.474 4.294 1.00 0.48 H new ATOM 0 HD13 ILE A 153 -0.173 -11.514 5.908 1.00 0.48 H new ATOM 2390 N LEU A 154 -3.807 -9.829 1.466 1.00 0.24 N ATOM 2391 CA LEU A 154 -3.815 -10.140 0.040 1.00 0.22 C ATOM 2392 C LEU A 154 -4.654 -9.127 -0.729 1.00 0.20 C ATOM 2393 O LEU A 154 -5.867 -9.034 -0.532 1.00 0.28 O ATOM 2394 CB LEU A 154 -4.352 -11.553 -0.199 1.00 0.23 C ATOM 2395 CG LEU A 154 -3.575 -12.673 0.497 1.00 0.28 C ATOM 2396 CD1 LEU A 154 -4.189 -14.026 0.176 1.00 0.30 C ATOM 2397 CD2 LEU A 154 -2.108 -12.646 0.089 1.00 0.35 C ATOM 0 H LEU A 154 -4.716 -9.914 1.921 1.00 0.24 H new ATOM 0 HA LEU A 154 -2.788 -10.088 -0.322 1.00 0.22 H new ATOM 0 HB2 LEU A 154 -5.389 -11.591 0.134 1.00 0.23 H new ATOM 0 HB3 LEU A 154 -4.354 -11.747 -1.272 1.00 0.23 H new ATOM 0 HG LEU A 154 -3.635 -12.511 1.573 1.00 0.28 H new ATOM 0 HD11 LEU A 154 -3.624 -14.811 0.679 1.00 0.30 H new ATOM 0 HD12 LEU A 154 -5.223 -14.047 0.519 1.00 0.30 H new ATOM 0 HD13 LEU A 154 -4.161 -14.192 -0.901 1.00 0.30 H new ATOM 0 HD21 LEU A 154 -1.575 -13.450 0.595 1.00 0.35 H new ATOM 0 HD22 LEU A 154 -2.028 -12.780 -0.990 1.00 0.35 H new ATOM 0 HD23 LEU A 154 -1.670 -11.688 0.369 1.00 0.35 H new ATOM 2409 N PHE A 155 -4.003 -8.369 -1.604 1.00 0.17 N ATOM 2410 CA PHE A 155 -4.688 -7.360 -2.404 1.00 0.18 C ATOM 2411 C PHE A 155 -4.704 -7.748 -3.878 1.00 0.17 C ATOM 2412 O PHE A 155 -3.828 -8.469 -4.352 1.00 0.20 O ATOM 2413 CB PHE A 155 -4.017 -5.996 -2.236 1.00 0.22 C ATOM 2414 CG PHE A 155 -4.283 -5.354 -0.905 1.00 0.24 C ATOM 2415 CD1 PHE A 155 -5.530 -4.829 -0.611 1.00 0.37 C ATOM 2416 CD2 PHE A 155 -3.285 -5.283 0.055 1.00 0.43 C ATOM 2417 CE1 PHE A 155 -5.778 -4.242 0.614 1.00 0.42 C ATOM 2418 CE2 PHE A 155 -3.527 -4.697 1.283 1.00 0.52 C ATOM 2419 CZ PHE A 155 -4.776 -4.157 1.552 1.00 0.42 C ATOM 0 H PHE A 155 -3.000 -8.434 -1.778 1.00 0.17 H new ATOM 0 HA PHE A 155 -5.717 -7.298 -2.050 1.00 0.18 H new ATOM 0 HB2 PHE A 155 -2.941 -6.112 -2.365 1.00 0.22 H new ATOM 0 HB3 PHE A 155 -4.363 -5.330 -3.027 1.00 0.22 H new ATOM 0 HD1 PHE A 155 -6.318 -4.879 -1.348 1.00 0.37 H new ATOM 0 HD2 PHE A 155 -2.308 -5.690 -0.159 1.00 0.43 H new ATOM 0 HE1 PHE A 155 -6.759 -3.849 0.836 1.00 0.42 H new ATOM 0 HE2 PHE A 155 -2.747 -4.660 2.030 1.00 0.52 H new ATOM 0 HZ PHE A 155 -4.962 -3.670 2.498 1.00 0.42 H new ATOM 2429 N LYS A 156 -5.709 -7.255 -4.593 1.00 0.18 N ATOM 2430 CA LYS A 156 -5.850 -7.538 -6.015 1.00 0.21 C ATOM 2431 C LYS A 156 -5.979 -6.243 -6.805 1.00 0.22 C ATOM 2432 O LYS A 156 -6.641 -5.301 -6.366 1.00 0.28 O ATOM 2433 CB LYS A 156 -7.071 -8.426 -6.262 1.00 0.24 C ATOM 2434 CG LYS A 156 -6.975 -9.793 -5.603 1.00 0.27 C ATOM 2435 CD LYS A 156 -8.297 -10.541 -5.673 1.00 0.40 C ATOM 2436 CE LYS A 156 -8.682 -10.873 -7.107 1.00 0.93 C ATOM 2437 NZ LYS A 156 -7.680 -11.758 -7.763 1.00 1.38 N ATOM 0 H LYS A 156 -6.440 -6.656 -4.209 1.00 0.18 H new ATOM 0 HA LYS A 156 -4.957 -8.065 -6.351 1.00 0.21 H new ATOM 0 HB2 LYS A 156 -7.961 -7.916 -5.893 1.00 0.24 H new ATOM 0 HB3 LYS A 156 -7.202 -8.558 -7.336 1.00 0.24 H new ATOM 0 HG2 LYS A 156 -6.198 -10.380 -6.092 1.00 0.27 H new ATOM 0 HG3 LYS A 156 -6.677 -9.675 -4.561 1.00 0.27 H new ATOM 0 HD2 LYS A 156 -8.225 -11.461 -5.093 1.00 0.40 H new ATOM 0 HD3 LYS A 156 -9.081 -9.937 -5.216 1.00 0.40 H new ATOM 0 HE2 LYS A 156 -9.657 -11.360 -7.117 1.00 0.93 H new ATOM 0 HE3 LYS A 156 -8.780 -9.950 -7.679 1.00 0.93 H new ATOM 0 HZ1 LYS A 156 -8.089 -12.164 -8.629 1.00 1.38 H new ATOM 0 HZ2 LYS A 156 -6.834 -11.204 -8.007 1.00 1.38 H new ATOM 0 HZ3 LYS A 156 -7.416 -12.525 -7.112 1.00 1.38 H new ATOM 2451 N LEU A 157 -5.340 -6.201 -7.970 1.00 0.25 N ATOM 2452 CA LEU A 157 -5.380 -5.021 -8.823 1.00 0.29 C ATOM 2453 C LEU A 157 -6.147 -5.302 -10.110 1.00 0.32 C ATOM 2454 O LEU A 157 -6.451 -6.452 -10.424 1.00 0.53 O ATOM 2455 CB LEU A 157 -3.959 -4.558 -9.153 1.00 0.39 C ATOM 2456 CG LEU A 157 -3.081 -4.229 -7.943 1.00 0.48 C ATOM 2457 CD1 LEU A 157 -1.666 -3.894 -8.386 1.00 0.58 C ATOM 2458 CD2 LEU A 157 -3.678 -3.078 -7.146 1.00 0.51 C ATOM 0 H LEU A 157 -4.788 -6.973 -8.344 1.00 0.25 H new ATOM 0 HA LEU A 157 -5.898 -4.230 -8.281 1.00 0.29 H new ATOM 0 HB2 LEU A 157 -3.467 -5.336 -9.737 1.00 0.39 H new ATOM 0 HB3 LEU A 157 -4.021 -3.674 -9.788 1.00 0.39 H new ATOM 0 HG LEU A 157 -3.041 -5.108 -7.299 1.00 0.48 H new ATOM 0 HD11 LEU A 157 -1.056 -3.663 -7.512 1.00 0.58 H new ATOM 0 HD12 LEU A 157 -1.238 -4.747 -8.912 1.00 0.58 H new ATOM 0 HD13 LEU A 157 -1.688 -3.031 -9.052 1.00 0.58 H new ATOM 0 HD21 LEU A 157 -3.040 -2.859 -6.290 1.00 0.51 H new ATOM 0 HD22 LEU A 157 -3.750 -2.195 -7.781 1.00 0.51 H new ATOM 0 HD23 LEU A 157 -4.672 -3.355 -6.796 1.00 0.51 H new ATOM 2470 N SER A 158 -6.457 -4.242 -10.849 1.00 0.41 N ATOM 2471 CA SER A 158 -7.187 -4.371 -12.103 1.00 0.48 C ATOM 2472 C SER A 158 -6.846 -3.219 -13.041 1.00 0.50 C ATOM 2473 O SER A 158 -7.178 -2.067 -12.766 1.00 0.69 O ATOM 2474 CB SER A 158 -8.693 -4.392 -11.846 1.00 0.57 C ATOM 2475 OG SER A 158 -9.407 -4.707 -13.029 1.00 1.47 O ATOM 0 H SER A 158 -6.213 -3.283 -10.600 1.00 0.41 H new ATOM 0 HA SER A 158 -6.892 -5.310 -12.571 1.00 0.48 H new ATOM 0 HB2 SER A 158 -8.923 -5.125 -11.072 1.00 0.57 H new ATOM 0 HB3 SER A 158 -9.015 -3.421 -11.471 1.00 0.57 H new ATOM 0 HG SER A 158 -10.368 -4.716 -12.838 1.00 1.47 H new ATOM 2481 N GLU A 159 -6.184 -3.535 -14.149 1.00 0.58 N ATOM 2482 CA GLU A 159 -5.807 -2.516 -15.118 1.00 0.66 C ATOM 2483 C GLU A 159 -7.037 -2.006 -15.862 1.00 0.60 C ATOM 2484 O GLU A 159 -7.378 -2.506 -16.935 1.00 0.73 O ATOM 2485 CB GLU A 159 -4.786 -3.073 -16.113 1.00 0.94 C ATOM 2486 CG GLU A 159 -3.450 -3.441 -15.485 1.00 1.13 C ATOM 2487 CD GLU A 159 -3.548 -4.637 -14.559 1.00 1.69 C ATOM 2488 OE1 GLU A 159 -3.458 -5.781 -15.053 1.00 2.11 O ATOM 2489 OE2 GLU A 159 -3.712 -4.430 -13.338 1.00 2.23 O ATOM 0 H GLU A 159 -5.900 -4.483 -14.396 1.00 0.58 H new ATOM 0 HA GLU A 159 -5.353 -1.684 -14.580 1.00 0.66 H new ATOM 0 HB2 GLU A 159 -5.206 -3.957 -16.593 1.00 0.94 H new ATOM 0 HB3 GLU A 159 -4.617 -2.334 -16.897 1.00 0.94 H new ATOM 0 HG2 GLU A 159 -2.729 -3.656 -16.274 1.00 1.13 H new ATOM 0 HG3 GLU A 159 -3.067 -2.586 -14.928 1.00 1.13 H new ATOM 2496 N THR A 160 -7.699 -1.007 -15.287 1.00 0.57 N ATOM 2497 CA THR A 160 -8.888 -0.426 -15.897 1.00 0.69 C ATOM 2498 C THR A 160 -8.542 0.843 -16.671 1.00 1.35 C ATOM 2499 O THR A 160 -8.519 1.928 -16.051 1.00 1.89 O ATOM 2500 CB THR A 160 -9.960 -0.096 -14.840 1.00 1.14 C ATOM 2501 OG1 THR A 160 -10.244 -1.259 -14.052 1.00 1.94 O ATOM 2502 CG2 THR A 160 -11.239 0.398 -15.498 1.00 1.98 C ATOM 2503 OXT THR A 160 -8.293 0.740 -17.891 1.00 2.15 O ATOM 0 H THR A 160 -7.431 -0.583 -14.399 1.00 0.57 H new ATOM 0 HA THR A 160 -9.288 -1.171 -16.585 1.00 0.69 H new ATOM 0 HB THR A 160 -9.572 0.695 -14.198 1.00 1.14 H new ATOM 0 HG1 THR A 160 -10.925 -1.042 -13.381 1.00 1.94 H new ATOM 0 HG21 THR A 160 -11.979 0.624 -14.730 1.00 1.98 H new ATOM 0 HG22 THR A 160 -11.027 1.299 -16.074 1.00 1.98 H new ATOM 0 HG23 THR A 160 -11.628 -0.374 -16.162 1.00 1.98 H new TER 2511 THR A 160